==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-APR-07 2YXP . COMPND 2 MOLECULE: HALOALKANE DEHALOGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: XANTHOBACTER AUTOTROPHICUS; . AUTHOR X.LIU,L.HANSON,P.LANGAN,R.E.VIOLA . 310 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12501.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 214 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 22 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 16.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.3 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 0 1 1 2 1 1 1 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 1 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 . 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 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 1 X M 0 0 177 0, 0.0 2,-0.2 0, 0.0 32,-0.1 0.000 360.0 360.0 360.0 142.5 11.4 87.8 45.2 2 2 X I - 0 0 49 30,-0.6 2,-0.5 1,-0.1 29,-0.0 -0.620 360.0-106.4 -70.0 143.3 12.4 90.9 43.3 3 3 X N + 0 0 102 -2,-0.2 89,-2.5 88,-0.0 90,-0.5 -0.668 59.5 156.4 -77.8 118.9 9.5 92.0 41.0 4 4 X A E -A 91 0A 30 -2,-0.5 2,-0.3 87,-0.3 211,-0.1 -0.961 32.0-146.9-146.5 157.7 10.6 91.1 37.5 5 5 X I E -A 90 0A 49 85,-2.1 85,-2.9 -2,-0.3 2,-0.4 -0.831 14.8-133.3-126.6 164.9 9.3 90.3 34.0 6 6 X R - 0 0 117 -2,-0.3 83,-0.1 83,-0.2 81,-0.1 -0.969 19.8-120.0-126.7 130.3 10.6 88.1 31.2 7 7 X T - 0 0 10 -2,-0.4 203,-0.1 81,-0.3 201,-0.0 -0.472 39.1-107.1 -70.2 129.8 10.9 88.9 27.5 8 8 X P > - 0 0 66 0, 0.0 3,-2.0 0, 0.0 4,-0.2 -0.338 22.9-128.0 -58.0 138.5 8.8 86.5 25.4 9 9 X D G > S+ 0 0 107 1,-0.3 3,-2.1 2,-0.2 4,-0.1 0.778 103.3 71.6 -63.0 -27.4 11.0 84.1 23.5 10 10 X Q G > S+ 0 0 146 1,-0.3 3,-1.6 2,-0.2 4,-0.3 0.759 82.4 72.7 -60.9 -21.8 9.4 85.0 20.1 11 11 X R G < S+ 0 0 99 -3,-2.0 -1,-0.3 1,-0.3 3,-0.2 0.747 98.8 47.7 -61.9 -21.7 11.3 88.3 20.3 12 12 X F G X S+ 0 0 15 -3,-2.1 3,-1.0 -4,-0.2 -1,-0.3 0.253 80.7 105.4-103.1 9.7 14.5 86.4 19.6 13 13 X S T < S+ 0 0 78 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.1 0.884 85.1 33.5 -57.7 -45.8 13.1 84.4 16.7 14 14 X N T 3 S+ 0 0 153 -4,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 -0.052 77.8 157.2-111.8 34.4 14.9 86.3 13.8 15 15 X L X - 0 0 34 -3,-1.0 2,-0.6 3,-0.1 3,-0.5 -0.284 42.7-120.5 -64.2 141.8 18.2 87.3 15.3 16 16 X D T 3 S- 0 0 60 185,-0.4 -1,-0.1 1,-0.2 -2,-0.0 -0.735 84.0 -16.5 -87.8 115.9 21.0 88.1 12.8 17 17 X Q T 3 S+ 0 0 140 -2,-0.6 -1,-0.2 1,-0.1 -2,-0.0 0.881 95.8 121.9 60.0 47.5 24.1 85.9 13.3 18 18 X Y < + 0 0 21 -3,-0.5 -3,-0.1 1,-0.1 -1,-0.1 -0.616 18.4 152.4-134.7 71.6 23.3 84.6 16.8 19 19 X P + 0 0 98 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.115 31.5 126.8 -86.8 20.8 23.2 80.8 16.4 20 20 X F - 0 0 16 1,-0.1 21,-0.1 21,-0.0 44,-0.0 -0.683 60.8-122.7 -91.8 128.8 24.3 80.2 20.1 21 21 X S - 0 0 77 -2,-0.4 19,-0.4 19,-0.1 2,-0.2 -0.382 28.7-110.9 -72.7 141.8 22.0 78.0 22.2 22 22 X P - 0 0 59 0, 0.0 2,-0.3 0, 0.0 17,-0.1 -0.455 29.7-173.6 -75.0 142.9 20.5 79.3 25.4 23 23 X N E -B 38 0B 48 15,-1.1 15,-2.3 -2,-0.2 2,-0.4 -0.967 10.2-158.5-128.1 145.6 21.5 78.2 28.9 24 24 X Y E -B 37 0B 65 -2,-0.3 2,-0.4 13,-0.2 13,-0.2 -0.966 15.8-166.9-131.3 144.6 19.7 79.3 32.0 25 25 X L E -B 36 0B 8 11,-2.3 11,-2.9 -2,-0.4 2,-0.3 -0.996 16.9-173.4-122.6 119.7 20.5 79.6 35.7 26 26 X D E +B 35 0B 95 -2,-0.4 9,-0.2 9,-0.2 -2,-0.0 -0.865 63.0 15.9-113.7 153.5 17.6 80.2 38.0 27 27 X D S S- 0 0 95 7,-1.3 -1,-0.2 4,-0.5 8,-0.1 0.868 72.2-178.6 53.2 44.0 17.6 80.9 41.7 28 28 X L > - 0 0 6 3,-0.5 3,-2.7 6,-0.5 6,-0.2 -0.402 51.4 -77.3 -51.7 145.9 21.3 81.7 41.9 29 29 X P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 79,-0.1 -0.367 124.5 16.8 -56.6 127.4 22.1 82.5 45.6 30 30 X G T 3 S+ 0 0 67 -3,-0.1 75,-0.1 -2,-0.1 -2,-0.1 0.277 115.8 