==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 06-OCT-09 3A8G . COMPND 2 MOLECULE: NITRILE HYDRATASE SUBUNIT ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOCOCCUS ERYTHROPOLIS; . AUTHOR Y.YAMANAKA,K.HASHIMOTO,A.OHTAKI,K.NOGUCHI,M.YOHDA,M.ODAKA . 409 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16741.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 259 63.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 6.8 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 . 24 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 110 26.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.4 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 3 2 2 2 2 2 0 2 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 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 PARALLEL BRIDGES PER LADDER . 3 0 2 1 0 0 1 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 . 1 0 0 0 0 0 1 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 9 A E 0 0 213 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 7.3 124.2 11.9 -4.5 2 10 A N + 0 0 124 1,-0.2 2,-0.0 0, 0.0 0, 0.0 0.517 360.0 152.5 65.7 12.9 121.3 13.5 -2.5 3 11 A A - 0 0 63 1,-0.1 -1,-0.2 0, 0.0 260,-0.1 -0.287 50.7 -99.6 -74.5 150.7 120.4 10.0 -1.0 4 12 A A - 0 0 60 1,-0.1 -1,-0.1 259,-0.1 2,-0.1 -0.468 41.1-107.4 -64.8 148.9 118.8 9.6 2.4 5 13 A P - 0 0 49 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.406 41.5 -93.2 -75.3 151.7 121.0 8.7 5.3 6 14 A A + 0 0 74 -2,-0.1 2,-0.3 295,-0.0 293,-0.0 -0.424 54.7 177.6 -61.1 130.2 120.8 5.2 6.7 7 15 A Q - 0 0 46 294,-0.1 294,-0.2 -2,-0.1 3,-0.1 -0.985 31.2-123.6-140.7 139.1 118.4 5.1 9.6 8 16 A A - 0 0 8 292,-2.7 5,-0.1 -2,-0.3 291,-0.1 -0.248 62.6 -69.5 -59.4 160.3 116.9 2.5 12.0 9 17 A P > - 0 0 83 0, 0.0 4,-2.0 0, 0.0 3,-0.3 -0.249 46.5-121.6 -54.0 141.2 113.1 2.3 11.9 10 18 A V H > S+ 0 0 33 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.874 111.3 56.0 -59.7 -36.4 111.6 5.5 13.4 11 19 A S H > S+ 0 0 45 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.922 107.9 49.7 -60.6 -39.7 109.7 3.5 16.0 12 20 A D H > S+ 0 0 76 -3,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.899 112.9 46.9 -64.7 -39.0 112.9 1.9 17.2 13 21 A R H X S+ 0 0 7 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.920 112.3 48.8 -66.3 -45.2 114.6 5.4 17.4 14 22 A A H X S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.939 114.6 44.3 -65.6 -42.7 111.7 7.0 19.2 15 23 A W H X S+ 0 0 74 -4,-2.6 4,-2.9 -5,-0.2 -1,-0.2 0.834 109.6 57.7 -70.2 -28.7 111.5 4.2 21.8 16 24 A A H X S+ 0 0 0 -4,-1.8 4,-2.7 -5,-0.3 -1,-0.2 0.914 106.2 49.3 -63.7 -40.0 115.3 4.2 22.1 17 25 A L H X S+ 0 0 1 -4,-2.2 4,-1.9 1,-0.2 5,-0.2 0.935 112.7 47.7 -63.5 -45.6 115.1 7.9 23.1 18 26 A F H X S+ 0 0 29 -4,-2.1 4,-3.2 1,-0.2 5,-0.3 0.940 114.3 45.4 -55.2 -54.2 112.4 7.0 25.7 19 27 A R H X S+ 0 0 110 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.880 109.2 55.4 -67.0 -34.9 114.4 4.1 27.1 20 28 A A H < S+ 0 0 4 -4,-2.7 4,-0.2 -5,-0.2 -1,-0.2 0.932 117.4 35.7 -59.1 -46.8 117.7 6.0 27.2 21 29 A L H ><>S+ 0 0 2 -4,-1.9 5,-1.9 -5,-0.2 3,-1.4 0.926 117.6 50.6 -73.1 -46.9 116.1 8.8 29.3 22 30 A D H ><5S+ 0 0 69 -4,-3.2 3,-2.0 1,-0.3 5,-0.2 0.889 104.7 58.4 -59.3 -39.1 113.8 6.6 31.4 23 31 A G T 3<5S+ 0 0 67 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.581 103.4 54.2 -69.2 -10.3 116.6 4.2 32.3 24 32 A K T < 5S- 0 0 100 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.242 119.0-109.3-103.9 5.2 118.4 7.2 33.9 25 33 A G T < 5S+ 0 0 69 -3,-2.0 -3,-0.2 2,-0.1 -2,-0.1 0.633 85.1 122.5 80.4 14.8 115.5 8.1 36.1 26 34 A L < + 0 0 55 -5,-1.9 -4,-0.2 1,-0.1 -3,-0.1 0.524 57.1 65.9 -93.8 -8.5 114.8 11.3 34.0 27 35 A V S S- 0 0 7 -6,-0.3 3,-0.1 -5,-0.2 -1,-0.1 -0.953 84.3-129.3-118.3 111.6 111.2 10.5 33.1 28 36 A P > - 0 0 54 0, 0.0 3,-2.2 0, 0.0 4,-0.3 -0.134 40.6 -81.0 -59.8 