==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 30-MAR-11 3RC1 . COMPND 2 MOLECULE: SUGAR 3-KETOREDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ACTINOMADURA KIJANIATA; . AUTHOR H.M.HOLDEN,R.L.KUBIAK . 325 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14732.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 245 75.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 12.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 14.5 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 . 2 0.6 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 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 28.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 3.1 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 0 3 0 1 0 0 2 2 0 1 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 3 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 0 1 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 8 A N 0 0 190 0, 0.0 3,-0.1 0, 0.0 28,-0.0 0.000 360.0 360.0 360.0 128.4 23.3 14.3 -45.9 2 9 A P - 0 0 52 0, 0.0 26,-0.3 0, 0.0 2,-0.2 -0.298 360.0 -97.0 -63.7 155.4 25.6 14.4 -42.9 3 10 A I E -a 28 0A 8 24,-2.7 26,-3.1 1,-0.1 2,-0.7 -0.558 37.9-126.1 -73.3 141.0 26.9 17.8 -41.8 4 11 A R E -a 29 0A 89 -2,-0.2 62,-3.1 24,-0.2 63,-1.7 -0.801 29.2-159.9 -94.6 115.8 30.4 18.4 -43.3 5 12 A V E -ab 30 67A 3 24,-3.1 26,-2.2 -2,-0.7 27,-1.1 -0.850 10.8-166.5-104.8 135.7 32.8 19.2 -40.4 6 13 A G E -ab 32 68A 0 61,-2.4 63,-2.4 -2,-0.4 2,-0.5 -0.911 12.7-146.6-114.2 143.7 36.2 21.0 -40.8 7 14 A V E -ab 33 69A 0 25,-2.1 27,-3.0 -2,-0.4 2,-0.7 -0.952 3.7-158.2-112.8 125.3 38.6 21.0 -37.9 8 15 A I E S+a 34 0A 0 61,-2.5 27,-0.2 -2,-0.5 64,-0.1 -0.911 70.6 25.2-101.6 104.7 40.9 24.0 -37.3 9 16 A G S S- 0 0 5 25,-2.3 2,-1.9 -2,-0.7 26,-0.2 0.390 74.4-123.8 113.1 113.5 43.9 22.9 -35.2 10 17 A C + 0 0 8 23,-0.1 2,-0.1 4,-0.1 -1,-0.1 -0.576 51.9 175.6 -84.5 71.4 45.3 19.4 -35.1 11 18 A A > - 0 0 20 -2,-1.9 4,-2.4 1,-0.1 5,-0.2 -0.374 45.8-119.7 -82.8 154.7 44.9 19.3 -31.3 12 19 A D H > S+ 0 0 85 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.917 117.7 53.2 -55.6 -41.3 45.6 16.5 -28.9 13 20 A I H >>S+ 0 0 44 1,-0.2 5,-2.3 2,-0.2 4,-2.2 0.864 108.6 50.1 -67.4 -32.6 41.9 16.6 -27.8 14 21 A A H 4>S+ 0 0 0 3,-0.2 5,-2.8 4,-0.2 -1,-0.2 0.950 113.2 44.8 -64.4 -47.6 40.9 16.4 -31.5 15 22 A W H <5S+ 0 0 58 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.918 123.7 35.3 -62.7 -41.1 43.2 13.3 -32.1 16 23 A R H <5S+ 0 0 110 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.870 136.7 0.3 -84.8 -37.6 42.1 11.6 -28.9 17 24 A R T X5S+ 0 0 65 -4,-2.2 4,-1.4 -5,-0.2 -3,-0.2 0.745 123.7 45.6-121.5 -55.7 38.4 12.4 -28.4 18 25 A A H > S+ 0 0 38 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.890 112.4 47.5 -62.9 -32.2 37.2 9.6 -33.4 21 28 A A H X S+ 0 0 6 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.927 