==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 02-FEB-12 4DJL . COMPND 2 MOLECULE: CARBOXYPEPTIDASE T; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOACTINOMYCES VULGARIS; . AUTHOR S.A.KUZNETSOV,V.I.TIMOFEEV,V.K.AKPAROV,I.P.KURANOVA . 323 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12371.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 6.2 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 19 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 26.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 1 1 1 0 1 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 1 1 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 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 A D 0 0 89 0, 0.0 122,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 170.1 55.1 -71.6 2.4 2 2 A F - 0 0 13 7,-0.2 5,-0.1 1,-0.1 122,-0.1 -0.320 360.0 -92.5 -55.4 143.9 55.6 -71.2 6.2 3 3 A P > - 0 0 14 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.295 40.2-109.0 -53.6 150.0 57.1 -74.4 7.8 4 4 A S G > S+ 0 0 109 1,-0.3 3,-1.5 2,-0.2 4,-0.1 0.827 119.4 59.3 -54.0 -37.2 54.3 -76.7 9.0 5 5 A Y G 3 S+ 0 0 158 1,-0.3 286,-0.3 2,-0.1 -1,-0.3 0.722 112.4 40.2 -66.1 -21.3 55.1 -75.8 12.7 6 6 A D G X S+ 0 0 4 -3,-1.8 3,-1.9 1,-0.1 -1,-0.3 -0.009 75.0 128.5-113.2 26.9 54.4 -72.1 11.9 7 7 A S T < + 0 0 78 -3,-1.5 4,-0.1 1,-0.3 -1,-0.1 0.657 55.6 79.6 -61.3 -16.7 51.3 -72.8 9.7 8 8 A G T 3 S+ 0 0 37 -3,-0.2 -1,-0.3 -4,-0.1 2,-0.1 0.723 75.3 90.8 -63.2 -23.9 49.3 -70.3 11.7 9 9 A Y S < S- 0 0 5 -3,-1.9 2,-0.6 1,-0.1 -7,-0.2 -0.435 83.2-118.0 -70.0 149.7 50.9 -67.4 9.9 10 10 A H - 0 0 57 63,-0.2 -2,-0.1 -2,-0.1 -1,-0.1 -0.811 20.4-153.4 -93.0 122.1 49.2 -66.1 6.7 11 11 A N > - 0 0 25 -2,-0.6 4,-2.7 -4,-0.1 5,-0.2 -0.228 44.2 -85.9 -74.5 179.3 51.0 -66.3 3.4 12 12 A Y H > S+ 0 0 20 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.933 129.5 44.8 -59.1 -48.4 50.1 -63.8 0.7 13 13 A N H > S+ 0 0 107 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.895 114.4 49.5 -63.3 -39.4 47.2 -65.8 -0.7 14 14 A E H > S+ 0 0 72 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.884 110.0 51.8 -65.1 -39.3 45.8 -66.6 2.8 15 15 A M H X S+ 0 0 2 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.942 110.7 47.5 -60.8 -48.6 46.1 -62.9 3.7 16 16 A V H X S+ 0 0 17 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.901 110.2 52.7 -60.4 -42.5 44.1 -61.9 0.6 17 17 A N H X S+ 0 0 102 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.886 110.7 47.7 -60.9 -39.9 41.5 -64.6 1.4 18 18 A K H X S+ 0 0 54 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.929 112.2 48.4 -65.7 -48.1 41.1 -63.2 4.9 19 19 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.922 112.8 49.3 -56.6 -46.2 40.8 -59.6 3.7 20 20 A N H X S+ 0 0 57 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.867 109.4 51.8 -62.6 -39.5 38.2 -60.7 1.1 21 21 A T H X S+ 0 0 76 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.936 113.4 43.0 -63.8 -48.0 36.2 -62.6 3.7 22 22 A V H X S+ 0 0 5 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.940 113.8 51.0 -64.7 -48.0 36.0 -59.7 6.1 23 23 A A H < S+ 0 0 18 -4,-2.7 7,-0.2 1,-0.2 -1,-0.2 0.889 112.6 46.8 -56.5 -41.2 35.3 -57.1 3.4 24 24 A S H < S+ 0 0 81 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.845 113.3 49.2 -68.8 -35.3 32.4 -59.3 2.0 25 25 A N H < S+ 0 0 104 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.701 118.5 37.0 -77.9 -22.8 31.0 -59.9 5.5 26 26 A Y >X + 0 0 77 -4,-1.7 4,-2.1 -3,-0.1 3,-1.4 -0.390 64.5 150.8-127.9 55.3 31.0 -56.2 6.5 27 27 A P T 34 + 0 0 83 0, 0.0 -1,-0.1 0, 0.0 26,-0.1 0.751 69.9 63.3 -64.3 -24.0 30.1 -54.2 3.3 28 28 A N T 34 S+ 0 0 139 1,-0.2 25,-1.2 -3,-0.1 24,-0.3 0.811 122.2 17.8 -66.3 -29.0 28.4 -51.4 5.3 29 29 A I T <4 S+ 0 0 4 -3,-1.4 21,-2.0 23,-0.1 2,-0.4 0.498 115.0 68.2-124.4 -6.4 31.8 -50.5 6.9 30 30 A V E < +A 49 0A 7 -4,-2.1 2,-0.4 -7,-0.2 19,-0.2 -0.968 45.4 178.0-125.4 132.6 34.6 -52.1 4.9 31 31 A K E -A 48 0A 107 17,-2.3 17,-2.1 -2,-0.4 2,-0.3 -0.969 17.5-149.4-131.0 117.3 35.8 -51.3 1.4 32 32 A K E +A 47 0A 66 -2,-0.4 2,-0.3 15,-0.2 15,-0.2 -0.614 27.5 156.2 -80.7 141.4 38.8 -53.1 -0.1 