156.1 108.7 10.4 35.9 29 37 A D T 3 S+ 0 0 165 1,-0.3 -7,-0.0 2,-0.1 0, 0.0 -0.339 115.6 2.9 -52.9 133.0 106.4 7.4 36.3 30 38 A G T 3> S+ 0 0 45 -3,-0.1 4,-2.3 1,-0.1 -1,-0.3 0.524 93.4 129.2 70.8 4.1 103.4 7.8 33.9 31 39 A Y H <> S+ 0 0 32 -3,-2.2 4,-2.0 2,-0.2 5,-0.2 0.925 72.8 37.0 -65.6 -49.5 104.7 11.0 32.4 32 40 A V H > S+ 0 0 1 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.848 117.1 54.4 -73.7 -28.7 104.6 10.3 28.7 33 41 A E H > S+ 0 0 111 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.892 107.5 50.7 -65.3 -39.5 101.3 8.3 29.2 34 42 A G H X S+ 0 0 35 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.911 111.2 47.7 -64.3 -42.9 99.8 11.4 30.9 35 43 A W H X S+ 0 0 40 -4,-2.0 4,-2.9 1,-0.2 5,-0.2 0.925 108.3 54.9 -66.9 -41.7 100.9 13.7 28.1 36 44 A K H X S+ 0 0 37 -4,-2.5 4,-2.2 1,-0.2 5,-0.2 0.927 109.3 47.6 -57.4 -42.4 99.5 11.3 25.5 37 45 A K H X>S+ 0 0 122 -4,-2.0 4,-3.0 2,-0.2 5,-0.7 0.926 112.1 49.9 -66.0 -42.3 96.1 11.4 27.3 38 46 A T H X>S+ 0 0 37 -4,-2.4 5,-2.4 1,-0.2 4,-1.7 0.943 112.9 46.5 -56.9 -48.4 96.2 15.2 27.5 39 47 A F H <5S+ 0 0 1 -4,-2.9 75,-0.4 1,-0.2 -1,-0.2 0.856 121.0 37.4 -64.1 -36.6 97.0 15.5 23.8 40 48 A E H <5S+ 0 0 74 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.824 131.2 20.6 -84.0 -36.5 94.3 13.0 22.8 41 49 A E H <5S+ 0 0 118 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.766 126.8 35.0-112.2 -28.0 91.5 13.7 25.1 42 50 A D T <> - 0 0 27 66,-1.5 3,-1.7 -2,-0.6 4,-0.8 -0.992 62.6-129.4-156.1 141.8 90.4 19.6 21.4 45 53 A P H 3> S+ 0 0 24 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.642 103.1 78.3 -68.8 -11.3 88.7 21.8 18.8 46 54 A R H 3> S+ 0 0 107 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.833 91.8 53.9 -64.2 -26.7 85.5 21.0 20.7 47 55 A R H <> S+ 0 0 50 -3,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.947 108.3 46.0 -68.9 -50.7 86.8 23.7 23.2 48 56 A G H X S+ 0 0 0 63,-1.7 4,-2.4 -4,-0.8 -2,-0.2 0.912 110.7 54.6 -60.3 -36.5 87.2 26.3 20.5 49 57 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 62,-0.2 -1,-0.2 0.898 106.3 51.9 -61.8 -37.3 83.8 25.4 19.1 50 58 A E H X S+ 0 0 50 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.908 109.9 49.3 -62.7 -43.0 82.3 26.1 22.6 51 59 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.895 111.2 49.0 -64.1 -41.8 84.0 29.5 22.6 52 60 A V H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.932 111.0 49.2 -64.2 -47.2 82.7 30.4 19.2 53 61 A A H X S+ 0 0 0 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.887 111.4 49.9 -61.8 -36.4 79.1 29.4 20.1 54 62 A R H >X S+ 0 0 56 -4,-2.0 4,-1.3 -5,-0.2 3,-0.6 0.948 111.5 48.4 -63.6 -49.2 79.3 31.4 23.3 55 63 A A H 3< S+ 0 0 2 -4,-2.4 3,-0.5 1,-0.2 7,-0.3 0.916 109.2 53.9 -60.7 -39.0 80.6 34.4 21.3 56 64 A W H 3< S+ 0 0 23 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.788 119.1 32.9 -64.2 -29.3 77.8 34.0 18.7 57 65 A T H << S+ 0 0 53 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.442 117.2 55.0-107.9 -2.3 75.1 34.1 21.4 58 66 A D X - 0 0 39 -4,-1.3 4,-2.6 -3,-0.5 3,-0.3 -0.860 58.1-169.2-137.6 93.8 76.6 36.5 24.0 59 67 A P H > S+ 0 0 106 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.865 89.7 53.8 -58.6 -34.3 77.7 39.9 22.7 60 68 A E H > S+ 0 0 161 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.927 111.2 44.3 -66.2 -40.5 79.5 40.7 25.9 61 69 A F H > S+ 0 0 4 -3,-0.3 4,-3.4 2,-0.2 5,-0.2 0.904 110.1 57.0 -68.9 -38.7 81.6 37.5 25.7 62 70 A R H X S+ 0 0 66 -4,-2.6 4,-2.2 -7,-0.3 -2,-0.2 0.953 107.6 48.0 -54.5 -49.1 82.2 38.2 22.0 63 71 A Q H X S+ 0 0 121 -4,-2.4 4,-1.0 2,-0.2 -1,-0.2 0.895 112.8 47.9 -61.0 -41.2 83.7 41.5 22.8 64 72 A L H >X S+ 0 0 46 -4,-1.9 4,-3.4 2,-0.2 3,-0.8 0.956 110.1 51.6 -64.3 -47.6 85.9 40.0 25.5 65 73 A L H 3< S+ 0 0 0 -4,-3.4 23,-0.7 1,-0.2 -2,-0.2 0.877 113.4 46.1 -55.7 -35.6 87.1 37.2 23.3 66 74 A L H 3< S+ 0 0 41 