113.5 47.2 -67.3 -47.3 33.6 10.7 -32.4 22 29 A L H < S+ 0 0 5 -4,-2.8 6,-0.3 1,-0.2 -3,-0.2 0.916 111.5 51.4 -60.9 -41.1 33.2 12.6 -35.7 23 30 A E H < S+ 0 0 107 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.915 115.9 40.7 -61.3 -40.3 34.5 9.7 -37.7 24 31 A A H < S+ 0 0 74 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.686 93.5 95.5 -83.7 -25.0 32.1 7.2 -36.1 25 32 A E >< - 0 0 16 -4,-1.9 3,-1.7 1,-0.1 -4,-0.0 -0.601 63.6-151.7 -74.3 120.9 29.1 9.5 -36.0 26 33 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.826 93.4 59.1 -61.0 -29.3 26.7 8.9 -39.0 27 34 A L T 3 S+ 0 0 43 -25,-0.1 -24,-2.7 -26,-0.0 2,-0.4 0.506 102.7 58.5 -77.9 -5.5 25.5 12.6 -38.9 28 35 A T E < -a 3 0A 8 -3,-1.7 2,-0.5 -6,-0.3 -24,-0.2 -0.984 59.5-166.4-131.2 137.3 28.9 14.1 -39.3 29 36 A E E -a 4 0A 102 -26,-3.1 -24,-3.1 -2,-0.4 2,-0.9 -0.982 22.3-134.4-118.9 128.4 31.5 13.8 -42.1 30 37 A V E +a 5 0A 14 -2,-0.5 -24,-0.2 18,-0.2 3,-0.1 -0.706 35.5 165.0 -82.2 109.4 35.0 15.0 -41.6 31 38 A T E + 0 0 14 -26,-2.2 20,-2.4 -2,-0.9 2,-0.3 0.709 57.6 7.7 -97.9 -24.2 35.7 16.9 -44.8 32 39 A A E -ac 6 51A 0 -27,-1.1 -25,-2.1 18,-0.3 2,-0.4 -0.980 51.1-164.1-157.3 145.5 38.8 19.0 -44.0 33 40 A I E -ac 7 52A 0 18,-2.2 20,-2.4 -2,-0.3 2,-0.3 -0.993 15.5-159.9-135.4 126.7 41.4 19.4 -41.2 34 41 A A E +ac 8 53A 0 -27,-3.0 -25,-2.3 -2,-0.4 2,-0.3 -0.803 12.8 171.7-107.4 149.7 43.7 22.4 -41.1 35 42 A S E - c 0 54A 6 18,-1.8 20,-2.9 -2,-0.3 3,-0.1 -0.977 46.0-117.9-147.6 154.7 47.0 22.9 -39.3 36 43 A R S S+ 0 0 206 -2,-0.3 2,-0.5 18,-0.2 -1,-0.1 0.704 113.1 50.0 -60.2 -22.2 49.7 25.6 -39.1 37 44 A R S >> S- 0 0 163 1,-0.1 4,-1.8 16,-0.1 3,-1.2 -0.972 76.9-151.8-121.4 111.9 51.9 22.8 -40.5 38 45 A W H 3> S+ 0 0 104 -2,-0.5 4,-2.9 1,-0.2 5,-0.2 0.871 96.2 61.0 -43.2 -46.6 50.6 20.9 -43.6 39 46 A D H 3> S+ 0 0 98 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.835 105.3 48.8 -54.5 -34.5 52.5 17.7 -42.6 40 47 A R H <> S+ 0 0 94 -3,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.922 109.7 50.5 -72.7 -44.8 50.5 17.7 -39.3 41 48 A A H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 5,-0.3 0.938 109.8 52.0 -55.9 -47.5 47.2 18.1 -41.1 42 49 A K H X S+ 0 0 72 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.884 106.0 52.9 -57.7 -40.5 48.2 15.3 -43.4 43 50 A R H X S+ 0 0 116 -4,-1.4 4,-1.3 -5,-0.2 -1,-0.2 0.924 112.2 47.0 -64.0 -42.9 48.9 13.0 -40.5 44 51 A F H X S+ 0 0 1 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.889 113.0 46.5 -61.2 -46.2 45.5 13.7 -39.1 45 52 A T H X S+ 0 0 7 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.828 106.4 59.7 -65.9 -28.5 43.6 13.2 -42.4 46 53 A E H < S+ 0 0 133 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.898 115.3 36.3 -67.4 -34.8 45.6 10.0 -43.0 47 54 A R H < S+ 0 0 131 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.916 135.4 19.1 -77.3 -45.4 44.0 8.8 -39.7 48 55 