33 33 A F E -A 46 0A 55 13,-2.5 13,-2.9 -2,-0.3 2,-0.4 -0.949 34.9-121.4-151.2 170.4 41.0 -51.3 -2.6 34 34 A S E -A 45 0A 37 -2,-0.3 11,-0.2 11,-0.2 3,-0.1 -0.958 3.4-159.4-117.0 141.0 44.6 -51.5 -4.0 35 35 A I E - 0 0 27 9,-2.4 2,-0.3 -2,-0.4 10,-0.1 0.450 67.4 -69.4 -92.9 -0.8 47.2 -48.7 -3.8 36 36 A G E - 0 0 25 8,-0.3 8,-2.9 149,-0.0 2,-0.4 -0.972 60.4 -59.0 148.0-162.3 49.2 -50.3 -6.6 37 37 A K E -A 43 0A 115 -2,-0.3 6,-0.2 6,-0.2 144,-0.1 -0.943 36.5-124.0-125.1 144.2 51.4 -53.2 -7.5 38 38 A S > - 0 0 6 4,-2.8 3,-1.4 -2,-0.4 74,-0.1 -0.173 46.5 -90.0 -68.5 173.0 54.7 -54.6 -6.1 39 39 A Y T 3 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.884 130.7 46.6 -53.9 -41.1 57.7 -55.0 -8.4 40 40 A E T 3 S- 0 0 102 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.462 126.6 -98.9 -86.3 -0.4 56.6 -58.6 -9.3 41 41 A G S < S+ 0 0 40 -3,-1.4 2,-0.3 1,-0.3 -2,-0.1 0.641 71.1 145.7 98.2 16.7 53.0 -57.5 -9.8 42 42 A R - 0 0 67 1,-0.1 -4,-2.8 3,-0.0 -1,-0.3 -0.666 54.1-106.8 -83.6 140.9 51.2 -58.4 -6.6 43 43 A E E -A 37 0A 52 -2,-0.3 2,-1.2 -6,-0.2 -6,-0.2 -0.404 17.5-135.3 -66.9 140.0 48.4 -56.1 -5.4 44 44 A L E - 0 0 0 -8,-2.9 -9,-2.4 -2,-0.1 -8,-0.3 -0.741 36.4-152.9 -94.4 83.2 49.2 -53.8 -2.5 45 45 A W E +A 34 0A 45 -2,-1.2 64,-1.2 -11,-0.2 65,-0.5 -0.261 23.0 165.8 -69.7 143.7 45.9 -54.4 -0.7 46 46 A A E -AB 33 108A 0 -13,-2.9 -13,-2.5 62,-0.2 2,-0.3 -0.945 19.4-149.2-143.1 161.4 44.2 -52.0 1.6 47 47 A V E -AB 32 107A 0 60,-1.8 60,-2.0 -2,-0.3 2,-0.4 -0.969 7.6-147.0-126.1 155.2 40.8 -51.4 3.3 48 48 A K E -AB 31 106A 15 -17,-2.1 -17,-2.3 -2,-0.3 2,-0.4 -0.961 18.0-164.5-107.2 136.0 39.0 -48.4 4.4 49 49 A I E +AB 30 105A 0 56,-2.9 56,-2.8 -2,-0.4 2,-0.3 -0.992 33.8 108.4-124.9 122.5 36.9 -48.9 7.5 50 50 A S S > S- 0 0 0 -21,-2.0 3,-0.6 -2,-0.4 51,-0.2 -0.928 70.4 -83.6-176.7 155.8 34.1 -46.4 8.4 51 51 A D T 3 S+ 0 0 32 49,-2.0 4,-0.1 52,-0.3 -22,-0.1 -0.442 121.5 20.5 -63.3 151.9 30.4 -45.9 8.6 52 52 A N T > S- 0 0 89 -24,-0.3 3,-2.0 1,-0.1 -1,-0.2 0.939 86.0-179.5 48.2 52.6 29.1 -44.8 5.1 53 53 A V T < + 0 0 11 -25,-1.2 -1,-0.1 -3,-0.6 -2,-0.1 0.755 68.8 60.7 -61.2 -28.9 32.4 -46.3 3.8 54 54 A G T 3 S+ 0 0 59 -26,-0.2 2,-0.4 -4,-0.1 -1,-0.3 0.489 97.3 72.3 -78.3 -3.9 31.7 -45.5 0.2 55 55 A T S < S- 0 0 81 -3,-2.0 2,-1.0 -4,-0.1 0, 0.0 -0.922 80.7-130.0-114.1 136.9 31.6 -41.8 0.9 56 56 A D - 0 0 80 -2,-0.4 2,-0.2 2,-0.0 -3,-0.1 -0.776 39.3-172.2 -82.8 105.6 34.6 -39.5 1.8 57 57 A E - 0 0 57 -2,-1.0 2,-1.8 -5,-0.1 47,-0.1 -0.504 37.7 -99.9 -97.7 166.3 33.3 -37.8 4.9 58 58 A N S S+ 0 0 160 -2,-0.2 -2,-0.0 45,-0.0 -1,-0.0 -0.512 79.6 124.1 -85.0 68.8 34.8 -34.9 6.9 59 59 A E S S- 0 0 23 -2,-1.8 44,-0.2 254,-0.0 45,-0.1 -0.941 70.8 -92.1-127.0 148.6 36.2 -37.2 9.6 60 60 A P - 0 0 27 0, 0.0 44,-2.4 0, 0.0 2,-0.3 -0.326 43.3-139.6 -60.0 142.8 39.8 -37.6 10.9 61 61 A E E -cd 104 197A 0 135,-2.1 137,-2.6 42,-0.2 138,-0.9 -0.795 17.5-170.7-107.4 148.0 41.7 -40.3 9.0 62 62 A V E -cd 105 199A 0 42,-2.2 44,-3.2 -2,-0.3 2,-0.4 -0.997 5.9-153.9-139.5 142.8 44.1 -42.9 10.5 63 63 A L E -cd 106 200A 0 136,-1.7 138,-2.1 -2,-0.3 2,-0.4 -0.951 9.8-175.8-124.8 135.5 46.5 -45.4 8.9 64 64 A Y E +cd 107 201A 0 42,-2.0 44,-2.8 -2,-0.4 2,-0.3 -0.992 14.9 175.1-122.1 135.8 48.0 -48.7 9.9 65 65 A T E -cd 108 202A 0 136,-2.1 138,-3.4 -2,-0.4 2,-0.3 -0.974 6.7-169.9-142.4 159.1 50.6 -50.6 7.8 66 66 A A E + d 0 203A 0 42,-1.4 45,-2.2 -2,-0.3 46,-0.2 -0.911 50.2 35.1-143.0 163.6 52.8 -53.7 8.0 67 67 A L + 0 0 1 136,-0.6 45,-0.8 5,-0.3 49,-0.2 0.857 43.6 149.2 56.3 49.9 55.6 -55.7 6.4 68 68 A H S S+ 0 0 0 135,-0.5 2,-0.5 1,-0.2 77,-0.4 0.870 77.8 53.4 -59.2 -38.0 58.0 -53.1 5.0 69 69 A H S > S- 0 0 5 1,-0.1 3,-1.8 3,-0.1 61,-0.2 -0.897 85.8-138.7-111.8 127.3 60.5 -55.8 5.8 70 70 A A T 3 S+ 0 0 0 59,-1.7 59,-0.2 -2,-0.5 -1,-0.1 0.760 97.1 50.3 -56.7 -39.7 60.0 -59.3 4.5 71 71 A R T 3 S+ 0 0 35 57,-1.2 2,-1.4 1,-0.2 -1,-0.3 0.530 85.4 89.9 -79.5 -5.5 61.0 -61.3 7.5 72 72 A E X + 0 0 3 -3,-1.8 3,-2.1 1,-0.2 4,-0.4 -0.303 47.0 154.3 -92.3 55.3 58.7 -59.4 9.9 73 73 A H T >> + 0 0 11 -2,-1.4 4,-1.3 214,-0.4 3,-1.0 0.723 58.7 71.8 -62.4 -26.8 55.7 -61.7 9.4 74 74 A L H 3> S+ 0 0 2 