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.639 122.7 33.5 -85.7 -14.0 88.1 39.7 20.6 67 75 A T H << S+ 0 0 92 -4,-1.0 -2,-0.2 -3,-0.8 -3,-0.2 0.692 137.2 14.4-109.9 -30.7 89.8 42.2 22.9 68 76 A D X + 0 0 77 -4,-3.4 4,-2.0 -5,-0.2 3,-0.2 -0.589 65.4 170.5-144.1 77.3 91.4 39.9 25.5 69 77 A G H > S+ 0 0 3 17,-0.4 4,-2.7 1,-0.2 5,-0.2 0.870 77.5 58.6 -61.7 -33.9 91.2 36.3 24.2 70 78 A T H > S+ 0 0 29 16,-0.8 4,-2.6 1,-0.2 -1,-0.2 0.933 107.7 46.1 -58.9 -45.1 93.4 35.0 27.0 71 79 A A H > S+ 0 0 32 -3,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.908 112.7 50.4 -66.6 -39.4 90.9 36.2 29.6 72 80 A A H X S+ 0 0 0 -4,-2.0 4,-0.6 -8,-0.3 3,-0.4 0.932 112.9 45.2 -63.3 -46.9 88.0 34.8 27.7 73 81 A V H ><>S+ 0 0 0 -4,-2.7 5,-1.9 1,-0.2 3,-1.2 0.888 108.0 59.1 -65.4 -38.0 89.6 31.4 27.3 74 82 A A H ><5S+ 0 0 45 -4,-2.6 3,-1.0 1,-0.3 -1,-0.2 0.798 93.4 65.2 -61.1 -30.5 90.7 31.5 31.0 75 83 A Q H 3<5S+ 0 0 121 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.826 107.8 42.2 -61.7 -27.4 87.0 31.8 32.1 76 84 A Y T <<5S- 0 0 50 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.495 114.8-118.9 -91.8 -8.2 86.5 28.3 30.6 77 85 A G T < 5S+ 0 0 56 -3,-1.0 -3,-0.2 -4,-0.5 -2,-0.1 0.749 74.4 128.9 76.0 25.3 89.8 27.0 32.0 78 86 A Y < + 0 0 41 -5,-1.9 -4,-0.2 -31,-0.1 2,-0.1 0.292 26.0 118.8-105.0 16.9 91.2 26.2 28.6 79 87 A L + 0 0 71 -6,-0.2 5,-0.2 -5,-0.1 3,-0.0 -0.430 39.4 131.1 -69.8 152.8 94.6 28.0 28.8 80 88 A G B > -A 83 0A 15 3,-1.3 3,-1.8 -2,-0.1 31,-0.1 -0.985 56.3 -27.2-177.9-176.3 97.5 25.5 28.4 81 89 A P T 3 S+ 0 0 41 0, 0.0 28,-0.0 0, 0.0 0, 0.0 -0.241 130.7 10.7 -52.4 134.0 100.8 24.7 26.7 82 90 A Q T 3 S+ 0 0 27 27,-0.1 27,-0.8 26,-0.1 25,-0.1 0.774 126.2 70.4 60.2 30.6 100.9 26.4 23.3 83 91 A G B < +A 80 0A 2 -3,-1.8 -3,-1.3 25,-0.2 3,-0.2 -0.055 54.8 108.9-166.4 45.0 97.8 28.3 24.3 84 92 A E S S+ 0 0 141 73,-0.3 2,-0.7 1,-0.3 74,-0.1 0.783 81.5 41.8 -97.4 -36.7 98.7 30.8 27.0 85 93 A Y E S-b 158 0B 19 72,-0.5 74,-2.6 2,-0.0 2,-0.4 -0.911 81.2-171.8-114.6 103.7 98.4 34.1 25.0 86 94 A I E -b 159 0B 3 -2,-0.7 -16,-0.8 72,-0.2 2,-0.4 -0.836 15.8-177.3-106.8 133.4 95.3 33.8 22.8 87 95 A V E -b 160 0B 24 72,-2.1 74,-1.8 -2,-0.4 2,-0.4 -0.993 11.3-157.6-123.1 124.7 94.1 36.2 20.1 88 96 A A E -b 161 0B 6 -23,-0.7 2,-0.5 -2,-0.4 74,-0.2 -0.855 10.5-151.6 -96.4 137.3 90.8 35.5 18.3 89 97 A V E -b 162 0B 8 72,-2.4 74,-2.9 -2,-0.4 2,-0.5 -0.924 12.0-132.4-117.9 129.6 90.4 37.1 14.9 90 98 A E E -b 163 0B 82 -2,-0.5 2,-0.2 72,-0.2 72,-0.1 -0.676 6.5-146.8 -92.0 122.9 87.0 38.0 13.6 91 99 A D + 0 0 6 72,-2.5 5,-0.2 -2,-0.5 -1,-0.0 -0.534 24.9 179.9 -73.0 150.8 85.7 37.2 10.1 92 100 A T B > -C 95 0C 35 3,-2.2 3,-1.7 -2,-0.2 73,-0.1 -0.847 48.4 -84.2-141.5 174.4 83.4 39.8 8.6 93 101 A P T 3 S+ 0 0 101 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 0.699 132.4 33.8 -59.8 -15.4 81.4 40.2 5.4 94 102 A T T 3 S+ 0 0 92 1,-0.1 54,-2.2 53,-0.1 2,-0.4 0.248 114.9 61.2-121.2 16.4 84.6 41.7 3.9 95 103 A L E < -Cd 92 148C 23 -3,-1.7 -3,-2.2 52,-0.2 2,-0.5 -0.974 48.7-174.0-151.9 126.9 87.3 39.7 5.7 96 104 A K E - d 0 149C 8 52,-2.9 54,-2.6 -2,-0.4 2,-0.3 -0.994 16.8-155.2-118.9 123.6 88.3 36.0 5.9 97 105 A N E - d 0 150C 2 -2,-0.5 2,-0.3 52,-0.2 54,-0.2 -0.729 11.3-177.7 -99.1 146.8 91.1 35.0 8.3 98 106 A V E - d 0 151C 0 52,-2.1 54,-3.0 -2,-0.3 2,-0.4 -0.990 13.4-144.1-143.0 141.7 93.4 32.0 8.0 99 107 A I E + d 0 152C 4 89,-2.3 2,-0.3 -2,-0.3 54,-0.2 -0.866 24.3 157.1-113.2 145.6 96.1 30.7 10.4 100 108 A V E - d 0 153C 0 52,-2.3 54,-3.0 -2,-0.4 2,-0.4 -0.948 36.5-140.9-147.7 165.1 99.4 29.0 9.6 101 109 A C > - 0 0 0 18,-0.4 3,-0.9 -2,-0.3 52,-0.1 -0.888 22.2-178.5-123.8 94.1 102.9 28.4 11.1 102 110 A S T 3 S+ 0 0 0 -2,-0.4 103,-0.7 1,-0.2 -1,-0.1 0.815 80.2 50.6 -64.6 -26.9 105.1 28.7 8.0 103 111 A L T 3 S- 0 0 4 51,-0.1 -1,-0.2 101,-0.1 2,-0.1 0.588 135.8 -37.6 -86.3 -13.7 108.2 28.0 10.1 104 112 A X S < S- 0 0 9 -3,-0.9 -3,-0.2 2,-0.1 21,-0.1 -0.205 89.5 -62.2-172.8 -93.7 106.9 24.7 11.8 105 113 A A + 0 0 2 49,-0.2 -3,-0.1 -5,-0.1 15,-0.1 0.308 55.5 170.8-166.1 7.0 103.4 24.0 13.1 106 114 A X + 0 0 10 48,-0.2 2,-0.3 14,-0.0 48,-0.2 -0.031 14.0 158.4 -44.6 130.5 102.5 26.4 15.8 107 115 A T - 0 0 7 -25,-0.1 2,-2.1 52,-0.1 54,-0.1 -0.966 55.8 -98.8-155.4 147.1 98.9 26.1 16.8 108 116 A A >> - 0 0 1 52,-0.6 4,-2.4 -2,-0.3 3,-1.2 -0.504 48.2-174.5 -73.3 77.6 96.7 27.0 19.8 109 117 A W H 3> + 0 0 12 -2,-2.1 4,-2.1 -27,-0.8 -1,-0.2 0.813 69.2 53.3 -50.1 -48.3 96.8 23.4 21.0 110 118 A P H 34 S+ 0 0 1 0, 0.0 -66,-1.5 0, 0.0 -1,-0.3 0.803 122.4 27.3 -66.8 -26.8 94.4 23.5 24.0 111 119 A I H <4 S+ 0 0 0 -3,-1.2 -63,-1.7 -68,-0.2 -62,-0.2 0.567 132.7 32.4-112.8 -14.2 91.4 24.9 22.0 112 120 A L H < S- 0 0 5 -4,-2.4 -3,-0.2 -65,-0.1 76,-0.1 0.531 104.7-123.9-108.4 -13.7 92.1 23.7 18.5 113 121 A G < - 0 0 3 -4,-2.1 -69,-0.2 -5,-0.5 -2,-0.1 -0.012 50.8 -44.1 79.5 163.1 93.8 20.4 19.3 114 122 A L S S- 0 0 11 -75,-0.4 -6,-0.1 -71,-0.4 0, 0.0 -0.298 79.6 -92.1 -57.1 148.3 97.2 19.4 18.0 115 123 A P - 0 0 5 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.310 40.1-120.4 -67.6 147.9 97.6 20.3 14.4 116 124 A P >> - 0 0 10 0, 0.0 4,-1.3 0, 0.0 3,-1.1 -0.394 29.6 -99.9 -79.6 162.0 96.8 17.7 11.7 117 125 A T H >> S+ 0 0 94 1,-0.3 4,-0.5 105,-0.2 3,-0.5 0.866 120.2 56.3 -49.6 -43.7 99.3 16.4 9.2 118 126 A W H >4 S+ 0 0 5 1,-0.2 3,-0.8 2,-0.2 6,-0.4 0.839 103.8 52.4 -62.6 -34.1 98.0 18.7 6.4 119 127 A Y H <4 S+ 0 0 3 -3,-1.1 -18,-0.4 1,-0.2 -1,-0.2 0.813 111.8 47.5 -71.6 -28.9 98.5 21.9 8.5 120 128 A K H << S+ 0 0 11 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.466 90.4 118.0 -85.7 -3.8 102.1 20.8 9.1 121 129 A S S S+ 0 0 26 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.853 109.9 60.9 -61.6 -33.8 105.2 21.8 3.3 123 131 A E H > S+ 0 0 55 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.947 109.8 38.2 -60.2 -47.8 102.4 22.4 0.8 124 132 A Y H > S+ 0 0 0 -6,-0.4 4,-2.3 1,-0.2 5,-0.4 0.941 116.8 51.3 -69.7 -43.8 100.3 24.4 3.3 125 133 A R H < S+ 0 0 0 -4,-2.6 4,-0.3 1,-0.2 -1,-0.2 0.849 118.3 37.7 -61.0 -39.1 103.3 26.1 4.9 126 134 A A H < S+ 0 0 0 -4,-2.5 81,-2.4 -5,-0.2 4,-0.4 0.870 124.9 34.7 -76.9 -42.7 104.7 27.3 1.6 127 135 A R H >X S+ 0 0 10 -4,-2.2 4,-3.1 -5,-0.3 3,-0.8 0.841 99.7 65.4 -92.7 -38.5 101.5 28.1 -0.2 128 136 A V T 3< S+ 0 0 0 -4,-2.3 -1,-0.2 -5,-0.3 -3,-0.1 0.833 100.3 54.9 -65.7 -27.0 98.8 29.6 2.1 129 137 A V T 34 S+ 0 0 2 -5,-0.4 -1,-0.3 -4,-0.3 22,-0.1 0.841 121.4 29.3 -68.5 -32.1 100.9 32.7 2.8 130 138 A R T <4 S+ 0 0 44 -3,-0.8 263,-1.4 -4,-0.4 264,-0.7 0.778 137.1 18.9 -97.3 -36.8 101.2 33.6 -0.9 131 139 A E X + 0 0 55 -4,-3.1 4,-2.5 261,-0.2 5,-0.2 -0.375 66.7 151.8-135.9 61.5 98.1 32.1 -2.5 132 140 A P H > S+ 0 0 1 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.839 72.9 57.4 -65.1 -31.3 95.5 31.6 0.2 133 141 A R H > S+ 0 0 56 1,-0.2 4,-2.3 2,-0.2 10,-0.2 0.957 111.1 42.0 -67.4 -42.2 92.5 32.0 -2.1 134 142 A K H > S+ 0 0 106 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.903 114.6 51.8 -67.3 -41.6 93.7 29.2 -4.4 135 143 A V H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.961 112.4 45.2 -61.3 -47.9 94.7 27.0 -1.4 136 144 A L H X>S+ 0 0 0 -4,-2.7 5,-2.9 1,-0.2 4,-0.8 0.921 112.2 52.6 -61.9 -42.1 91.3 27.4 0.2 137 145 A S H ><5S+ 0 0 46 -4,-2.3 3,-1.3 -5,-0.2 -1,-0.2 0.939 109.2 48.2 -57.2 -49.6 89.5 26.8 -3.2 138 146 A E H 3<5S+ 0 0 47 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.830 109.4 54.6 -60.8 -30.2 91.4 23.6 -3.7 139 147 A M H 3<5S- 0 0 2 -4,-1.8 79,-3.2 -5,-0.2 -1,-0.3 0.587 129.9 -93.9 -79.4 -12.8 90.5 22.6 -0.1 140 148 A G T <<5S+ 0 0 56 -3,-1.3 2,-0.5 -4,-0.8 -3,-0.2 0.529 90.6 112.3 114.1 8.9 86.7 23.1 -0.8 141 149 A T < - 0 0 10 -5,-2.9 2,-0.6 -6,-0.2 -1,-0.2 -0.941 48.4-157.9-122.6 112.6 86.2 26.7 0.3 142 150 A E - 0 0 139 -2,-0.5 2,-0.6 -5,-0.1 -8,-0.1 -0.755 6.4-169.9 -90.5 124.4 85.4 29.4 -2.2 143 151 A I - 0 0 10 -2,-0.6 -6,-0.1 -10,-0.2 6,-0.1 -0.936 22.0-129.5-115.5 116.1 86.2 33.0 -1.0 144 152 A A > - 0 0 60 -2,-0.6 3,-2.0 1,-0.1 -11,-0.0 -0.204 20.0-112.9 -64.0 150.9 84.8 35.7 -3.3 145 153 A S T 3 S+ 0 0 103 1,-0.3 -1,-0.1 3,-0.0 -12,-0.0 0.689 112.5 71.8 -53.7 -20.5 87.0 38.5 -4.7 146 154 A D T 3 S+ 0 0 140 1,-0.1 2,-0.5 2,-0.1 -1,-0.3 0.505 89.2 78.5 -78.7 2.7 84.9 40.9 -2.6 147 155 A I S < S- 0 0 39 -3,-2.0 2,-0.3 -4,-0.1 -52,-0.2 -0.898 76.5-136.7-115.4 125.1 86.6 39.5 0.5 148 156 A E E -d 95 0C 74 -54,-2.2 -52,-2.9 -2,-0.5 2,-0.5 -0.575 18.6-146.2 -67.5 131.9 90.1 40.3 1.8 149 157 A I E -d 96 0C 0 -2,-0.3 247,-2.3 -54,-0.2 246,-1.1 -0.901 14.0-168.1 -95.9 133.7 92.0 37.2 2.9 150 158 A R E -de 97 396C 35 -54,-2.6 -52,-2.1 -2,-0.5 2,-0.5 -0.988 4.6-158.2-125.3 119.5 94.3 37.8 5.8 151 159 A V E -de 98 397C 1 245,-2.2 247,-3.0 -2,-0.5 2,-0.6 -0.871 3.7-154.0-100.4 126.2 96.8 35.1 6.8 152 160 A Y E -de 99 398C 22 -54,-3.0 -52,-2.3 -2,-0.5 2,-0.6 -0.896 7.4-155.0 -97.6 117.1 98.2 35.1 10.3 153 161 A D E -de 100 399C 0 245,-2.6 2,-1.8 -2,-0.6 247,-0.9 -0.849 13.7-138.3 -94.2 120.9 101.6 33.4 10.4 154 162 A T + 0 0 0 -54,-3.0 -48,-0.2 -2,-0.6 -49,-0.2 -0.561 47.8 146.1 -84.9 79.9 102.2 32.1 14.0 155 163 A T + 0 0 0 -2,-1.8 -1,-0.2 -54,-0.1 2,-0.1 0.480 62.6 16.5 -98.9 -7.2 105.8 33.2 14.3 156 164 A A S S- 0 0 4 2,-0.3 245,-0.1 -3,-0.2 -2,-0.0 -0.166 109.3 -54.4-136.5-132.0 106.0 34.0 18.1 157 165 A E S S+ 0 0 42 -2,-0.1 -72,-0.5 2,-0.1 -73,-0.3 0.609 91.1 107.9-102.6 -10.3 103.9 33.3 21.2 158 166 A T E -b 85 0B 0 -74,-0.1 2,-0.5 -72,-0.1 -2,-0.3 -0.480 54.7-158.4 -60.2 135.8 100.5 34.6 20.1 159 167 A R E -b 86 0B 2 -74,-2.6 -72,-2.1 -2,-0.1 2,-0.3 -0.985 13.9-151.5-121.2 126.5 98.2 31.6 19.5 160 168 A Y E -b 87 0B 3 -2,-0.5 -52,-0.6 -74,-0.2 2,-0.3 -0.614 21.4-177.6-107.2 153.1 95.2 32.2 17.3 161 169 A M E -b 88 0B 0 -74,-1.8 -72,-2.4 -2,-0.3 2,-0.4 -0.990 27.0-126.0-136.0 146.6 91.7 31.1 16.7 162 170 A V E -b 89 0B 0 25,-2.4 -72,-0.2 -2,-0.3 27,-0.1 -0.771 8.1-152.2 -88.2 134.1 89.3 32.3 14.0 163 171 A L E -b 90 0B 1 -74,-2.9 -72,-2.5 -2,-0.4 -66,-0.1 -0.898 27.0-153.9 -95.8 98.2 85.9 33.5 15.0 164 172 A P - 0 0 1 0, 0.0 2,-0.1 0, 0.0 28,-0.1 -0.309 23.2 -91.7 -73.1 164.5 84.0 32.6 11.8 165 173 A Q - 0 0 93 -73,-0.1 -73,-0.1 1,-0.1 -109,-0.0 -0.405 43.3-111.8 -68.1 147.3 80.8 34.5 10.7 166 174 A R - 0 0 81 -2,-0.1 -1,-0.1 -3,-0.1 2,-0.1 -0.729 37.2-125.7 -81.0 124.2 77.6 32.9 12.0 167 175 A P > - 0 0 30 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 -0.329 20.5-104.2 -75.7 152.1 75.7 31.4 9.0 168 176 A A T 3 S+ 0 0 80 1,-0.2 27,-0.1 2,-0.1 0, 0.0 -0.301 103.5 50.0 -60.0 151.3 72.2 32.2 8.2 169 177 A G T 3 S+ 0 0 42 4,-0.0 -1,-0.2 26,-0.0 0, 0.0 0.440 89.3 87.3 95.2 -1.8 69.7 29.5 9.1 170 178 A T X + 0 0 2 -3,-1.0 3,-2.2 -4,-0.1 -2,-0.1 0.225 51.4 142.1-112.0 13.3 71.0 29.2 12.7 171 179 A E T 3 S+ 0 0 139 1,-0.3 -3,-0.0 -4,-0.0 0, 0.0 -0.347 76.3 7.7 -60.6 131.8 68.9 31.9 14.3 172 180 A G T 3 S+ 0 0 78 1,-0.3 -1,-0.3 -2,-0.1 -2,-0.0 0.381 90.8 149.0 77.7 -0.7 67.8 30.8 17.7 173 181 A W < - 0 0 67 -3,-2.2 -1,-0.3 1,-0.1 -3,-0.1 -0.257 49.3-111.7 -60.4 151.5 70.0 27.7 17.9 174 182 A S > - 0 0 47 1,-0.1 4,-2.5 4,-0.0 5,-0.2 -0.314 28.2-105.5 -75.4 163.3 71.2 26.6 21.2 175 183 A Q H > S+ 0 0 73 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.925 123.1 53.1 -56.5 -40.3 75.0 26.8 22.1 176 184 A E H > S+ 0 0 134 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.924 109.0 47.7 -62.4 -43.2 75.1 23.0 21.7 177 185 A Q H > S+ 0 0 87 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.892 114.3 47.2 -62.7 -40.9 73.6 23.1 18.2 178 186 A L H >X S+ 0 0 0 -4,-2.5 3,-1.1 1,-0.2 4,-0.6 