76.8 91.3 -7.7 20.7 86.0 46.3 31 31 X Y X + 0 0 14 -3,-2.7 3,-1.5 3,-0.1 -4,-0.5 -0.466 63.7 177.3-130.3 58.2 18.6 86.0 43.2 32 32 X P T 3 S+ 0 0 70 0, 0.0 -30,-0.6 0, 0.0 3,-0.1 -0.407 70.1 12.1 -68.5 140.7 15.6 83.8 44.0 33 33 X G T 3 S+ 0 0 28 1,-0.2 2,-0.4 -32,-0.1 -29,-0.1 0.385 101.2 115.8 78.1 -2.7 12.9 83.6 41.3 34 34 X L < - 0 0 3 -3,-1.5 -7,-1.3 -6,-0.2 2,-0.5 -0.850 52.2-153.0-105.2 133.9 15.2 85.2 38.7 35 35 X R E -B 26 0B 48 -2,-0.4 54,-3.0 -9,-0.2 2,-0.4 -0.925 9.2-161.3-106.3 125.6 16.4 83.4 35.6 36 36 X A E -B 25 0B 1 -11,-2.9 -11,-2.3 -2,-0.5 2,-0.4 -0.888 7.2-144.9-105.9 137.1 19.7 84.4 34.0 37 37 X H E +B 24 0B 1 -2,-0.4 44,-2.7 44,-0.3 2,-0.3 -0.782 23.2 168.5 -97.9 141.9 20.7 83.6 30.5 38 38 X Y E -BC 23 80B 24 -15,-2.3 -15,-1.1 -2,-0.4 2,-0.3 -0.989 31.0-125.8-147.9 150.2 24.2 82.8 29.4 39 39 X L E - C 0 79B 1 40,-2.0 40,-1.7 -2,-0.3 2,-0.3 -0.718 18.8-171.5 -87.9 144.9 26.0 81.4 26.3 40 40 X D E + C 0 78B 38 -19,-0.4 2,-0.3 -2,-0.3 38,-0.2 -0.825 20.8 169.0-140.6 93.1 28.3 78.4 26.9 41 41 X E E + C 0 77B 50 36,-2.7 36,-2.5 -2,-0.3 2,-0.0 -0.750 33.2 19.1-117.4 155.5 30.2 77.8 23.7 42 42 X G S S- 0 0 37 -2,-0.3 2,-0.4 34,-0.2 34,-0.2 -0.226 109.0 -8.1 80.4-173.6 33.1 75.6 22.7 43 43 X N > - 0 0 89 32,-0.4 3,-2.3 28,-0.3 -2,-0.1 -0.359 56.3-152.5 -62.2 112.0 34.6 72.6 24.5 44 44 X S T 3 S+ 0 0 70 -2,-0.4 -1,-0.2 1,-0.3 32,-0.1 0.703 97.1 49.0 -57.1 -22.7 32.9 72.4 27.9 45 45 X D T 3 S+ 0 0 136 30,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.164 82.9 138.6-103.4 16.2 36.1 70.7 29.3 46 46 X A < - 0 0 16 -3,-2.3 29,-0.1 1,-0.1 28,-0.0 -0.206 57.1-134.9 -57.9 150.0 38.5 73.3 27.9 47 47 X E S S+ 0 0 159 27,-0.2 2,-0.3 1,-0.0 -1,-0.1 0.921 90.5 55.3 -70.3 -41.7 41.3 74.4 30.2 48 48 X D - 0 0 30 26,-0.2 28,-2.5 70,-0.1 2,-0.4 -0.696 66.3-165.9 -96.6 141.6 40.7 78.1 29.3 49 49 X V E -de 76 118B 7 68,-1.9 70,-3.0 -2,-0.3 2,-0.8 -0.986 10.6-151.0-126.7 122.0 37.4 79.9 29.7 50 50 X F E -de 77 119B 1 26,-3.0 28,-2.4 -2,-0.4 2,-0.8 -0.838 11.5-161.0 -88.6 111.4 36.7 83.3 28.1 51 51 X L E -de 78 120B 0 68,-2.4 70,-2.9 -2,-0.8 2,-0.6 -0.855 9.1-164.5 -97.0 106.1 34.2 85.1 30.3 52 52 X C E - e 0 121B 1 26,-2.6 2,-0.5 -2,-0.8 70,-0.2 -0.837 3.7-168.3-104.2 114.2 32.7 87.9 28.1 53 53 X L - 0 0 0 68,-2.7 70,-0.4 -2,-0.6 73,-0.2 -0.875 5.7-153.2-111.4 126.8 30.8 90.6 29.9 54 54 X H - 0 0 1 26,-0.5 2,-0.1 -2,-0.5 69,-0.1 -0.304 7.8-156.0 -90.1 175.2 28.6 93.1 28.1 55 55 X G > + 0 0 0 70,-0.2 3,-2.1 4,-0.2 69,-0.1 -0.365 41.1 1.8-128.4-151.3 27.7 96.7 29.1 56 56 X E T 3 S- 0 0 1 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 -0.657 120.2 -11.1 -86.6 138.1 25.0 99.3 28.5 57 57 X P T 3 S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 134,-0.1 -0.347 116.6 80.4-104.4 60.4 22.5 98.9 26.7 58 58 X T < - 0 0 0 -3,-2.1 28,-0.3 27,-0.1 2,-0.3 -0.086 52.0-151.8-115.3-159.4 23.5 95.6 25.1 59 59 X W > - 0 0 1 26,-0.1 3,-2.5 -3,-0.1 4,-0.3 -0.909 54.3 -59.0-163.0-171.1 23.7 91.9 25.8 60 60 X S G > S+ 0 0 1 1,-0.3 3,-2.0 -2,-0.3 4,-0.2 0.724 118.8 79.5 -58.5 -20.5 25.7 88.8 24.9 61 61 X Y G > S+ 0 0 0 1,-0.3 3,-1.8 2,-0.2 -1,-0.3 0.821 81.2 68.3 -49.5 -34.2 24.7 89.5 21.2 62 62 X L G < S+ 0 0 0 -3,-2.5 3,-0.4 1,-0.3 -1,-0.3 0.761 97.5 50.9 -58.9 -27.2 27.5 92.1 21.3 63 63 X Y G X> S+ 0 0 0 -3,-2.0 4,-2.4 -4,-0.3 3,-1.4 0.345 75.2 111.0 -93.2 7.4 30.0 89.3 21.5 64 64 X R T <4 S+ 0 0 9 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.709 78.8 46.9 -60.6 -24.9 28.7 87.4 18.6 65 65 X K T 34 S+ 0 0 72 -3,-0.4 4,-0.4 227,-0.2 -1,-0.3 0.687 116.8 43.9 -86.0 -21.0 31.7 88.1 16.4 66 66 X M T <> S+ 0 0 0 -3,-1.4 4,-2.2 2,-0.1 3,-0.3 0.816 98.3 69.6 -92.0 -37.4 34.2 87.2 19.1 67 67 X I H X S+ 0 0 1 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.906 98.2 49.0 -53.8 -50.8 32.7 84.0 