213,-0.3 4,-1.9 -3,-0.2 -1,-0.3 0.803 89.5 65.7 -57.2 -26.9 54.1 -61.0 12.8 75 75 A T H <> S+ 0 0 0 -3,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.844 96.3 52.9 -67.1 -34.2 53.2 -57.5 11.4 76 76 A V H <> S+ 0 0 4 -3,-1.0 4,-2.5 -4,-0.4 -1,-0.2 0.914 108.5 51.1 -65.5 -40.2 50.9 -58.9 8.8 77 77 A E H X S+ 0 0 9 -4,-1.3 4,-2.5 1,-0.2 -2,-0.2 0.885 108.5 52.9 -61.6 -37.9 49.1 -60.8 11.6 78 78 A M H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.901 108.7 48.4 -62.6 -43.6 48.9 -57.5 13.4 79 79 A A H X S+ 0 0 1 -4,-2.1 4,-1.9 30,-0.2 -2,-0.2 0.902 113.1 47.8 -64.2 -40.5 47.3 -55.8 10.4 80 80 A L H X S+ 0 0 6 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.878 110.0 52.6 -69.3 -36.3 44.8 -58.7 10.1 81 81 A Y H X S+ 0 0 52 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.913 107.4 52.2 -61.0 -43.3 44.0 -58.5 13.8 82 82 A T H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.896 107.0 53.1 -61.4 -40.7 43.4 -54.7 13.4 83 83 A L H X S+ 0 0 0 -4,-1.9 4,-1.0 1,-0.2 -1,-0.2 0.932 112.7 43.8 -57.9 -48.1 40.9 -55.5 10.6 84 84 A D H X S+ 0 0 30 -4,-2.1 4,-2.4 1,-0.2 5,-0.5 0.851 108.2 60.3 -64.6 -38.0 39.1 -58.0 12.9 85 85 A L H X S+ 0 0 6 -4,-2.6 4,-0.7 1,-0.2 -2,-0.2 0.915 109.3 39.7 -58.5 -47.5 39.2 -55.5 15.8 86 86 A F H < S+ 0 0 0 -4,-1.9 -1,-0.2 2,-0.1 -2,-0.2 0.707 124.6 38.1 -78.0 -19.6 37.2 -52.7 14.1 87 87 A T H >< S+ 0 0 1 -4,-1.0 3,-1.2 -5,-0.2 -2,-0.2 0.892 111.6 49.4 -98.7 -51.7 34.7 -55.1 12.4 88 88 A Q H 3< S+ 0 0 98 -4,-2.4 -3,-0.1 1,-0.3 -2,-0.1 0.776 117.4 44.4 -62.3 -25.9 33.9 -57.9 14.8 89 89 A N T >X S+ 0 0 55 -4,-0.7 4,-2.9 -5,-0.5 3,-2.2 0.462 81.9 124.0 -98.2 -3.7 33.2 -55.4 17.6 90 90 A Y T <4 S+ 0 0 48 -3,-1.2 4,-0.1 1,-0.3 -3,-0.1 -0.392 86.9 4.9 -63.6 132.4 31.2 -52.9 15.5 91 91 A N T 34 S+ 0 0 115 2,-0.4 -1,-0.3 -2,-0.1 3,-0.1 0.572 128.1 68.1 63.7 13.1 27.7 -52.4 17.1 92 92 A L T <4 S+ 0 0 147 -3,-2.2 2,-0.5 1,-0.4 -2,-0.2 0.640 94.8 47.3-119.9 -47.4 28.8 -54.5 20.0 93 93 A D S X S- 0 0 63 -4,-2.9 4,-2.5 1,-0.1 -2,-0.4 -0.887 72.2-148.7 -99.8 126.7 31.5 -52.5 21.8 94 94 A S H > S+ 0 0 92 -2,-0.5 4,-2.4 1,-0.2 5,-0.1 0.888 94.7 48.5 -62.6 -43.7 30.6 -48.8 22.3 95 95 A R H > S+ 0 0 71 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.934 115.1 43.3 -63.4 -47.6 34.1 -47.4 22.0 96 96 A I H > S+ 0 0 6 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.912 113.4 52.6 -66.6 -41.1 34.9 -49.3 18.8 97 97 A T H X S+ 0 0 14 -4,-2.5 4,-2.2 -8,-0.3 -2,-0.2 0.917 108.8 50.1 -57.9 -46.1 31.5 -48.4 17.4 98 98 A N H < S+ 0 0 95 -4,-2.4 4,-0.5 2,-0.2 -1,-0.2 0.849 111.0 49.6 -62.8 -36.3 32.1 -44.7 18.1 99 99 A L H >X S+ 0 0 10 -4,-1.8 3,-1.2 2,-0.2 4,-1.0 0.948 111.5 46.4 -67.3 -49.6 35.5 -44.8 16.4 100 100 A V H 3< S+ 0 0 0 -4,-2.6 -49,-2.0 1,-0.3 3,-0.3 0.869 114.0 50.7 -61.9 -34.7 34.2 -46.5 13.2 101 101 A N T 3< S+ 0 0 38 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.585 122.0 31.1 -77.5 -10.6 31.3 -44.0 13.2 102 102 A N T <4 S+ 0 0 82 -3,-1.2 2,-0.3 -4,-0.5 -2,-0.2 0.249 114.1 54.4-135.4 11.8 33.6 -41.0 13.5 103 103 A R < - 0 0 24 -4,-1.0 2,-0.6 -3,-0.3 -52,-0.3 -0.961 66.5-132.9-139.8 155.9 36.9 -41.9 11.8 104 104 A E E - c 0 61A 0 -44,-2.4 -42,-2.2 -2,-0.3 2,-0.4 -0.963 31.7-162.8-110.9 112.2 38.0 -43.1 8.4 105 105 A I E -Bc 49 62A 0 -56,-2.8 -56,-2.9 -2,-0.6 2,-0.4 -0.817 7.0-168.7-101.9 129.4 40.5 -46.0 9.1 106 106 A Y E -Bc 48 63A 11 -44,-3.2 -42,-2.0 -2,-0.4 2,-0.4 -0.940 3.6-171.7-115.6 141.2 42.9 -47.3 6.5 107 107 A I E -Bc 47 64A 0 -60,-2.0 -60,-1.8 -2,-0.4 2,-0.6 -0.994 9.4-167.0-129.4 126.0 45.0 -50.5 6.7 108 108 A V E -Bc 46 65A 0 -44,-2.8 -42,-1.4 -2,-0.4 3,-0.3 -0.955 14.7-165.9-107.4 109.0 47.7 -51.4 4.2 109 109 A F + 0 0 0 -64,-1.2 2,-0.2 -2,-0.6 -30,-0.2 0.760 66.1 7.1 -72.9 -31.7 48.3 -55.0 5.1 110 110 A N + 0 0 10 -65,-0.5 -1,-0.3 1,-0.1 -43,-0.2 -0.758 51.1 177.5-161.6 96.9 51.5 -55.9 3.3 111 111 A I S S+ 0 0 0 -45,-2.2 -43,-0.2 -3,-0.3 -44,-0.1 0.594 86.8 43.6 -85.0 -10.1 53.7 -53.3 1.6 112 112 A N > + 0 0 0 -45,-0.8 4,-2.7 -46,-0.2 -1,-0.2 -0.457 63.7 150.6-128.5 60.2 56.4 -55.8 0.6 113 113 A P H > S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.826 72.8 55.0 -67.2 -28.4 54.5 -58.9 -0.6 114 114 A D H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.941 112.6 42.4 -66.2 -48.0 57.3 -60.0 -3.0 115 115 A G H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.931 113.2 53.4 -60.6 -47.8 59.9 -60.0 -0.2 116 116 A G H X S+ 0 0 4 -4,-2.7 4,-0.6 1,-0.2 -2,-0.2 0.865 113.0 43.1 -57.1 -39.9 57.4 -61.7 2.2 117 117 A E H >X S+ 0 0 45 -4,-2.1 3,-0.9 -5,-0.2 4,-0.7 0.899 112.0 52.9 -73.8 -41.0 56.7 -64.5 -0.3 118 118 A Y H >< S+ 0 0 73 -4,-2.5 3,-1.1 1,-0.2 4,-0.4 0.902 101.3 62.3 -59.2 -39.9 60.4 -64.9 -1.2 119 119 A D H 3< S+ 0 0 0 -4,-2.6 7,-1.3 1,-0.3 -1,-0.2 0.788 117.2 27.8 -57.2 -30.6 61.2 -65.3 2.5 120 120 A I H X< S+ 0 0 4 -3,-0.9 3,-1.4 -4,-0.6 -1,-0.3 0.331 87.9 110.2-113.0 5.6 59.1 -68.4 2.8 121 121 A S T << S+ 0 0 72 -3,-1.1 -2,-0.1 -4,-0.7 -1,-0.1 0.707 82.7 42.1 -63.2 -26.0 59.3 -69.7 -0.8 122 122 A S T 3 S- 0 0 90 2,-0.4 -1,-0.3 -4,-0.4 3,-0.1 0.577 114.2-109.2 -93.9 -11.0 61.5 -72.8 -0.0 123 123 A G S < S+ 0 0 25 -3,-1.4 2,-0.4 1,-0.2 -2,-0.1 0.380 98.0 89.4 90.4 -2.0 59.6 -73.8 3.2 124 124 A S S S- 0 0 86 -122,-0.1 -2,-0.4 -121,-0.1 -1,-0.2 -0.999 88.7-105.5-127.5 132.0 62.6 -72.6 5.2 125 125 A Y - 0 0 46 -2,-0.4 -5,-0.2 1,-0.1 -6,-0.1 -0.255 25.0-168.4 -61.9 136.3 63.0 -69.1 6.4 126 126 A K - 0 0 68 -7,-1.3 -1,-0.1 2,-0.1 3,-0.1 0.612 32.1-129.1 -95.7 -15.8 65.6 -66.9 4.5 127 127 A S + 0 0 53 -8,-0.2 2,-0.1 1,-0.2 -56,-0.1 0.826 46.0 174.8 60.4 35.8 65.7 -63.9 6.9 128 128 A W + 0 0 45 -13,-0.1 -57,-1.2 1,-0.1 -1,-0.2 -0.445 16.8 173.1 -73.9 144.0 65.1 -61.7 3.8 129 129 A R + 0 0 19 -59,-0.2 -59,-1.7 -60,-0.1 16,-0.2 0.754 49.2 62.3-116.1 -46.9 64.6 -58.0 4.5 130 130 A K S S- 0 0 3 -61,-0.2 -60,-0.3 1,-0.2 14,-0.2 0.056 84.5 -92.1 -81.2-178.2 64.4 -56.0 1.3 131 131 A N - 0 0 0 12,-2.2 -1,-0.2 2,-0.1 -2,-0.1 -0.070 39.0-109.3 -76.8-166.2 62.0 -56.0 -1.7 132 132 A R S S+ 0 0 44 10,-0.1 -1,-0.0 2,-0.1 10,-0.0 0.051 70.3 129.5-118.7 26.7 62.7 -58.2 -4.8 133 133 A Q - 0 0 33 10,-0.1 9,-2.6 8,-0.1 -2,-0.1 -0.685 57.8-124.4 -82.5 123.2 63.6 -55.4 -7.3 134 134 A P - 0 0 70 0, 0.0 2,-0.5 0, 0.0 7,-0.1 -0.234 16.0-130.9 -67.6 160.7 66.8 -56.1 -9.1 135 135 A N > - 0 0 19 3,-0.4 3,-1.8 5,-0.3 5,-0.1 -0.966 24.0-113.2-116.5 124.7 69.7 -53.6 -9.1 136 136 A S T 3 S+ 0 0 100 -2,-0.5 3,-0.1 1,-0.3 0, 0.0 -0.282 98.5 7.7 -58.2 131.7 71.4 -52.6 -12.3 137 137 A G T 3 S+ 0 0 91 1,-0.2 2,-0.3 2,-0.0 -1,-0.3 0.538 115.4 91.3 75.8 8.9 75.1 -53.8 -12.6 138 138 A S < - 0 0 43 -3,-1.8 -3,-0.4 2,-0.1 -1,-0.2 -0.975 65.6-148.4-136.6 146.9 74.8 -55.9 -9.4 139 139 A S S S+ 0 0 104 -2,-0.3 2,-0.5 -5,-0.1 -1,-0.1 0.551 76.0 100.4 -85.1 -9.4 73.9 -59.5 -8.5 140 140 A Y - 0 0 135 -5,-0.1 -5,-0.3 -6,-0.0 2,-0.3 -0.689 66.4-147.0 -84.6 122.0 72.5 -58.2 -5.2 141 141 A V + 0 0 38 -2,-0.5 -11,-0.2 -7,-0.1 -8,-0.1 -0.629 42.4 23.1 -91.5 140.4 68.7 -58.0 -5.3 142 142 A G - 0 0 0 -9,-2.6 2,-0.4 -2,-0.3 28,-0.2 0.198 54.2-113.0 103.0 154.6 66.4 -55.5 -3.5 143 143 A T - 0 0 1 26,-0.1 -12,-2.2 -14,-0.1 2,-0.9 -0.940 33.5-114.5-121.5 142.5 66.0 -52.1 -1.8 144 144 A D > - 0 0 0 24,-3.0 3,-2.1 -2,-0.4 4,-0.3 -0.719 26.0-156.8 -75.7 107.6 65.3 -51.5 1.9 145 145 A L G > S+ 0 0 0 -2,-0.9 3,-1.2 -77,-0.4 4,-0.2 0.823 89.4 61.8 -59.2 -30.4 61.8 -50.1 1.6 146 146 A N G 3 S+ 0 0 12 1,-0.2 -1,-0.3 2,-0.1 23,-0.1 0.222 107.6 43.1 -85.8 17.3 62.2 -48.3 5.0 147 147 A R G < S+ 0 0 9 -3,-2.1 7,-0.3 21,-0.2 -1,-0.2 0.179 97.4 79.7-127.3 8.2 65.1 -46.3 3.6 148 148 A N < + 0 0 0 -3,-1.2 26,-3.2 -4,-0.3 27,-0.2 0.413 62.8 109.3-102.4 1.0 63.5 -45.5 0.3 149 149 A Y - 0 0 0 110,-2.8 112,-0.1 -4,-0.2 31,-0.1 -0.389 70.0-123.4 -78.8 163.0 61.1 -42.6 1.3 150 150 A G S > S+ 0 0 29 23,-0.1 2,-0.9 2,-0.1 3,-0.9 0.524 73.4 105.1 -93.3 -8.9 61.9 -39.1 0.2 151 151 A Y T 3 S- 0 0 39 1,-0.3 108,-0.8 109,-0.3 109,-0.2 -0.654 113.1 -24.2 -82.4 108.5 62.2 -36.9 3.3 152 152 A K T > S- 0 0 76 -2,-0.9 3,-1.8 1,-0.2 4,-0.3 0.803 90.6-168.6 56.7 35.9 66.0 -36.3 3.7 153 153 A W T < - 0 0 72 -3,-0.9 -1,-0.2 1,-0.3 20,-0.1 -0.256 66.8 -3.6 -53.8 130.8 66.7 -39.5 1.8 154 154 A G T 3 S+ 0 0 27 -7,-0.3 -1,-0.3 -3,-0.1 3,-0.2 0.678 99.2 123.3 57.3 25.0 70.3 -40.5 2.0 155 155 A C < + 0 0 61 -3,-1.8 -2,-0.1 