0.910 106.0 58.4 -66.9 -42.0 76.0 25.9 17.2 179 187 A Q H >< S+ 0 0 50 -4,-2.9 3,-1.4 1,-0.3 -1,-0.2 0.892 96.6 64.0 -55.4 -35.4 79.0 24.1 18.6 180 188 A E H 3< S+ 0 0 141 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.821 102.4 46.8 -65.5 -30.0 78.4 21.1 16.3 181 189 A I H << S+ 0 0 19 -3,-1.1 2,-0.9 -4,-0.6 13,-0.5 0.540 90.5 89.7 -92.3 0.0 78.9 23.1 13.1 182 190 A V << - 0 0 0 -3,-1.4 2,-0.2 -4,-0.6 -133,-0.1 -0.818 65.1-176.7 -95.5 104.7 82.1 24.8 14.3 183 191 A T >> - 0 0 33 -2,-0.9 4,-1.9 1,-0.1 3,-0.6 -0.481 42.7-100.1 -97.5 169.4 84.8 22.3 13.2 184 192 A K H 3> S+ 0 0 29 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.909 124.5 54.1 -49.9 -44.4 88.6 22.3 13.6 185 193 A D H 3>>S+ 0 0 4 1,-0.2 4,-1.8 2,-0.2 6,-1.5 0.803 104.2 54.4 -69.4 -26.8 88.9 23.6 10.1 186 194 A C H <45S+ 0 0 0 -3,-0.6 -1,-0.2 4,-0.2 -2,-0.2 0.888 108.3 49.6 -67.5 -36.6 86.6 26.5 10.9 187 195 A L H <5S+ 0 0 0 -4,-1.9 -25,-2.4 1,-0.2 -2,-0.2 0.826 112.5 46.3 -70.3 -35.0 88.9 27.5 13.9 188 196 A I H <5S- 0 0 6 -4,-1.9 -89,-2.3 -5,-0.2 -1,-0.2 0.820 116.0-121.3 -73.0 -33.6 92.0 27.3 11.7 189 197 A G T <5S+ 0 0 0 -4,-1.8 -3,-0.2 -91,-0.2 -4,-0.1 0.397 85.1 106.3 112.8 -0.8 90.2 29.3 9.1 190 198 A V S - 0 0 19 -2,-2.1 3,-2.0 1,-0.1 58,-0.1 -0.288 65.4 -98.8 -88.7 174.1 117.2 27.2 6.1 202 4 B V T 3 S+ 0 0 58 1,-0.3 -1,-0.1 56,-0.2 56,-0.0 0.731 115.5 74.4 -69.2 -15.7 114.9 25.1 4.0 203 5 B H T 3 S+ 0 0 6 55,-0.2 2,-1.9 1,-0.2 -1,-0.3 0.665 72.7 86.8 -65.3 -18.4 112.4 25.3 6.9 204 6 B D < + 0 0 25 -3,-2.0 -1,-0.2 1,-0.2 -101,-0.1 -0.588 56.7 152.2 -84.6 78.5 111.7 28.9 5.9 205 7 B L > + 0 0 7 -2,-1.9 3,-2.6 -103,-0.7 -1,-0.2 0.638 16.6 119.8 -88.5 -21.5 109.1 27.7 3.4 206 8 B A T 3 S+ 0 0 10 1,-0.3 -80,-0.2 -3,-0.2 137,-0.2 -0.297 86.5 13.9 -57.8 130.7 106.6 30.5 3.1 207 9 B G T 3 S+ 0 0 8 -81,-2.4 -1,-0.3 1,-0.3 -81,-0.1 0.252 86.8 140.4 91.0 -12.5 106.5 31.7 -0.5 208 10 B V < - 0 0 64 -3,-2.6 -1,-0.3 -83,-0.1 2,-0.3 -0.448 41.6-145.2 -64.1 137.7 108.4 28.8 -2.0 209 11 B Q + 0 0 122 1,-0.1 -1,-0.0 -2,-0.1 -82,-0.0 -0.795 66.4 55.4-107.0 151.0 106.8 27.8 -5.3 210 12 B G + 0 0 83 1,-0.4 -1,-0.1 -2,-0.3 2,-0.1 0.212 67.2 126.6 114.2 -10.4 106.4 24.4 -6.9 211 13 B F - 0 0 58 -3,-0.3 -1,-0.4 1,-0.1 3,-0.1 -0.440 49.2-136.0 -73.8 152.7 104.5 22.5 -4.2 212 14 B G - 0 0 43 1,-0.2 -1,-0.1 -2,-0.1 -85,-0.1 0.137 47.3 -31.4 -85.0-156.2 101.3 20.7 -5.1 213 15 B K - 0 0 143 1,-0.1 -1,-0.2 -75,-0.0 -90,-0.1 -0.298 62.1-108.2 -64.7 143.8 97.9 20.5 -3.4 214 16 B V - 0 0 9 -91,-0.2 2,-2.4 1,-0.1 -1,-0.1 -0.544 37.5-118.3 -64.3 134.1 97.6 20.6 0.3 215 17 B P S S+ 0 0 81 0, 0.0 2,-0.3 0, 0.0 -97,-0.2 -0.284 83.8 70.2 -81.6 65.0 96.6 16.9 1.3 216 18 B H - 0 0 18 -2,-2.4 2,-0.3 -98,-0.1 -2,-0.1 -0.942 57.8-153.9-167.9 145.3 93.2 17.8 2.8 217 19 B T > - 0 0 81 -2,-0.3 3,-2.2 4,-0.1 -77,-0.2 -0.932 55.4 -72.2-121.1 155.6 89.8 18.9 1.9 218 20 B V T 3 S- 0 0 36 -79,-3.2 3,-0.1 -2,-0.3 -1,-0.0 -0.113 113.0 -2.2 -58.1 135.2 87.7 20.7 4.4 219 21 B N T 3 S+ 0 0 75 1,-0.2 -1,-0.3 -3,-0.0 3,-0.1 0.548 91.8 151.4 65.5 15.8 86.4 18.7 7.3 220 22 B A < - 0 0 40 -3,-2.2 2,-0.3 1,-0.1 -1,-0.2 -0.359 59.6 -82.8 -69.9 159.0 87.8 15.5 5.9 221 23 B D - 0 0 152 1,-0.2 -1,-0.1 -3,-0.1 -4,-0.1 -0.429 40.5-177.3 -62.0 122.4 88.8 12.8 8.3 222 24 B I - 0 0 62 1,-0.3 -105,-0.2 -2,-0.3 -1,-0.2 0.350 34.8-138.5 -98.4 2.0 92.2 13.4 9.8 223 25 B G - 0 0 28 -107,-0.1 -1,-0.3 4,-0.0 4,-0.1 -0.208 48.6 -18.3 72.9-167.1 92.2 10.1 11.8 224 26 B P - 0 0 85 0, 0.0 3,-0.1 0, 0.0 -184,-0.0 -0.168 67.3-106.9 -67.7 166.6 93.4 9.8 15.4 225 27 B T S S+ 0 0 54 1,-0.2 2,-0.5 -185,-0.1 -185,-0.0 0.939 112.1 35.4 -57.6 -48.1 95.7 12.4 17.0 226 28 B F - 0 0 12 1,-0.1 -1,-0.2 -190,-0.0 3,-0.1 -0.940 64.0-168.9-113.2 131.1 98.6 9.9 16.8 227 29 B H S S+ 0 0 108 -2,-0.5 2,-0.3 1,-0.1 -1,-0.1 0.447 77.2 35.9 -97.0 -2.4 98.8 7.6 13.8 228 30 B A S > S- 0 0 30 -217,-0.0 3,-1.5 1,-0.0 4,-0.3 -0.982 85.9-113.9-146.7 155.8 101.6 5.4 15.3 229 31 B E T 3 S+ 0 0 141 -2,-0.3 3,-0.2 1,-0.3 4,-0.0 0.619 113.1 49.4 -69.1 -13.4 102.2 4.2 18.9 230 32 B W T > S+ 0 0 22 1,-0.1 3,-2.2 2,-0.1 -1,-0.3 0.537 82.2 94.4 -95.8 -8.9 105.5 6.2 19.2 231 33 B E T < S+ 0 0 32 -3,-1.5 4,-0.4 1,-0.3 -1,-0.1 0.669 77.9 58.0 -70.8 -19.0 104.2 9.6 18.0 232 34 B H T 3> S+ 0 0 9 -4,-0.3 4,-2.0 -3,-0.2 -1,-0.3 0.599 90.9 79.3 -76.3 -12.6 103.4 11.1 21.4 233 35 B L H <> S+ 0 0 1 -3,-2.2 4,-3.1 1,-0.2 5,-0.4 0.920 82.9 55.5 -68.7 -45.3 107.0 10.6 22.5 234 36 B P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.945 115.3 37.6 -57.3 -45.8 108.7 13.6 20.9 235 37 B Y H > S+ 0 0 4 -4,-0.4 4,-2.6 2,-0.2 5,-0.2 0.934 117.6 51.1 -72.9 -37.2 106.5 16.2 22.5 236 38 B S H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.917 114.4 43.0 -62.7 -42.1 106.3 14.3 25.8 237 39 B L H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 -1,-0.2 0.813 109.8 57.6 -76.0 -28.1 110.1 14.0 26.0 238 40 B M H X S+ 0 0 13 -4,-2.2 4,-2.6 -5,-0.4 5,-0.2 0.938 108.2 47.4 -59.1 -47.9 110.5 17.6 24.9 239 41 B F H X>S+ 0 0 21 -4,-2.6 4,-2.7 1,-0.2 5,-0.9 0.895 108.5 54.1 -64.9 -36.0 108.3 18.6 27.9 240 42 B A H X>S+ 0 0 1 -4,-2.0 5,-3.1 1,-0.2 4,-1.4 0.952 111.4 47.0 -57.7 -46.4 110.4 16.3 30.1 241 43 B G H <5S+ 0 0 0 -4,-2.5 6,-2.3 3,-0.2 7,-0.7 0.892 121.2 34.5 -61.6 -42.7 113.5 18.2 28.9 242 44 B V H <5S+ 0 0 42 -4,-2.6 -2,-0.2 4,-0.2 -3,-0.2 0.965 131.0 25.2 -78.0 -49.9 112.0 21.7 29.3 243 45 B A H <5S+ 0 0 68 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.1 0.749 131.1 29.6 -97.1 -27.6 109.9 21.4 32.4 244 46 B E T < - 0 0 18 116,-0.3 4,-1.2 -2,-0.3 3,-0.2 -0.604 33.4-110.8 -93.0 165.5 114.0 25.7 26.0 250 52 B V H > S+ 0 0 33 1,-0.2 4,-2.3 -2,-0.2 3,-0.4 0.901 120.4 59.5 -60.6 -38.1 111.3 25.2 23.5 251 53 B D H > S+ 0 0 14 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.899 100.1 54.8 -59.4 -38.3 113.1 27.7 21.3 252 54 B E H > S+ 0 0 15 113,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.817 105.2 54.4 -63.7 -31.3 116.2 25.4 21.3 253 55 B V H X S+ 0 0 3 -4,-1.2 4,-1.9 -3,-0.4 -2,-0.2 0.929 108.1 48.2 -67.4 -44.4 113.8 22.6 20.0 254 56 B R H X S+ 0 0 15 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.955 114.3 47.3 -58.1 -45.6 112.7 24.7 17.1 255 57 B Y H X S+ 0 0 6 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.899 107.3 53.9 -68.0 -38.3 116.3 25.6 16.3 256 58 B V H < S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.884 108.9 50.1 -66.8 -31.9 117.6 22.0 16.5 257 59 B V H >< S+ 0 0 4 -4,-1.9 3,-1.8 1,-0.2 -1,-0.2 0.927 107.6 53.9 -66.5 -40.6 115.0 21.0 14.0 258 60 B E H 3< S+ 0 0 13 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.795 102.7 61.2 -57.8 -29.3 116.1 23.9 11.7 259 61 B R T 3< S+ 0 0 16 -4,-1.4 46,-2.4 -5,-0.1 -1,-0.3 0.453 73.6 119.2 -85.0 1.0 119.6 22.4 12.0 260 62 B M S < S- 0 0 5 -3,-1.8 44,-0.1 44,-0.3 5,-0.1 -0.367 86.0 -90.8 -55.5 144.6 118.7 19.1 10.4 261 63 B E > - 0 0 49 42,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.312 45.0-116.1 -54.9 141.0 120.7 18.6 7.3 262 64 B P H > S+ 0 0 60 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.864 112.2 44.4 -61.0 -43.6 118.5 20.1 4.6 263 65 B R H > S+ 0 0 127 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.892 113.8 53.1 -64.0 -37.8 117.8 17.0 2.5 264 66 B H H >> S+ 0 0 6 1,-0.2 4,-0.8 2,-0.2 3,-0.6 0.944 108.7 49.5 -61.5 -46.3 117.2 15.1 5.8 265 67 B Y H >< S+ 0 0 4 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.929 109.0 52.9 -54.4 -48.0 114.6 17.7 6.8 266 68 B M H 3< S+ 0 0 77 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.720 113.4 41.2 -68.4 -21.4 112.8 17.5 3.5 267 69 B M H << S+ 0 0 90 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.421 96.5 93.7-102.9 1.9 112.3 13.8 3.6 268 70 B T S << S- 0 0 6 -3,-1.1 5,-0.1 -4,-0.8 -4,-0.0 -0.819 74.3-122.2-103.8 128.2 111.4 13.4 7.3 269 71 B P > - 0 0 83 0, 0.0 4,-1.9 0, 0.0 3,-0.4 -0.244 34.4-103.6 -58.8 153.8 107.8 13.4 8.6 270 72 B Y H >> S+ 0 0 25 1,-0.2 4,-1.2 2,-0.2 3,-0.5 0.873 115.9 43.9 -47.3 -61.1 107.0 16.0 11.1 271 73 B Y H 3> S+ 0 0 13 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.875 111.1 56.5 -63.4 -31.9 106.9 14.0 14.4 272 74 B E H 3> S+ 0 0 17 -3,-0.4 4,-2.5 1,-0.2 -1,-0.3 0.858 98.8 60.8 -63.4 -36.4 110.2 12.2 13.4 273 75 B R H S+ 0 0 0 -4,-2.4 5,-2.1 2,-0.2 6,-1.8 0.871 112.7 43.4 -59.9 -40.4 120.0 15.4 24.8 283 85 B V H ><5S+ 0 0 40 -4,-1.9 3,-1.8 4,-0.2 -2,-0.2 0.932 114.2 49.1 -66.9 -49.5 123.4 14.5 23.2 284 86 B E H 3<5S+ 0 0 88 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.854 110.1 51.4 -61.7 -32.6 124.5 18.1 22.9 285 87 B K T 3<5S- 0 0 89 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.421 116.7-113.9 -84.3 -3.7 123.6 18.9 26.5 286 88 B G T < 5S+ 0 0 65 -3,-1.8 -3,-0.2 2,-0.3 -2,-0.1 0.601 87.2 112.6 86.7 10.6 125.6 15.8 27.8 287 89 B I S - 0 0 70 -2,-0.3 4,-1.9 1,-0.1 5,-0.1 -0.842 18.8-129.0-109.7 153.5 125.3 9.7 24.0 290 92 B Q H > S+ 0 0 72 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.885 109.0 61.4 -65.2 -35.4 124.8 8.9 20.4 291 93 B D H > S+ 0 0 118 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.916 105.9 44.4 -56.7 -46.7 126.4 5.5 21.1 292 94 B E H > S+ 0 0 40 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.900 111.6 52.9 -72.0 -31.6 123.7 4.6 23.5 293 95 B L H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.926 113.7 43.2 -61.8 -44.8 120.9 5.9 21.3 294 96 B E H X>S+ 0 0 65 -4,-2.8 4,-1.5 2,-0.2 5,-1.4 0.876 112.5 52.8 -70.6 -36.7 122.2 3.8 18.4 295 97 B S H <5S+ 0 0 82 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.948 114.2 42.2 -61.3 -46.3 122.7 0.7 20.6 296 98 B L H <5S+ 0 0 62 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.876 115.5 49.4 -66.4 -38.2 119.2 0.9 21.9 297 99 B A H <5S- 0 0 4 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.721 104.6-129.9 -73.5 -19.5 117.7 1.7 18.5 298 100 B G T <5S+ 0 0 69 -4,-1.5 -3,-0.2 1,-0.2 -4,-0.1 0.741 76.2 20.8 76.5 23.6 119.6 -1.2 16.9 299 101 B G S - 0 0 99 -2,-0.3 3,-2.2 1,-0.1 29,-0.3 -0.795 35.5 -84.0-110.7 154.7 101.8 51.8 19.0 323 125 B V T 3 S+ 0 0 100 -2,-0.3 29,-0.2 1,-0.3 3,-0.1 -0.306 116.8 27.2 -55.6 134.3 98.9 50.4 17.0 324 126 B G T 3 S+ 0 0 50 27,-2.8 -1,-0.3 1,-0.3 2,-0.1 0.187 90.3 128.6 93.2 -16.2 98.6 52.1 13.6 325 127 B Q < - 0 0 87 -3,-2.2 26,-2.7 26,-0.1 2,-0.4 -0.436 59.5-122.6 -73.2 152.4 102.4 52.9 13.4 326 128 B R E +F 350 0C 157 24,-0.2 83,-1.9 83,-0.1 2,-0.3 -0.774 35.7 177.9 -92.7 130.3 104.3 52.0 10.3 327 129 B V E -FG 349 408C 1 22,-2.6 22,-2.7 -2,-0.4 2,-0.4 -0.941 20.8-143.9-131.0 155.5 107.4 49.8 10.9 328 130 B R E -FG 348 407C 87 79,-2.6 79,-2.0 -2,-0.3 2,-0.5 -0.937 26.1-117.7-113.9 142.6 110.0 48.1 8.7 329 131 B V E - G 0 406C 1 18,-2.3 17,-1.1 15,-0.4 77,-0.3 -0.674 45.6-101.5 -77.8 126.2 111.4 44.7 9.5 330 132 B R - 0 0 40 75,-2.8 2,-1.8 -2,-0.5 16,-0.3 -0.183 25.9-125.4 -53.4 134.0 115.2 45.2 10.1 331 133 B D + 0 0 112 14,-0.2 2,-0.3 15,-0.1 -1,-0.1 -0.582 63.4 134.3 -84.1 77.2 117.3 44.3 7.0 332 134 B E - 0 0 66 -2,-1.8 2,-0.5 73,-0.1 14,-0.0 -0.913 49.7-141.5-132.4 151.0 119.5 41.9 9.0 333 135 B Y - 0 0 151 -2,-0.3 -2,-0.0 12,-0.0 0, 0.0 -0.978 16.2-172.8-121.0 126.0 120.8 38.4 8.4 334 136 B V - 0 0 14 -2,-0.5 -134,-0.1 2,-0.1 4,-0.1 -0.978 12.2-165.4-123.8 113.7 121.0 36.0 11.4 335 137 B P S S+ 0 0 86 0, 0.0 -27,-0.2 0, 0.0 -26,-0.1 0.759 76.0 54.5 -76.5 -24.7 122.7 32.6 10.9 336 138 B G S S- 0 0 0 1,-0.2 -2,-0.1 -28,-0.1 27,-0.1 -0.032 112.8 -36.1 -87.5-159.3 121.3 31.2 14.2 337 139 B H + 0 0 0 26,-0.2 2,-0.3 25,-0.1 -1,-0.2 -0.336 63.0 162.5 -67.9 141.4 117.7 31.0 15.3 338 140 B I - 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