20.5 68 68 X P H > S+ 0 0 58 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.878 110.0 52.8 -60.9 -35.9 33.4 81.8 17.4 69 69 X V H > S+ 0 0 9 -4,-0.4 4,-0.9 -3,-0.3 -2,-0.2 0.950 113.1 43.1 -63.0 -47.3 37.0 83.0 17.3 70 70 X F H ><>S+ 0 0 0 -4,-2.2 5,-1.5 1,-0.2 3,-0.6 0.912 114.2 50.8 -64.1 -43.4 37.6 82.0 20.9 71 71 X A H ><5S+ 0 0 14 -4,-2.9 3,-1.8 1,-0.2 -28,-0.3 0.899 106.6 54.3 -64.5 -40.2 35.7 78.7 20.6 72 72 X E H 3<5S+ 0 0 167 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.721 96.8 65.2 -69.1 -18.3 37.8 77.7 17.5 73 73 X S T <<5S- 0 0 64 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.581 125.4-103.6 -73.0 -8.9 41.0 78.3 19.5 74 74 X G T < 5S+ 0 0 44 -3,-1.8 -27,-0.2 1,-0.3 -3,-0.2 0.444 81.6 126.2 97.5 5.8 39.7 75.3 21.6 75 75 X A < - 0 0 3 -5,-1.5 -32,-0.4 -29,-0.1 -1,-0.3 -0.469 61.1-115.6 -92.3 163.7 38.6 77.4 24.6 76 76 X R E - d 0 49B 38 -28,-2.5 -26,-3.0 -34,-0.2 2,-0.4 -0.691 27.5-154.3 -90.3 151.5 35.2 77.5 26.4 77 77 X V E -Cd 41 50B 2 -36,-2.5 -36,-2.7 -2,-0.3 2,-0.5 -0.991 10.3-172.2-135.4 124.6 33.3 80.8 26.2 78 78 X I E +Cd 40 51B 0 -28,-2.4 -26,-2.6 -2,-0.4 -38,-0.2 -0.981 6.8 175.6-116.9 124.5 30.7 82.0 28.8 79 79 X A E -C 39 0B 0 -40,-1.7 -40,-2.0 -2,-0.5 2,-0.2 -0.867 11.2-168.9-134.2 93.3 28.8 85.1 27.9 80 80 X P E -C 38 0B 4 0, 0.0 -26,-0.5 0, 0.0 2,-0.5 -0.536 18.6-133.4 -83.8 152.0 26.1 86.0 30.4 81 81 X D - 0 0 0 -44,-2.7 -44,-0.3 -2,-0.2 3,-0.1 -0.919 28.8-123.0 -98.7 126.0 23.3 88.6 30.0 82 82 X F > - 0 0 3 -2,-0.5 3,-2.2 1,-0.1 6,-0.3 -0.303 39.4 -87.8 -58.5 147.5 23.0 90.8 33.1 83 83 X F T 3 S+ 0 0 0 1,-0.3 7,-0.2 4,-0.1 -1,-0.1 -0.414 123.4 38.1 -52.0 135.3 19.6 90.9 34.8 84 84 X G T 3 S+ 0 0 0 5,-2.3 135,-0.3 1,-0.2 2,-0.3 0.291 112.8 75.2 97.6 -6.6 17.7 93.6 32.9 85 85 X F S X S- 0 0 0 -3,-2.2 3,-2.0 4,-0.4 -1,-0.2 -0.904 88.3 -14.4-138.6 159.2 19.2 92.6 29.6 86 86 X G T 3 S- 0 0 0 -2,-0.3 -79,-0.2 -28,-0.3 -27,-0.1 -0.209 121.0 -23.4 56.9-131.7 19.2 90.1 26.8 87 87 X K T 3 S+ 0 0 23 -50,-0.1 -1,-0.3 -81,-0.1 2,-0.1 0.318 111.0 108.2 -97.2 6.6 17.4 86.9 27.6 88 88 X S S < S- 0 0 0 -3,-2.0 -81,-0.3 -6,-0.3 -52,-0.2 -0.444 82.4 -90.4 -77.9 157.0 17.8 87.3 31.4 89 89 X D - 0 0 7 -54,-3.0 -5,-2.3 -83,-0.1 -4,-0.4 -0.235 40.5-136.0 -63.4 160.0 14.8 88.3 33.6 90 90 X K E -A 5 0A 0 -85,-2.9 -85,-2.1 -7,-0.2 127,-0.1 -0.868 1.9-140.4-133.1 96.4 14.3 92.0 34.1 91 91 X P E -A 4 0A 0 0, 0.0 127,-0.3 0, 0.0 -87,-0.3 -0.260 15.0-145.2 -48.2 138.4 13.5 93.6 37.4 92 92 X V S S+ 0 0 31 -89,-2.5 2,-0.5 125,-0.1 -88,-0.1 0.665 74.4 74.0 -89.6 -17.7 10.9 96.3 36.9 93 93 X D > - 0 0 82 -90,-0.5 3,-1.7 1,-0.1 4,-0.4 -0.865 68.3-147.2-102.7 126.7 12.0 98.8 39.5 94 94 X E G > S+ 0 0 46 -2,-0.5 3,-1.5 1,-0.3 -1,-0.1 0.830 96.6 68.1 -57.7 -32.6 15.2 100.9 38.9 95 95 X E G 3 S+ 0 0 179 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.724 90.1 62.6 -60.7 -22.9 15.8 100.9 42.6 96 96 X D G < S+ 0 0 48 -3,-1.7 2,-0.6 -93,-0.1 -1,-0.3 0.668 87.8 83.3 -78.2 -17.5 16.6 97.1 42.5 97 97 X Y < + 0 0 1 -3,-1.5 2,-0.3 -4,-0.4 3,-0.1 -0.812 57.2 151.5 -90.3 122.4 19.5 97.7 40.2 98 98 X T > - 0 0 52 -2,-0.6 4,-2.0 1,-0.1 5,-0.2 -0.886 58.7-101.6-137.8 168.4 22.7 98.6 42.1 99 99 X F H > S+ 0 0 2 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.941 124.8 43.0 -56.2 -49.5 26.5 98.2 41.5 100 100 X E H > S+ 0 0 74 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.789 105.3 63.3 -72.2 -26.2 26.6 95.3 44.0 101 101 X F H > S+ 0 0 24 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.961 113.8 35.5 -57.2 -50.6 23.4 93.7 42.6 102 102 X H H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.892 118.3 50.7 -71.3 -39.9 25.2 93.2 39.3 103 103 X R H X S+ 0 0 22 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.947 109.8 49.6 -65.3 -46.4 28.6 92.5 40.9 104 104 X N