1,-0.1 -1,-0.1 0.826 69.9 28.2 -78.7 -35.7 71.3 -37.4 4.0 156 156 A C S S- 0 0 56 -4,-0.3 -1,-0.1 61,-0.0 100,-0.1 0.023 105.5 -92.1-136.3 23.0 72.8 -38.6 7.2 157 157 A G S S+ 0 0 69 -3,-0.2 99,-0.1 1,-0.1 -2,-0.0 0.666 87.1 123.7 69.1 17.8 74.5 -42.0 7.0 158 158 A G S S+ 0 0 6 99,-0.1 100,-1.0 58,-0.1 2,-0.3 0.157 75.5 19.7 -93.1 18.9 71.3 -43.8 8.1 159 159 A S S S- 0 0 14 98,-0.2 2,-0.3 -5,-0.1 9,-0.2 -0.930 82.3-102.3-167.9 177.6 71.3 -46.0 5.0 160 160 A S B -h 168 0B 26 7,-2.1 9,-2.6 -2,-0.3 10,-0.3 -0.896 2.4-154.2-121.1 148.8 73.6 -47.4 2.3 161 161 A G S S+ 0 0 45 -2,-0.3 7,-0.1 7,-0.2 -1,-0.1 0.325 73.4 98.7 -92.9 4.4 74.3 -46.6 -1.3 162 162 A S > - 0 0 62 1,-0.1 3,-2.2 5,-0.0 5,-0.1 -0.838 69.1-144.9 -99.3 124.4 75.6 -50.1 -1.9 163 163 A P T 3 S+ 0 0 32 0, 0.0 5,-0.2 0, 0.0 -1,-0.1 0.783 99.6 62.0 -55.2 -30.5 73.1 -52.7 -3.5 164 164 A S T 3 S+ 0 0 68 3,-0.1 2,-0.1 -3,-0.0 -23,-0.1 0.673 85.3 104.5 -66.2 -18.6 74.6 -55.5 -1.4 165 165 A S S X S- 0 0 27 -3,-2.2 3,-1.4 1,-0.1 -21,-0.1 -0.393 71.6-140.1 -74.3 142.0 73.5 -53.7 1.8 166 166 A E T 3 S+ 0 0 76 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.715 110.6 46.1 -65.3 -21.7 70.6 -54.7 3.9 167 167 A T T 3 S+ 0 0 40 -5,-0.1 -7,-2.1 -24,-0.0 -1,-0.3 0.032 78.8 154.5-110.0 24.6 69.9 -51.0 4.3 168 168 A Y B < -h 160 0B 15 -3,-1.4 -24,-3.0 -9,-0.2 -21,-0.2 -0.350 34.1-153.4 -54.2 124.9 70.4 -50.1 0.5 169 169 A R - 0 0 47 -9,-2.6 6,-0.3 1,-0.3 3,-0.2 0.430 36.4-112.7 -86.5 -1.0 68.3 -47.0 -0.0 170 170 A G - 0 0 3 -10,-0.3 -1,-0.3 -28,-0.2 3,-0.1 -0.198 38.8 -70.4 89.4 171.6 67.6 -47.5 -3.8 171 171 A R S S- 0 0 187 1,-0.2 2,-0.3 -3,-0.1 -1,-0.2 0.768 113.9 -7.6 -69.6 -28.4 68.9 -45.5 -6.8 172 172 A S S > S- 0 0 61 -3,-0.2 3,-1.7 -24,-0.0 4,-0.2 -0.959 96.1 -65.5-158.6 165.3 66.6 -42.5 -5.8 173 173 A A T 3 S+ 0 0 36 -2,-0.3 -24,-0.2 1,-0.3 -23,-0.1 -0.402 122.8 8.0 -59.2 134.4 63.9 -41.7 -3.4 174 174 A F T 3 S+ 0 0 27 -26,-3.2 -1,-0.3 -29,-0.1 6,-0.1 0.726 82.7 139.2 62.0 26.7 60.8 -43.7 -4.2 175 175 A S < + 0 0 30 -3,-1.7 -2,-0.1 -6,-0.3 -1,-0.1 0.707 53.6 81.5 -68.0 -21.9 62.7 -45.9 -6.7 176 176 A A S > S- 0 0 0 -4,-0.2 4,-2.3 -28,-0.2 5,-0.2 -0.720 80.2-140.0 -85.2 135.3 60.8 -48.9 -5.3 177 177 A P H > S+ 0 0 41 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.845 100.8 58.8 -63.7 -29.5 57.2 -49.3 -6.7 178 178 A E H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.935 110.6 38.7 -65.0 -48.1 56.0 -50.3 -3.2 179 179 A T H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.868 112.7 57.5 -72.1 -35.7 57.1 -47.0 -1.5 180 180 A A H X S+ 0 0 17 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.894 107.5 49.3 -57.1 -39.4 56.0 -45.0 -4.5 181 181 A A H X S+ 0 0 9 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.907 110.6 48.5 -67.8 -43.0 52.5 -46.5 -4.1 182 182 A M H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.917 112.3 50.4 -60.6 -44.1 52.5 -45.6 -0.3 183 183 A R H X S+ 0 0 73 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.940 111.0 47.8 -56.7 -51.5 53.6 -42.1 -1.2 184 184 A D H X S+ 0 0 88 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.869 112.4 49.9 -62.6 -38.1 50.9 -41.7 -3.9 185 185 A F H X S+ 0 0 17 -4,-2.3 4,-0.6 2,-0.2 -1,-0.2 0.959 113.3 43.6 -65.7 -50.3 48.2 -43.0 -1.5 186 186 A I H >< S+ 0 0 0 -4,-2.6 3,-1.2 1,-0.2 10,-0.2 0.915 113.8 52.1 -63.4 -40.5 49.2 -40.7 1.4 187 187 A N H >< S+ 0 0 63 -4,-2.9 3,-1.6 1,-0.2 -1,-0.2 0.846 102.5 60.5 -60.1 -33.7 49.5 -37.8 -1.0 188 188 A S H 3< S+ 0 0 65 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.667 93.0 66.5 -70.1 -16.3 46.0 -38.6 -2.3 189 189 A R T << S+ 0 0 32 -3,-1.2 7,-2.5 -4,-0.6 2,-0.8 0.333 70.8 105.6 -89.8 7.8 44.6 -38.0 1.2 190 190 A V E < +I 195 0C 57 -3,-1.6 2,-0.4 5,-0.3 5,-0.3 -0.826 53.9 178.4 -81.2 110.7 45.5 -34.3 0.9 191 191 A V E > -I 194 0C 59 3,-2.7 3,-1.6 -2,-0.8 -2,-0.1 -0.984 63.3 -2.9-124.8 127.5 42.0 -32.9 0.4 192 192 A G T 3 S- 0 0 81 -2,-0.4 -1,-0.2 1,-0.3 3,-0.1 0.802 132.8 -57.5 59.6 30.3 41.3 -29.2 0.1 193 193 A G T 3 S+ 0 0 69 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.385 119.3 103.9 84.7 -2.0 45.1 -28.6 0.7 194 194 A K E < S-I 191 0C 147 -3,-1.6 -3,-2.7 -5,-0.0 2,-0.3 -0.948 74.7-120.2-120.1 130.1 45.1 -30.4 4.1 195 195 A Q E -I 190 0C 17 -2,-0.4 -5,-0.3 -5,-0.3 -8,-0.1 -0.497 21.2-161.8 -63.0 125.5 46.4 -33.9 4.9 196 196 A Q + 0 0 28 -7,-2.5 -135,-2.1 -2,-0.3 2,-0.5 0.758 67.5 85.8 -85.7 -26.9 43.4 -35.9 6.2 197 197 A I E +d 61 0A 2 -11,-0.2 -135,-0.2 -8,-0.2 3,-0.1 -0.657 50.8 172.6 -75.0 124.0 45.5 -38.6 7.9 198 198 A K E + 0 0 76 -137,-2.6 74,-2.6 -2,-0.5 2,-0.3 0.719 60.9 17.9-106.0 -29.8 46.4 -37.4 11.4 199 199 A T E +de 62 272A 0 -138,-0.9 -136,-1.7 72,-0.2 2,-0.3 -0.965 62.9 176.3-140.3 153.6 48.0 -40.4 13.0 200 200 A L E -de 63 273A 0 72,-2.0 74,-2.4 -2,-0.3 2,-0.4 -0.987 18.4-150.4-154.1 155.0 49.5 -43.7 11.8 201 201 A I E -de 64 274A 0 -138,-2.1 -136,-2.1 -2,-0.3 2,-0.5 -1.000 7.3-163.6-123.0 130.0 51.3 -46.8 13.0 202 202 A T E -de 65 275A 0 72,-2.6 74,-2.1 -2,-0.4 2,-0.4 -0.969 21.2-140.3-108.6 121.0 53.8 -48.7 10.8 203 203 A F E +de 66 276A 1 -138,-3.4 -136,-0.6 -2,-0.5 -135,-0.5 -0.706 32.1 153.4 -92.6 131.7 54.4 -52.2 12.3 204 204 A H E - e 0 277A 0 72,-3.3 74,-2.8 -2,-0.4 2,-0.3 -0.796 32.5 -93.3-133.6 171.2 57.8 -53.8 12.3 205 205 A T E + e 0 278A 3 72,-0.3 74,-0.1 -2,-0.2 82,-0.1 -0.953 62.2 30.3-132.8 159.1 59.6 -56.4 14.4 206 206 A Y S S+ 0 0 51 72,-0.7 73,-0.2 74,-0.4 -1,-0.2 0.721 81.5 41.4-131.3 169.7 61.4 -56.8 16.7 207 207 A S S S- 0 0 41 71,-1.8 72,-0.2 73,-1.4 71,-0.2 0.074 84.4-104.2 155.7 -15.5 62.4 -55.2 20.1 208 208 A E S S+ 0 0 27 70,-1.0 39,-2.5 69,-0.7 2,-0.3 0.978 71.5 144.9 64.7 61.5 59.1 -54.1 21.8 209 209 A L E -fG 247 277A 15 68,-1.6 68,-2.9 37,-0.3 2,-0.5 -0.939 48.3-150.1-128.7 148.0 59.5 -50.4 21.0 210 210 A I E -fG 248 276A 0 37,-2.5 39,-2.8 -2,-0.3 2,-0.4 -0.983 28.8-168.1-114.2 112.9 57.3 -47.4 20.2 211 211 A L E -fG 249 275A 9 64,-3.2 64,-2.7 -2,-0.5 39,-0.2 -0.860 9.5-171.4-108.1 135.6 59.5 -45.1 18.0 212 212 A Y E -f 250 0A 4 37,-1.5 39,-3.3 -2,-0.4 40,-0.3 -0.890 34.7 -51.5-119.4 156.6 58.6 -41.5 17.0 213 213 A P S S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 -0.152 87.2 61.3 -66.2 163.6 60.5 -39.3 14.5 214 214 A Y + 0 0 0 43,-0.1 38,-1.2 36,-0.1 3,-0.1 0.469 37.9 161.3 -99.2 150.3 63.0 -38.1 13.7 215 215 A G S S+ 0 0 0 36,-0.2 42,-1.5 1,-0.1 43,-0.1 0.765 71.4 69.1 -80.6 -30.7 65.3 -40.9 12.7 216 216 A Y S S+ 0 0 23 40,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.672 105.5 30.9 -71.1 -18.6 67.7 -38.7 10.6 217 217 A T - 0 0 26 2,-0.2 35,-0.3 -3,-0.1 -1,-0.1 -0.990 62.8-137.9-141.4 147.1 69.1 -36.8 13.6 218 218 A Y S S+ 0 0 158 -2,-0.3 -1,-0.1 34,-0.1 32,-0.1 0.717 74.8 113.1 -69.6 -22.9 69.9 -37.3 17.3 219 219 A T - 0 0 75 1,-0.1 -2,-0.2 2,-0.0 33,-0.1 -0.307 63.2-148.2 -56.3 125.8 68.5 -33.8 17.9 220 220 A D S S+ 0 0 84 1,-0.3 -1,-0.1 -2,-0.0 -3,-0.0 0.913 89.1 16.5 -62.4 -48.6 65.3 -34.1 19.9 221 221 A V S S- 0 0 45 9,-0.0 -1,-0.3 8,-0.0 6,-0.1 -0.731 83.2-177.8-131.2 80.2 63.5 -31.1 18.4 222 222 A P > - 0 0 13 0, 0.0 3,-1.9 0, 0.0 -5,-0.0 -0.139 47.9 -88.3 -74.2 176.8 65.3 -30.0 15.2 223 223 A S T 3 S+ 0 0 129 1,-0.3 -2,-0.0 3,-0.0 0, 0.0 0.722 126.7 57.4 -59.6 -22.9 64.3 -27.0 13.0 224 224 A D T 3 S+ 0 0 21 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.063 101.2 65.0 -99.1 23.6 61.8 -29.2 11.1 225 225 A M S < S- 0 0 9 -3,-1.9 2,-0.2 -4,-0.1 42,-0.0 -0.990 76.4-135.9-137.8 136.9 59.8 -30.2 14.2 226 226 A T > - 0 0 72 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.593 20.6-123.4 -85.3 154.9 57.8 -27.9 16.5 227 227 A Q H > S+ 0 0 100 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.907 115.1 55.4 -61.7 -40.1 58.1 -28.2 20.3 228 228 A D H > S+ 0 0 56 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.926 108.4 47.9 -54.7 -47.3 54.3 -28.7 20.4 229 229 A D H > S+ 0 0 6 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.909 110.1 51.3 -64.6 -42.2 54.7 -31.7 18.0 230 230 A F H X S+ 0 0 23 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.934 109.0 51.7 -57.1 -47.1 57.5 -33.2 20.0 231 231 A N H X S+ 0 0 58 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.890 110.3 48.9 -58.1 -40.6 55.3 -32.9 23.2 232 232 A V H X S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 5,-0.3 0.947 112.2 47.9 -63.5 -49.5 52.5 -34.7 21.3 233 233 A F H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.934 114.9 45.4 -55.1 -50.3 54.8 -37.5 20.1 234 234 A K H X S+ 0 0 85 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.915 115.9 45.9 -61.9 -45.9 56.3 -38.0 23.6 235 235 A T H X S+ 0 0 48 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.929 115.3 45.8 -65.2 -48.3 52.9 -37.9 25.4 236 236 A M H X S+ 0 0 0 -4,-3.1 4,-2.5 -5,-0.2 5,-0.2 0.924 113.5 49.2 -61.6 -45.7 51.3 -40.3 22.9 237 237 A A H X S+ 0 0 0 -4,-2.8 4,-2.4 -5,-0.3 -2,-0.2 0.926 112.9 47.4 -61.3 -43.0 54.2 -42.7 22.9 238 238 A N H X S+ 0 0 72 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.886 112.4 49.6 -66.5 -38.2 54.3 -42.8 26.7 239 239 A T H X S+ 0 0 56 -4,-2.4 4,-0.7 2,-0.2 -1,-0.2 0.895 112.3 46.9 -68.2 -40.4 50.5 -43.3 26.9 240 240 A M H >X S+ 0 0 1 -4,-2.5 4,-1.2 1,-0.2 3,-1.0 0.900 107.1 57.9 -68.0 -37.8 50.6 -46.2 24.4 241 241 A A H 3X S+ 0 0 15 -4,-2.4 4,-2.6 1,-0.3 3,-0.3 0.869 97.4 62.4 -58.2 -39.0 53.6 -47.8 26.3 242 242 A Q H 3< S+ 0 0 170 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.843 108.1 43.6 -51.9 -35.8 51.4 -47.9 29.4 243 243 A T H << S+ 0 0 63 -3,-1.0 -1,-0.2 -4,-0.7 -2,-0.2 0.725 126.4 24.6 -89.2 -24.7 49.0 -50.2 27.6 244 244 A N H < S- 0 0 7 -4,-1.2 -2,-0.2 -3,-0.3 -3,-0.2 0.482 93.6-122.4-121.7 -5.2 51.4 -52.7 25.8 245 245 A G < + 0 0 54 -4,-2.6 -4,-0.1 -5,-0.2 -3,-0.1 0.652 63.1 140.1 71.5 15.2 54.6 -52.6 27.9 246 246 A Y - 0 0 7 -5,-0.2 -37,-0.3 -6,-0.2 -1,-0.2 -0.387 58.8-105.4 -78.6 167.0 56.8 -51.5 25.0 247 247 A T E -f 209 0A 74 -39,-2.5 -37,-2.5 -40,-0.1 2,-0.4 -0.862 29.7-144.5 -98.1 121.4 59.6 -48.9 25.4 248 248 A P E +f 210 0A 35 0, 0.0 2,-0.3 0, 0.0 -37,-0.2 -0.699 36.8 139.3 -86.0 132.0 58.8 -45.5 24.0 249 249 A Q E -f 211 0A 42 -39,-2.8 -37,-1.5 -2,-0.4 2,-0.2 -0.991 54.6 -84.8-162.0 165.1 61.7 -43.6 22.4 250 250 A Q E >> -f 212 0A 0 -2,-0.3 3,-1.7 -39,-0.2 4,-0.5 -0.504 43.3-118.5 -72.9 143.3 62.8 -41.4 19.6 251 251 A A H >> S+ 0 0 10 -39,-3.3 3,-1.7 1,-0.3 4,-1.5 0.882 112.6 53.2 -49.5 -47.7 63.8 -43.3 16.5 252 252 A S H 34 S+ 0 0 2 -38,-1.2 -1,-0.3 -35,-0.3 4,-0.1 0.638 93.0 72.2 -69.8 -13.6 67.4 -42.0 16.5 253 253 A D H <4 S+ 0 0 88 -3,-1.7 -1,-0.3 2,-0.1 -2,-0.2 0.713 104.1 42.6 -70.8 -20.3 67.8 -43.1 20.1 254 254 A L H << S- 0 0 64 -3,-1.7 2,-0.3 -4,-0.5 -2,-0.2 0.919 138.9 -53.7 -81.1 -64.5 67.9 -46.6 18.6 255 255 A Y < - 0 0 113 -4,-1.5 -1,-0.3 -97,-0.0 2,-0.2 -0.949 62.3 -79.4-166.3 162.7 70.1 -45.6 15.7 256 256 A I + 0 0 30 -2,-0.3 2,-0.3 -4,-0.1 -40,-0.2 -0.464 49.1 173.4 -66.8 130.2 70.2 -43.0 12.9 257 257 A T - 0 0 12 -42,-1.5 2,-0.3 -2,-0.2 -98,-0.2 -0.977 13.1-165.3-129.4 152.5 68.0 -43.8 9.9 258 258 A D S S+ 0 0 0 -100,-1.0 -105,-0.1 -2,-0.3 -106,-0.1 -0.980 70.4 25.8-132.3 149.4 67.2 -41.7 6.8 259 259 A G S S+ 0 0 0 -108,-0.8 -110,-2.8 -2,-0.3 -111,-0.1 0.665 80.4 147.3 76.2 18.5 64.5 -42.3 4.3 260 260 A D > - 0 0 4 -113,-0.2 4,-1.4 -109,-0.2 -109,-0.3 -0.393 59.5-110.3 -80.5 166.7 62.1 -44.2 6.6 261 261 A M H > S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.875 113.7 50.2 -62.5 -42.2 58.3 -43.9 6.4 262 262 A T H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.4 0.873 106.0 54.4 -72.9 -36.2 57.8 -42.0 9.6 263 263 A D H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.894 116.1 41.9 -58.7 -39.3 60.4 -39.3 8.8 264 264 A W H X>S+ 0 0 9 -4,-1.4 4,-2.8 3,-0.2 5,-0.7 0.932 113.3 50.1 -74.0 -46.0 58.5 -38.8 5.5 265 265 A A H X5S+ 0 0 0 -4,-3.1 6,-1.9 1,-0.2 4,-1.1 0.918 124.0 31.5 -59.8 -44.0 54.9 -39.0 7.0 266 266 A Y H X5S+ 0 0 0 -4,-2.8 4,-1.9 4,-0.3 -2,-0.2 0.925 122.2 48.1 -78.4 -47.1 55.8 -36.4 9.7 267 267 A G H <5S+ 0 0 10 -4,-2.3 -3,-0.2 -5,-0.4 -2,-0.2 0.909 125.2 28.3 -61.6 -43.5 58.4 -34.4 7.7 268 268 A Q H <5S+ 0 0 111 -4,-2.8 -1,-0.2 -5,-0.3 -3,-0.2 0.827 140.3 16.8 -89.1 -33.9 56.2 -34.0 4.6 269 269 A H H < S- 0 0 53 2,-0.2 4,-1.7 4,-0.1 -75,-0.1 -0.779 91.9 -87.4-140.4 175.4 65.9 -60.3 21.6 283 283 A Y T 4 S+ 0 0 171 -2,-0.2 4,-0.2 2,-0.2 -1,-0.0 0.655 95.9 90.9 -63.6 -24.6 67.4 -62.4 18.8 284 284 A N T 4 S+ 0 0 131 1,-0.3 -2,-0.2 2,-0.1 -3,-0.2 -0.976 114.5 1.1-108.3 113.3 65.8 -65.7 20.1 285 285 A