H X S+ 0 0 66 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.820 105.7 58.9 -63.9 -29.2 27.2 89.8 43.2 105 105 X F H X S+ 0 0 0 -4,-1.2 4,-2.5 -5,-0.3 -1,-0.2 0.933 106.4 47.4 -61.7 -45.3 25.4 88.2 40.3 106 106 X L H X S+ 0 0 1 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.930 111.9 49.1 -63.9 -45.1 28.7 87.7 38.4 107 107 X L H X S+ 0 0 30 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.911 112.3 49.5 -59.9 -42.0 30.4 86.3 41.5 108 108 X A H X S+ 0 0 9 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.914 111.2 49.2 -63.6 -42.1 27.4 83.9 42.0 109 109 X L H X S+ 0 0 1 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.908 110.1 50.7 -63.4 -44.5 27.6 82.8 38.4 110 110 X I H X>S+ 0 0 7 -4,-2.6 5,-1.9 1,-0.2 4,-0.6 0.920 114.6 43.7 -60.9 -43.3 31.4 82.2 38.6 111 111 X E H <5S+ 0 0 122 -4,-2.2 3,-0.4 3,-0.2 -2,-0.2 0.922 113.0 51.5 -68.5 -41.9 30.9 80.0 41.7 112 112 X R H <5S+ 0 0 154 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.914 118.4 36.6 -62.9 -44.8 27.9 78.2 40.3 113 113 X L H <5S- 0 0 22 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.505 104.1-134.0 -83.5 -4.8 29.7 77.2 37.0 114 114 X D T <5 - 0 0 100 -4,-0.6 2,-0.3 -3,-0.4 -3,-0.2 0.917 33.0-169.2 47.6 52.4 32.9 76.8 39.0 115 115 X L < + 0 0 1 -5,-1.9 2,-0.3 -6,-0.2 -1,-0.2 -0.543 13.2 165.6 -74.4 131.2 34.8 78.8 36.3 116 116 X R + 0 0 99 -2,-0.3 -67,-0.2 1,-0.2 3,-0.2 -0.845 54.0 39.8-135.6 174.4 38.6 78.7 36.5 117 117 X N S S- 0 0 75 22,-0.4 -68,-1.9 -2,-0.3 2,-0.3 0.900 84.7-174.7 48.9 45.0 41.5 79.6 34.2 118 118 X I E -ef 49 141B 0 22,-3.0 24,-3.0 -70,-0.2 25,-2.0 -0.547 29.8-159.8 -79.4 130.7 39.4 82.6 33.2 119 119 X T E -ef 50 143B 0 -70,-3.0 -68,-2.4 -2,-0.3 2,-0.5 -0.964 24.6-144.1 -98.6 113.1 40.3 85.1 30.5 120 120 X L E -ef 51 144B 1 23,-2.6 25,-3.3 -2,-0.7 2,-0.5 -0.720 15.4-167.8 -84.8 123.7 38.2 88.1 31.5 121 121 X V E +ef 52 145B 0 -70,-2.9 -68,-2.7 -2,-0.5 2,-0.3 -0.966 18.8 169.6-118.1 117.2 36.8 90.0 28.5 122 122 X V E + f 0 146B 0 23,-2.3 25,-2.5 -2,-0.5 2,-0.3 -0.901 22.0 164.5-138.3 159.3 35.3 93.4 29.3 123 123 X Q >> - 0 0 0 -70,-0.4 3,-1.7 -2,-0.3 4,-0.5 -0.927 65.3 -23.0-166.6 141.0 34.0 96.7 27.9 124 124 X D H >> S- 0 0 5 24,-3.3 4,-2.4 -2,-0.3 3,-2.0 -0.126 134.7 -2.9 51.6-135.5 31.8 99.5 29.4 125 125 X W H 3>>S+ 0 0 3 1,-0.3 4,-2.4 2,-0.2 5,-0.5 0.795 130.6 66.6 -60.0 -27.3 29.8 98.2 32.4 126 126 X G H <>5S+ 0 0 0 -3,-1.7 4,-1.5 1,-0.2 -1,-0.3 0.843 111.2 36.5 -58.3 -32.2 31.2 94.7 31.7 127 127 X G H <5S+ 0 0 0 -4,-2.4 3,-2.0 -5,-0.2 -2,-0.2 0.921 122.5 52.4 -81.2 -53.1 31.9 95.5 37.2 130 130 X G H >< S+ 0 0 0 -3,-2.0 3,-1.9 -4,-0.2 4,-0.7 0.906 79.2 61.4 -81.3 -47.8 36.0 90.5 40.2 134 134 X P G >4 S+ 0 0 0 0, 0.0 3,-1.4 0, 0.0 6,-0.2 0.862 96.5 60.2 -56.2 -36.2 39.5 89.0 40.3 135 135 X M G 34 S+ 0 0 34 -4,-0.3 -2,-0.1 1,-0.3 -3,-0.1 0.747 100.7 58.0 -61.7 -22.6 40.4 90.5 43.7 136 136 X A G <4 S+ 0 0 53 -3,-1.9 -1,-0.3 -4,-0.2 -3,-0.1 0.738 133.3 1.6 -75.9 -24.0 37.5 88.5 45.2 137 137 X D S X< S+ 0 0 50 -3,-1.4 3,-1.7 -4,-0.7 4,-0.3 -0.428 73.6 174.9-163.3 69.1 38.9 85.2 44.0 138 138 X P G > S+ 0 0 73 0, 0.0 3,-1.4 0, 0.0 -3,-0.1 0.758 70.9 67.0 -63.3 -28.6 42.3 85.8 42.2 139 139 X S G 3 S+ 0 0 85 1,-0.3 -22,-0.4 -5,-0.1 0, 0.0 0.638 94.1 62.1 -68.2 -12.9 43.3 82.1 41.6 140 140 X R G < S+ 0 0 25 -3,-1.7 -22,-3.0 -6,-0.2 2,-0.4 0.617 92.5 78.0 -83.8 -15.1 40.3 81.7 39.2 141 141 X F E < +f 118 0B 19 -3,-1.4 -22,-0.2 -4,-0.3 3,-0.1 -0.859 40.4 160.4-109.5 134.3 41.7 84.4 36.8 142 142 X K E + 0 0 48 -24,-3.0 109,-1.3 -2,-0.4 2,-0.3 0.706 63.5 11.6-117.0 -40.4 44.5 83.9 34.3 143 143 X R E -fg 119 251B 14 -25,-2.0 -23,-2.6 107,-0.2 2,-0.4 -0.920 54.6-143.2-144.0 165.8 44.2 86.7 31.6 144 144 X L E -fg 120 252B 0 107,-2.1 109,-2.2 -2,-0.3 2,-0.5 -0.996 6.1-171.8-135.5 130.0 42.4 90.0 30.7 145 145 X I E -fg 121 253B 0 -25,-3.3 -23,-2.3 -2,-0.4 2,-0.5 -0.986 21.9-170.0-113.0 114.6 41.2 91.4 27.5 146 146 X I E +fg 122 254B 0 107,-2.6 109,-2.2 -2,-0.5 2,-0.3 -0.938 11.5 174.2-114.5 121.9 40.2 95.0 28.1 147 147 X M E - g 0 255B 0 -25,-2.5 -23,-0.2 -2,-0.5 109,-0.2 -0.827 64.6 -28.4-113.7 160.7 38.2 97.2 25.7 148 148 X N S S+ 0 0 0 107,-0.7 -24,-3.3 -2,-0.3 2,-0.3 0.357 99.9 109.5 -14.1 96.6 36.9 100.7 26.4 149 149 X A + 0 0 0 -26,-0.2 2,-0.2 114,-0.2 122,-0.1 -0.957 35.3 174.9-166.6 167.0 36.3 100.5 30.1 150 150 X C - 0 0 0 -26,-0.3 2,-0.4 -2,-0.3 -19,-0.2 -0.817 38.8 -75.1-161.1-158.9 37.6 101.8 33.4 151 151 X L - 0 0 0 -2,-0.2 2,-1.9 7,-0.1 -23,-0.1 -0.962 30.3-127.9-122.8 137.7 36.8 101.8 37.2 152 152 X M + 0 0 0 -2,-0.4 85,-0.3 -24,-0.3 86,-0.2 -0.325 56.1 144.5 -84.1 56.5 34.1 103.7 38.9 153 153 X T - 0 0 0 -2,-1.9 81,-0.1 84,-0.2 82,-0.1 -0.228 57.6 -78.8 -80.2 177.3 36.3 105.3 41.6 154 154 X D > - 0 0 35 80,-0.2 4,-1.9 1,-0.1 7,-0.2 -0.374 42.1-107.7 -78.0 161.6 35.8 108.8 42.9 155 155 X P T 4 S+ 0 0 77 0, 0.0 7,-0.2 0, 0.0 8,-0.1 0.758 114.5 54.4 -61.0 -27.6 37.0 111.9 41.0 156 156 X V T 4 S+ 0 0 130 2,-0.2 6,-0.0 1,-0.2 -3,-0.0 0.943 108.2 46.0 -76.7 -43.3 39.9 112.7 43.3 157 157 X T T 4 S+ 0 0 57 1,-0.3 -1,-0.2 2,-0.1 -4,-0.0 0.915 137.2 6.3 -68.3 -40.8 41.6 109.3 43.1 158 158 X Q >< - 0 0 48 -4,-1.9 3,-1.5 1,-0.1 -1,-0.3 -0.705 62.3-178.8-141.4 91.4 41.3 109.1 39.3 159 159 X P T >> S+ 0 0 83 0, 0.0 4,-2.7 0, 0.0 3,-1.9 0.825 82.4 65.6 -56.9 -31.9 40.0 112.2 37.5 160 160 X A H 3> S+ 0 0 26 1,-0.3 4,-0.6 2,-0.2 108,-0.1 0.793 97.3 56.0 -58.8 -30.6 40.2 110.5 34.1 161 161 X F H <4 S+ 0 0 0 -3,-1.5 -1,-0.3 -7,-0.2 106,-0.1 0.371 118.9 30.9 -89.2 6.0 37.4 108.1 35.2 162 162 X S H X4 S+ 0 0 23 -3,-1.9 3,-1.6 -4,-0.2 4,-0.4 0.554 100.5 74.7-126.3 -28.8 35.0 111.0 36.1 163 163 X A H >X S+ 0 0 60 -4,-2.7 4,-1.5 1,-0.3 3,-1.3 0.837 88.0 63.9 -59.8 -35.0 35.9 113.8 33.7 164 164 X F T 3< S+ 0 0 10 -4,-0.6 8,-0.6 1,-0.3 9,-0.4 0.704 87.4 73.3 -63.2 -19.3 34.2 112.1 30.7 165 165 X V T <4 S+ 0 0 25 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.841 110.5 25.7 -65.1 -32.9 30.8 112.3 32.5 166 166 X T T <4 S+ 0 0 102 -3,-1.3 -2,-0.2 -4,-0.4 -1,-0.2 0.630 109.3 85.1-111.4 -18.6 30.6 116.1 31.9 167 167 X Q S < S+ 0 0 149 -4,-1.5 -1,-0.3 1,-0.2 5,-0.2 -0.995 74.9 30.6-140.4 148.3 32.7 116.7 28.7 168 168 X P S > >S- 0 0 56 0, 0.0 3,-2.4 0, 0.0 5,-0.7 0.586 72.6-141.5 -78.6 159.7 32.4 116.6 25.8 169 169 X A T 3 >S+ 0 0 77 1,-0.3 5,-0.6 -2,-0.1 -2,-0.1 0.827 103.5 51.6 -52.4 -35.2 28.7 117.5 25.6 170 170 X D T 3 5S+ 0 0 79 3,-0.2 -1,-0.3 4,-0.1 91,-0.1 0.286 105.5 65.2 -88.9 12.4 28.3 114.9 22.8 171 171 X G T X>5S- 0 0 0 -3,-2.4 4,-2.3 90,-0.1 3,-0.7 0.374 121.2 -18.5-100.5-124.8 29.9 112.1 24.8 172 172 X F H 3>5S+ 0 0 6 -8,-0.6 4,-3.2 89,-0.4 5,-0.3 0.846 133.8 62.3 -55.7 -36.1 28.5 110.6 27.9 173 173 X T H 3> - 0 0 124 -2,-0.6 4,-2.1 1,-0.1 3,-0.2 -0.863 4.9-172.1-105.2 100.6 14.1 102.7 20.8 187 187 X L H > S+ 0 0 3 -2,-0.8 4,-2.7 1,-0.2 5,-0.2 0.740 82.5 61.9 -72.4 -21.8 17.4 100.8 21.3 188 188 X D H > S+ 0 0 46 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.952 109.3 42.1 -61.5 -47.8 17.7 100.0 17.6 189 189 X Q H > S+ 0 0 113 -3,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.899 114.2 52.7 -65.7 -41.3 17.8 103.7 16.8 190 190 X F H X S+ 0 0 10 -4,-2.1 4,-2.3 1,-0.2 3,-0.3 0.959 110.7 46.6 -55.0 -50.3 20.1 104.3 19.8 191 191 X M H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.3 7,-0.2 0.864 108.1 54.9 -70.0 -33.9 22.5 101.6 18.7 192 192 X K H < S+ 0 0 63 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.863 111.2 47.4 -63.7 -32.6 22.6 102.8 15.1 193 193 X R H < S+ 0 0 158 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.929 119.7 36.0 -70.8 -45.5 23.6 106.3 16.4 194 194 X W H < S+ 0 0 35 -4,-2.3 95,-0.5 1,-0.3 96,-0.4 0.593 130.4 32.8 -90.8 -12.9 26.3 105.0 18.7 195 195 X A S >< S+ 0 0 7 -4,-2.2 3,-2.3 -5,-0.2 -1,-0.3 -0.651 72.9 178.1-135.3 75.5 27.5 102.2 16.4 196 196 X P T 3 S+ 0 0 106 0, 0.0 -4,-0.1 0, 0.0 -2,-0.1 0.549 72.7 65.3 -64.3 -8.3 26.9 103.7 12.9 197 197 X T T 3 S+ 0 0 92 2,-0.0 -5,-0.1 0, 0.0 2,-0.0 0.462 76.0 114.1 -91.4 -3.8 28.3 100.7 11.1 198 198 X L < - 0 0 15 -3,-2.3 2,-0.1 -7,-0.2 -3,-0.0 -0.354 66.4-126.6 -62.9 144.0 25.6 98.3 12.3 199 199 X T > - 0 0 69 1,-0.1 4,-2.6 -2,-0.0 5,-0.2 -0.475 29.1-104.9 -76.7 166.0 23.2 96.9 9.7 200 200 X E H > S+ 0 0 127 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.921 122.8 51.6 -57.4 -44.2 19.4 97.3 10.3 201 201 X A H > S+ 0 0 43 2,-0.2 4,-1.2 1,-0.2 -185,-0.4 0.885 109.6 49.6 -62.0 -41.7 19.1 93.7 11.4 202 202 X E H >> S+ 0 0 22 1,-0.2 4,-0.9 2,-0.2 3,-0.6 0.942 110.3 50.2 -61.7 -47.9 21.9 94.0 13.9 203 203 X A H >X S+ 0 0 0 -4,-2.6 3,-0.9 1,-0.2 4,-0.9 0.902 106.3 56.1 -56.8 -40.4 20.4 97.2 15.4 204 204 X S H >X S+ 0 0 60 -4,-2.3 4,-1.4 1,-0.2 3,-0.6 0.832 97.4 63.7 -62.2 -30.1 17.0 95.3 15.7 205 205 X A H << S+ 0 0 1 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.806 99.9 53.1 -65.8 -28.5 18.8 92.6 17.8 206 206 X Y H << S+ 0 0 0 -4,-0.9 -1,-0.3 -3,-0.9 -2,-0.2 0.731 110.5 46.2 -77.8 -23.9 19.5 95.3 20.4 207 207 X A H X< S+ 0 0 17 -4,-0.9 3,-2.2 -3,-0.6 -2,-0.2 0.689 92.0 87.2 -82.7 -20.7 15.8 96.2 20.6 208 208 X A T 3< S+ 0 0 9 -4,-1.4 -2,-0.1 1,-0.3 -1,-0.1 0.821 81.6 54.6 -52.2 -43.7 14.7 92.6 20.7 209 209 X P T 3 S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.645 102.6 64.5 -65.6 -11.1 15.0 92.2 24.5 210 210 X F < + 0 0 11 -3,-2.2 -23,-0.1 1,-0.2 3,-0.1 -0.760 47.7 171.2-125.7 81.2 12.7 95.2 25.1 211 211 X P S S- 0 0 49 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.835 77.4 -16.6 -51.5 -37.3 9.0 94.9 24.0 212 212 X D S > S- 0 0 81 -28,-0.0 3,-2.0 -26,-0.0 4,-0.1 -0.944 83.7 -76.7-160.4 176.7 8.2 98.2 25.8 213 213 X T G > S+ 0 0 58 1,-0.3 3,-2.0 -2,-0.3 4,-0.1 0.739 115.8 71.9 -57.6 -25.7 9.5 100.6 28.5 214 214 X S G 3 S+ 0 0 52 1,-0.3 3,-0.5 2,-0.1 -1,-0.3 0.774 97.6 51.6 -62.1 -24.0 8.4 98.3 31.4 215 215 X Y G < S+ 0 0 35 -3,-2.0 -1,-0.3 1,-0.2 3,-0.2 0.383 96.9 71.9 -90.1 1.5 11.3 96.0 30.4 216 216 X Q <> + 0 0 6 -3,-2.0 4,-2.4 1,-0.2 5,-0.2 0.179 53.1 110.6-110.4 17.0 14.0 98.8 30.4 217 217 X A H > S+ 0 0 0 -3,-0.5 4,-1.8 -126,-0.3 -1,-0.2 0.904 84.9 48.0 -58.5 -42.3 14.5 99.6 34.1 218 218 X G H > S+ 0 0 1 -127,-0.3 4,-1.9 -3,-0.2 -1,-0.2 0.908 110.2 52.9 -63.9 -41.6 18.0 98.2 34.0 219 219 X V H 4 S+ 0 0 0 -135,-0.3 -2,-0.2 1,-0.2 -1,-0.2 0.884 110.9 46.5 -59.2 -42.6 18.8 100.1 30.9 220 220 X R H X S+ 0 0 54 -4,-2.4 4,-0.7 1,-0.2 -1,-0.2 0.846 111.5 51.7 -69.8 -33.7 17.7 103.4 32.5 221 221 X K H X S+ 0 0 41 -4,-1.8 4,-2.0 -5,-0.2 3,-0.3 0.860 92.7 71.7 -78.0 -34.3 19.6 102.8 35.7 222 222 X F H X S+ 0 0 0 -4,-1.9 4,-1.0 1,-0.2 3,-0.5 0.914 101.1 42.5 -50.7 -55.5 23.1 102.0 34.3 223 223 X P H > S+ 0 0 1 0, 0.0 4,-1.6 0, 0.0 3,-0.4 0.842 110.2 57.8 -64.3 -29.2 24.0 105.5 33.1 224 224 X K H X S+ 0 0 67 -4,-0.7 4,-2.4 -3,-0.3 -2,-0.2 0.880 103.8 53.4 -64.4 -35.0 22.6 107.0 36.3 225 225 X M H < S+ 0 0 14 -4,-2.0 -1,-0.2 -3,-0.5 -3,-0.1 0.681 104.6 55.4 -74.1 -21.4 25.1 104.8 38.2 226 226 X V H < S+ 0 0 5 -4,-1.0 -1,-0.2 -3,-0.4 3,-0.2 0.880 115.1 38.0 -73.7 -40.0 27.9 106.2 36.1 227 227 X A H < S+ 0 0 38 -4,-1.6 2,-0.5 1,-0.2 -2,-0.2 0.794 125.9 38.0 -79.5 -33.7 27.0 109.8 37.1 228 228 X Q S < S- 0 0 161 -4,-2.4 2,-0.5 -5,-0.2 -1,-0.2 -0.913 75.2-171.1-126.2 103.8 26.0 108.9 40.7 229 229 X R - 0 0 34 -2,-0.5 -3,-0.1 -3,-0.2 -4,-0.1 -0.825 15.8-136.9-101.5 122.7 28.3 106.3 42.3 230 230 X D > - 0 0 76 -2,-0.5 4,-2.5 -5,-0.1 5,-0.2 -0.240 28.3-103.9 -77.0 168.0 27.4 104.9 45.7 231 231 X Q H > S+ 0 0 121 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.878 120.5 54.3 -62.0 -37.4 29.9 104.4 48.4 232 232 X A H > S+ 0 0 30 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.932 109.7 48.0 -60.8 -46.9 30.1 100.6 47.9 233 233 X C H > S+ 0 0 3 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.929 112.9 48.5 -57.8 -48.0 30.9 101.2 44.2 234 234 X I H X S+ 0 0 27 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.940 114.6 44.4 -60.0 -47.7 33.6 103.8 45.1 235 235 X D H X S+ 0 0 88 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.944 116.1 45.4 -64.4 -47.2 35.2 101.6 47.7 236 236 X I H X S+ 0 0 20 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.933 114.5 49.0 -62.5 -45.4 35.2 98.4 45.6 237 237 X S H X S+ 0 0 0 -4,-2.7 4,-1.5 -5,-0.3 -84,-0.2 0.895 111.3 49.4 -63.3 -40.3 36.4 100.2 42.5 238 238 X T H X S+ 0 0 51 -4,-2.5 4,-1.4 -5,-0.3 -1,-0.2 0.921 110.0 50.5 -66.9 -41.9 39.2 101.9 44.4 239 239 X E H X S+ 0 0 124 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.899 105.9 58.4 -59.0 -39.1 40.3 98.5 45.9 240 240 X A H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 5,-0.3 0.880 98.4 58.6 -60.2 -36.9 40.3 97.1 42.4 241 241 X I H X S+ 0 0 11 -4,-1.5 4,-2.3 1,-0.2 5,-0.2 0.948 105.4 49.2 -59.2 -45.6 42.8 99.7 41.2 242 242 X S H X>S+ 0 0 53 -4,-1.4 4,-2.9 1,-0.2 5,-0.6 0.868 108.9 54.6 -60.6 -37.9 45.3 98.4 43.9 243 243 X F H X>S+ 0 0 15 -4,-1.7 4,-2.4 1,-0.2 5,-2.3 0.972 111.8 40.9 -60.5 -53.5 44.6 94.9 42.6 244 244 X W H <5S+ 0 0 1 -4,-2.4 32,-2.8 1,-0.2 -2,-0.2 0.845 122.1 43.2 -65.0 -32.9 45.5 95.6 39.0 245 245 X Q H <5S+ 0 0 99 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.903 131.4 16.4 -77.5 -43.1 48.4 97.8 40.0 246 246 X N H <5S+ 0 0 100 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.663 131.0 30.7-110.1 -25.3 50.0 95.7 42.8 247 247 X D T < - h 0 284B 0 -2,-0.5 3,-1.6 6,-0.2 28,-0.2 -0.796 21.7-159.3 -80.5 105.7 37.9 102.0 19.9 258 258 X M T 3 S+ 0 0 58 26,-2.2 30,-0.2 -2,-0.9 -1,-0.1 0.621 82.6 57.0 -73.5 -16.2 39.4 105.3 18.9 259 259 X K T 3 S+ 0 0 139 28,-2.9 2,-0.4 25,-0.4 -1,-0.3 0.354 76.8 121.8 -91.3 2.3 36.1 107.0 17.8 260 260 X D < - 0 0 14 -3,-1.6 4,-0.4 27,-0.4 -89,-0.1 -0.555 44.7-167.6 -70.1 124.8 34.6 106.5 21.3 261 261 X K S S+ 0 0 108 -2,-0.4 -89,-0.4 -91,-0.1 -1,-0.2 0.547 84.1 45.1 -85.1 -8.5 33.6 109.9 22.8 262 262 X L S S+ 0 0 2 -91,-0.2 -90,-0.1 -90,-0.1 -95,-0.1 0.908 127.9 9.0 -95.5 -69.5 33.1 108.2 26.3 263 263 X L S S+ 0 0 0 -6,-0.1 -6,-0.2 -115,-0.1 -114,-0.2 -0.351 91.2 128.0-119.9 48.7 35.9 105.8 27.1 264 264 X G S >> S- 0 0 1 -4,-0.4 4,-2.8 -116,-0.1 3,-1.9 0.192 79.1 -44.5 -86.3-154.0 38.5 106.4 24.5 265 265 X P H 3> S+ 0 0 38 0, 0.0 4,-2.2 0, 0.0 -7,-0.1 0.806 130.2 62.4 -48.1 -37.9 42.2 107.2 24.8 266 266 X D H 34 S+ 0 0 116 1,-0.2 -3,-0.1 2,-0.2 -102,-0.0 0.799 118.7 28.9 -68.1 -19.0 41.8 109.8 27.6 267 267 X V H <> S+ 0 0 0 -3,-1.9 4,-1.9 2,-0.1 -1,-0.2 0.790 119.9 53.1 -97.2 -39.7 40.4 107.0 29.8 268 268 X M H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.823 103.8 53.7 -76.4 -30.8 42.2 103.9 28.4 269 269 X Y H X S+ 0 0 92 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.955 110.2 47.6 -68.6 -47.1 45.8 105.2 28.6 270 270 X P H > S+ 0 0 43 0, 0.0 4,-1.1 0, 0.0 -2,-0.2 0.928 113.5 50.2 -54.2 -38.8 45.3 106.0 32.3 271 271 X M H X S+ 0 0 0 -4,-1.9 4,-1.0 1,-0.2 3,-0.5 0.909 105.2 56.6 -65.5 -40.8 43.8 102.5 32.6 272 272 X K H >< S+ 0 0 66 -4,-2.6 3,-0.8 1,-0.2 6,-0.4 0.908 104.8 52.0 -54.2 -44.3 46.8 101.0 30.8 273 273 X A H 3< S+ 0 0 81 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.799 107.4 52.9 -67.5 -27.6 49.2 102.4 33.4 274 274 X L H 3< S+ 0 0 18 -4,-1.1 2,-0.8 -3,-0.5 -1,-0.2 0.668 92.4 80.4 -82.3 -18.7 47.2 101.0 36.3 