P T >4 S+ 0 0 47 0, 0.0 3,-2.1 0, 0.0 -1,-0.3 -0.989 102.4 156.4 -85.7 0.5 63.2 -65.9 18.7 286 286 A G T 3< S- 0 0 3 -4,-1.7 -80,-0.1 1,-0.3 -2,-0.1 -0.225 74.0 -3.7 56.2-126.9 64.0 -62.7 16.8 287 287 A F T 3 S+ 0 0 49 1,-0.2 -214,-0.4 -4,-0.2 -213,-0.3 0.589 132.9 58.6 -75.5 -9.1 62.2 -62.4 13.5 288 288 A Y < + 0 0 42 -3,-2.1 -1,-0.2 -216,-0.1 -2,-0.1 -0.490 63.7 171.6-126.7 64.0 60.5 -65.8 13.8 289 289 A P - 0 0 1 0, 0.0 5,-0.1 0, 0.0 -5,-0.0 -0.402 46.7 -93.9 -68.2 148.9 58.4 -66.2 16.9 290 290 A P > - 0 0 56 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.290 31.4-115.8 -62.7 148.9 56.4 -69.4 17.0 291 291 A D G > S+ 0 0 27 -286,-0.3 3,-1.5 1,-0.3 4,-0.4 0.715 107.6 79.7 -61.6 -17.8 52.8 -69.1 15.7 292 292 A E G 3 S+ 0 0 150 1,-0.2 4,-0.3 2,-0.1 -1,-0.3 0.717 91.5 51.6 -58.4 -22.5 51.6 -69.9 19.2 293 293 A V G <> S+ 0 0 11 -3,-2.1 4,-3.0 1,-0.1 5,-0.3 0.510 80.9 95.5 -94.6 -4.7 52.2 -66.3 20.2 294 294 A I H <> S+ 0 0 23 -3,-1.5 4,-1.6 -4,-0.2 5,-0.3 0.916 86.2 44.6 -54.2 -52.2 50.3 -64.6 17.3 295 295 A G H > S+ 0 0 49 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.930 118.0 44.5 -58.9 -47.2 47.0 -64.1 19.2 296 296 A R H > S+ 0 0 134 -4,-0.3 4,-1.4 1,-0.2 -2,-0.2 0.937 115.6 44.9 -61.7 -50.1 48.8 -62.8 22.4 297 297 A E H < S+ 0 0 7 -4,-3.0 -18,-0.2 2,-0.2 -1,-0.2 0.611 116.4 44.7 -81.6 -13.2 51.3 -60.5 20.7 298 298 A T H >< S+ 0 0 4 -4,-1.6 3,-2.1 -5,-0.3 -1,-0.2 0.882 113.9 47.4 -87.3 -52.3 48.8 -58.9 18.3 299 299 A S H >< S+ 0 0 53 -4,-2.0 3,-2.0 -5,-0.3 4,-0.3 0.746 96.6 76.0 -60.5 -23.9 46.0 -58.4 20.8 300 300 A R T 3< S+ 0 0 69 -4,-1.4 -1,-0.3 1,-0.3 3,-0.3 0.792 95.9 49.2 -53.0 -31.1 48.6 -56.9 23.2 301 301 A N T <> S+ 0 0 0 -3,-2.1 4,-2.6 1,-0.2 -1,-0.3 0.282 78.5 108.1 -95.3 9.6 48.5 -53.8 21.0 302 302 A K H <> S+ 0 0 85 -3,-2.0 4,-2.3 1,-0.2 5,-0.2 0.924 81.4 43.3 -53.3 -53.8 44.7 -53.5 21.0 303 303 A E H > S+ 0 0 80 -4,-0.3 4,-2.5 -3,-0.3 -1,-0.2 0.868 113.5 51.8 -66.0 -34.8 44.5 -50.4 23.3 304 304 A A H > S+ 0 0 0 -4,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.911 109.4 50.7 -66.0 -41.6 47.4 -48.7 21.4 305 305 A V H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.924 113.5 44.5 -60.8 -45.7 45.6 -49.2 18.1 306 306 A L H X S+ 0 0 4 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.886 110.1 57.1 -67.6 -37.5 42.4 -47.8 19.5 307 307 A Y H X S+ 0 0 23 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.918 106.0 47.3 -60.5 -47.3 44.3 -44.9 21.1 308 308 A V H X S+ 0 0 0 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.867 113.1 50.0 -64.4 -34.1 45.9 -43.7 17.8 309 309 A A H >< S+ 0 0 0 -4,-1.5 3,-0.7 -5,-0.2 4,-0.3 0.918 112.2 48.1 -66.2 -43.9 42.5 -43.9 16.1 310 310 A E H >< S+ 0 0 65 -4,-2.6 3,-1.4 1,-0.2 -2,-0.2 0.935 110.1 50.4 -59.8 -48.5 40.9 -41.9 18.9 311 311 A K H 3< S+ 0 0 39 -4,-2.6 -1,-0.2 1,-0.3 6,-0.2 0.528 83.4 88.5 -77.2 -4.8 43.6 -39.2 18.9 312 312 A A T << S+ 0 0 1 -3,-0.7 2,-1.1 -4,-0.6 -1,-0.3 0.801 75.5 76.8 -58.0 -28.5 43.3 -38.6 15.1 313 313 A D S < S- 0 0 95 -3,-1.4 4,-0.1 -4,-0.3 -1,-0.1 -0.767 129.4 -28.6 -83.4 99.0 40.6 -36.1 16.2 314 314 A a > - 0 0 21 -2,-1.1 3,-1.9 1,-0.1 -1,-0.3 0.985 64.4-164.8 53.2 80.4 42.9 -33.3 17.3 315 315 A P G > S+ 0 0 8 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.804 85.0 72.6 -59.7 -27.6 46.2 -35.0 18.5 316 316 A Y G > >S+ 0 0 58 1,-0.3 5,-2.4 2,-0.2 3,-1.2 0.596 75.0 81.8 -65.9 -10.5 47.1 -31.7 20.2 317 317 A S G X 5S+ 0 0 54 -3,-1.9 3,-1.1 1,-0.2 -1,-0.3 0.812 79.4 67.3 -60.1 -29.7 44.4 -32.5 22.8 318 318 A V G < 5S+ 0 0 32 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.695 106.3 39.5 -68.4 -18.5 46.9 -34.7 24.6 319 319 A I G < 5S- 0 0 48 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.2 0.298 127.3 -98.8-109.5 3.8 49.0 -31.6 25.5 320 320 A G T < 5S+ 0 0 70 -3,-1.1 2,-0.3 1,-0.3 -3,-0.2 0.546 80.1 126.8 96.2 11.0 45.9 -29.6 26.2 321 321 A K < - 0 0 100 -5,-2.4 -1,-0.3 -6,-0.1 2,-0.2 -0.718 50.2-133.0-103.0 150.6 45.5 -27.6 23.0 322 322 A S 0 0 117 -2,-0.3 -8,-0.0 -5,-0.1 -1,-0.0 -0.575 360.0 360.0 -95.4 164.2 42.4 -27.2 20.7 323 323 A a 0 0 119 -2,-0.2 -1,-0.1 -9,-0.0 -10,-0.0 -0.606 360.0 360.0-114.6 360.0 42.4 -27.6 16.9