275 275 X I S X< S- 0 0 3 -4,-1.0 3,-2.2 -3,-0.8 -30,-0.2 -0.831 87.3-125.3 -95.8 108.1 47.2 97.4 35.0 276 276 X N T 3 S+ 0 0 73 -32,-2.8 -26,-0.1 -2,-0.8 -2,-0.1 -0.322 91.4 4.9 -52.8 124.1 50.5 95.7 35.8 277 277 X G T 3 S+ 0 0 62 1,-0.3 -25,-0.3 -4,-0.1 -1,-0.3 0.511 85.1 156.1 79.6 6.7 52.1 94.3 32.6 278 278 X C < - 0 0 12 -3,-2.2 -1,-0.3 -6,-0.4 -25,-0.1 -0.505 34.3-139.6 -68.7 126.3 49.4 95.8 30.2 279 279 X P - 0 0 32 0, 0.0 3,-0.1 0, 0.0 -25,-0.1 -0.257 36.7 -63.2 -77.3 170.8 51.0 96.1 26.8 280 280 X E - 0 0 167 1,-0.1 -26,-0.3 -27,-0.0 2,-0.1 -0.266 68.4-105.9 -42.8 132.7 50.7 98.9 24.2 281 281 X P - 0 0 11 0, 0.0 2,-0.7 0, 0.0 -26,-0.2 -0.369 18.0-120.7 -70.8 147.8 47.0 99.0 23.1 282 282 X L E -h 255 0B 44 -28,-2.8 -26,-2.7 -3,-0.1 2,-0.6 -0.809 32.8-147.4 -77.6 116.7 45.7 97.8 19.8 283 283 X E E -h 256 0B 93 -2,-0.7 2,-0.8 -28,-0.2 -26,-0.2 -0.825 9.7-161.7 -93.0 120.7 44.2 101.0 18.4 284 284 X I E > -h 257 0B 6 -28,-3.0 -26,-2.2 -2,-0.6 3,-0.9 -0.869 2.5-165.3-102.8 102.6 41.1 100.4 16.2 285 285 X A T 3 S+ 0 0 66 -2,-0.8 -1,-0.2 1,-0.2 -28,-0.0 0.815 84.1 41.9 -57.4 -39.5 40.7 103.5 14.2 286 286 X D T 3 S+ 0 0 101 -28,-0.1 2,-0.2 -27,-0.0 -1,-0.2 0.583 93.9 98.5 -88.7 -11.1 37.2 102.8 13.0 287 287 X A < - 0 0 0 -3,-0.9 -28,-2.9 -31,-0.2 -27,-0.4 -0.564 49.3-171.6 -85.5 140.8 35.7 101.4 16.2 288 288 X G - 0 0 20 2,-0.3 -28,-0.4 -2,-0.2 -140,-0.1 0.067 58.7 -47.4-100.6-143.2 33.6 103.5 18.6 289 289 X H S S+ 0 0 3 -95,-0.5 2,-1.8 -30,-0.2 3,-0.2 0.880 128.9 66.2 -61.8 -39.2 32.4 102.6 22.1 290 290 X F > + 0 0 4 -96,-0.4 3,-1.5 1,-0.2 -2,-0.3 -0.565 62.4 167.2 -88.3 77.2 31.2 99.2 20.9 291 291 X V G > + 0 0 0 -2,-1.8 3,-2.5 1,-0.3 -1,-0.2 0.812 65.4 71.3 -65.5 -29.7 34.6 97.8 20.1 292 292 X Q G > S+ 0 0 0 1,-0.3 3,-2.0 -3,-0.2 -1,-0.3 0.691 82.1 71.4 -62.4 -21.1 33.2 94.3 19.9 293 293 X E G < S+ 0 0 9 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.693 107.7 37.1 -68.6 -17.5 31.5 95.2 16.6 294 294 X F G <> S+ 0 0 53 -3,-2.5 4,-0.8 -4,-0.2 3,-0.5 -0.189 92.5 125.7-110.2 34.8 35.1 95.2 15.3 295 295 X G H <> + 0 0 0 -3,-2.0 4,-2.8 1,-0.2 5,-0.2 0.599 46.4 73.3 -80.8 -15.7 35.7 92.2 17.5 296 296 X E H > S+ 0 0 100 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.966 102.5 46.5 -62.6 -46.0 37.0 89.6 15.2 297 297 X Q H > S+ 0 0 85 -3,-0.5 4,-2.6 1,-0.2 5,-0.3 0.882 112.3 50.5 -56.7 -44.9 40.3 91.6 15.0 298 298 X V H X S+ 0 0 0 -4,-0.8 4,-2.5 2,-0.2 5,-0.2 0.947 113.1 44.8 -63.6 -46.5 40.4 92.0 18.8 299 299 X A H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.939 115.3 47.1 -64.2 -47.3 39.8 88.3 19.4 300 300 X R H X S+ 0 0 122 -4,-2.9 4,-2.0 -5,-0.2 -2,-0.2 0.933 115.4 44.5 -61.4 -46.4 42.3 87.1 16.8 301 301 X E H X S+ 0 0 77 -4,-2.6 4,-2.8 -5,-0.2 -1,-0.2 0.882 111.9 52.9 -68.7 -36.8 45.1 89.5 18.0 302 302 X A H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.3 -1,-0.2 0.937 108.4 50.7 -62.8 -45.6 44.5 88.8 21.7 303 303 X L H X S+ 0 0 37 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.896 111.5 47.8 -59.7 -41.1 44.8 85.0 21.0 304 304 X K H X S+ 0 0 108 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.937 111.2 50.5 -66.7 -41.0 48.1 85.7 19.1 305 305 X H H < S+ 0 0 50 -4,-2.8 4,-0.4 1,-0.2 -2,-0.2 0.898 113.9 45.7 -58.1 -40.6 49.4 87.9 22.0 306 306 X F H >< S+ 0 0 1 -4,-2.6 3,-1.2 1,-0.2 -2,-0.2 0.884 108.9 53.5 -74.4 -38.0 48.5 85.1 24.5 307 307 X A H >< S+ 0 0 73 -4,-2.5 3,-1.0 1,-0.2 -1,-0.2 0.865 100.9 65.0 -60.3 -36.8 50.0 82.3 22.4 308 308 X E T 3< S+ 0 0 138 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.645 117.0 22.5 -58.7 -24.4 53.2 84.3 22.4 309 309 X T T < 0 0 92 -3,-1.2 -1,-0.2 -4,-0.4 -2,-0.2 -0.018 360.0 360.0-142.6 36.5 53.7 84.1 26.1 310 310 X E < 0 0 171 -3,-1.0 -2,-0.1 -4,-0.1 -3,-0.1 0.949 360.0 360.0 -55.0 360.0 51.7 81.0 27.3