A F H < S- 0 0 13 -4,-2.8 -18,-0.2 1,-0.3 -3,-0.2 0.454 100.0-119.4-113.4 -3.6 40.6 10.3 -39.9 49 56 A G < + 0 0 33 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.1 -0.227 60.4 103.5 86.3-179.4 39.9 11.2 -43.6 50 57 A G S S- 0 0 31 -19,-0.1 -18,-0.3 -18,-0.1 -1,-0.2 -0.141 77.9 -64.7 91.6 167.1 39.1 14.6 -45.1 51 58 A E E -c 32 0A 111 -20,-2.4 -18,-2.2 -2,-0.1 2,-0.2 -0.772 48.4-124.8 -89.3 130.3 41.4 16.9 -47.1 52 59 A P E -c 33 0A 26 0, 0.0 2,-0.4 0, 0.0 -18,-0.2 -0.553 29.9-164.8 -71.9 139.1 44.5 18.3 -45.3 53 60 A V E -c 34 0A 12 -20,-2.4 -18,-1.8 -2,-0.2 2,-0.6 -0.983 17.1-133.1-128.8 139.8 44.6 22.1 -45.4 54 61 A E E S-c 35 0A 136 -2,-0.4 4,-0.3 -20,-0.2 -18,-0.2 -0.792 76.8 -0.4 -94.1 125.4 47.5 24.4 -44.7 55 62 A G S > S- 0 0 22 -20,-2.9 4,-0.6 -2,-0.6 -20,-0.2 0.181 81.1 -99.5 77.7 157.9 46.4 27.3 -42.4 56 63 A Y H >> S+ 0 0 25 1,-0.2 4,-1.8 2,-0.2 3,-0.6 0.870 111.0 63.5 -82.1 -38.6 43.0 28.0 -41.0 57 64 A P H 3> S+ 0 0 56 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.889 99.1 56.7 -54.6 -37.2 41.7 30.7 -43.4 58 65 A A H 34 S+ 0 0 50 -4,-0.3 3,-0.4 1,-0.2 4,-0.3 0.884 105.8 50.3 -63.7 -35.3 41.8 28.3 -46.3 59 66 A L H X< S+ 0 0 0 -3,-0.6 3,-1.7 -4,-0.6 -1,-0.2 0.923 107.2 53.4 -67.7 -40.1 39.5 25.8 -44.4 60 67 A L H 3< S+ 0 0 5 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.697 102.4 59.8 -70.7 -20.0 37.0 28.5 -43.6 61 68 A E T 3< S+ 0 0 145 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.519 82.2 115.0 -77.7 -9.7 36.8 29.4 -47.3 62 69 A R X - 0 0 61 -3,-1.7 3,-0.8 -4,-0.3 -56,-0.0 -0.402 55.6-156.6 -73.6 132.8 35.6 25.9 -48.2 63 70 A D T 3 S+ 0 0 149 1,-0.2 -1,-0.1 -2,-0.2 -3,-0.0 0.722 92.5 63.3 -72.5 -22.8 32.2 25.4 -49.7 64 71 A D T 3 S+ 0 0 51 -33,-0.1 2,-0.4 2,-0.0 -1,-0.2 0.066 86.1 88.1 -92.4 25.1 32.2 21.7 -48.5 65 72 A V < + 0 0 2 -3,-0.8 -60,-0.2 1,-0.1 3,-0.1 -0.995 42.3 169.5-120.9 124.5 32.4 22.7 -44.8 66 73 A D S S+ 0 0 47 -62,-3.1 24,-2.0 -2,-0.4 2,-0.3 0.690 71.6 14.7 -99.7 -28.2 29.1 23.3 -42.9 67 74 A A E -bd 5 90A 0 -63,-1.7 -61,-2.4 22,-0.3 2,-0.4 -0.986 67.5-144.2-152.2 145.9 30.5 23.5 -39.4 68 75 A V E -bd 6 91A 0 22,-2.5 24,-2.2 -2,-0.3 2,-0.5 -0.978 6.4-145.0-122.8 138.4 33.9 23.9 -37.8 69 76 A Y E -bd 7 92A 2 -63,-2.4 -61,-2.5 -2,-0.4 24,-0.2 -0.880 14.6-160.4 -97.6 130.9 35.3 22.3 -34.7 70 77 A V E + d 0 93A 0 22,-2.5 24,-2.4 -2,-0.5 -61,-0.1 -0.808 25.0 160.8-116.9 86.3 37.7 24.7 -32.9 71 78 A P + 0 0 11 0, 0.0 -58,-0.2 0, 0.0 -57,-0.2 -0.127 34.3 135.5 -94.5 36.8 40.1 22.9 -30.4 72 79 A L - 0 0 11 1,-0.2 5,-0.1 -64,-0.1 22,-0.1 -0.282 69.6 -72.0 -74.5 165.3 42.5 25.8 -30.3 73 80 A P >> - 0 0 19 0, 0.0 3,-2.2 0, 0.0 4,-0.5 -0.328 53.0-109.1 -56.5 144.4 44.1 27.1 -27.2 74 81 A A G >4 S+ 0 0 1 95,-0.3 3,-1.2 1,-0.3 4,-0.5 0.793 115.1 55.2 -47.1 -42.1 41.6 29.0 -25.1 75 82 A V G 34 S+ 0 0 51 93,-2.2 4,-0.3 1,-0.3 -1,-0.3 0.743 108.9 49.2 -70.5 -18.9 43.0 32.4 -25.7 76 83 A L G <> S+ 0 0 65 -3,-2.2 4,-1.4 92,-0.4 -1,-0.3 0.434 86.0 92.1-100.2 -0.7 42.8 32.0 -29.5 77 84 A H H S+ 0 0 11 -4,-0.5 4,-2.7 1,-0.2 5,-0.3 0.896 105.8 52.3 -57.8 -45.6 37.5 34.1 -30.0 79 86 A E H > S+ 0 0 101 -4,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.927 117.8 37.4 -55.0 -48.5 39.5 35.1 -33.1 80 87 A W H X S+ 0 0 27 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.763 114.4 53.0 -82.9 -28.9 38.7 31.9 -34.9 81 88 A I H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 5,-0.3 0.943 111.0 48.8 -63.7 -47.6 35.2 31.4 -33.7 82 89 A D H X S+ 0 0 46 -4,-2.7 4,-2.5 -5,-0.3 -2,-0.2 0.922 113.8 46.2 -55.5 -49.7 34.4 35.0 -34.9 83 90 A R H X S+ 0 0 97 -4,-2.0 4,-1.4 -5,-0.3 -1,-0.2 0.876 112.5 49.9 -62.4 -39.4 36.0 34.2 -38.3 84 91 A A H <>S+ 0 0 0 -4,-2.0 5,-2.4 2,-0.2 -2,-0.2 0.899 112.4 46.5 -67.8 -40.4 34.2 30.9 -38.6 85 92 A L H ><5S+ 0 0 0 -4,-2.7 3,-2.2 1,-0.2 -2,-0.2 0.918 111.5 51.9 -71.5 -40.9 30.8 32.3 -37.9 86 93 A R H 3<5S+ 0 0 139 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.771 104.2 58.1 -68.3 -23.9 31.5 35.2 -40.3 87 94 A A T 3<5S- 0 0 33 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.403 124.7-105.7 -77.7 0.6 32.4 32.6 -42.9 88 95 A G T < 5S+ 0 0 44 -3,-2.2 2,-0.4 1,-0.3 -3,-0.2 0.668 76.0 134.7 86.2 17.5 28.9 31.1 -42.4 89 96 A K < - 0 0 19 -5,-2.4 -1,-0.3 -6,-0.1 -22,-0.3 -0.796 55.5-128.1-106.8 136.1 29.9 28.0 -40.5 90 97 A H E -d 67 0A 35 -24,-2.0 -22,-2.5 -2,-0.4 2,-0.4 -0.546 35.9-138.4 -66.2 161.2 28.2 26.7 -37.4 91 98 A V E -de 68 118A 0 26,-2.7 28,-2.4 -24,-0.2 2,-0.6 -0.983 25.8-166.2-138.4 131.3 30.9 26.2 -34.7 92 99 A L E -de 69 119A 2 -24,-2.2 -22,-2.5 -2,-0.4 2,-0.4 -0.963 29.0-169.4-103.7 107.1 31.6 23.5 -32.0 93 100 A A E -de 70 120A 0 26,-3.0 28,-2.9 -2,-0.6 4,-0.1 -0.845 20.0-118.3-103.4 140.0 34.2 25.4 -29.8 94 101 A E E - e 0 121A 10 -24,-2.4 28,-0.1 -2,-0.4 -22,-0.1 -0.287 53.7 -60.4 -68.0 159.6 36.2 23.6 -27.1 95 102 A K S S+ 0 0 15 26,-0.5 -1,-0.1 25,-0.1 -21,-0.1 -0.434 118.9 48.8 -74.4 156.3 35.7 24.7 -23.5 96 103 A P S S- 0 0 6 0, 0.0 -19,-0.1 0, 0.0 -2,-0.1 0.742 79.5-149.1 -70.5 143.8 36.2 27.3 -22.3 97 104 A L S S- 0 0 4 -4,-0.1 2,-0.2 -2,-0.1 -3,-0.1 0.938 72.0 -35.6 -49.3 -55.9 34.2 28.9 -25.0 98 105 A T - 0 0 9 -21,-0.1 -23,-0.1 -5,-0.1 3,-0.1 -0.698 69.0 -83.9-146.8-145.1 36.4 31.9 -24.6 99 106 A T S S+ 0 0 33 -2,-0.2 2,-0.3 1,-0.2 -24,-0.1 0.627 95.8 10.6-105.6 -18.4 38.2 34.0 -22.0 100 107 A D S > S- 0 0 45 1,-0.1 4,-2.2 212,-0.0 -1,-0.2 -0.981 70.4-107.0-159.8 164.0 35.5 36.3 -20.6 101 108 A R H > S+ 0 0 67 208,-0.3 4,-2.8 -2,-0.3 5,-0.2 0.896 114.3 52.6 -66.7 -45.8 31.8 37.1 -20.6 102 109 A P H > S+ 0 0 62 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.922 111.6 48.0 -59.5 -41.0 31.9 40.2 -22.8 103 110 A Q H > S+ 0 0 43 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.910 111.0 51.4 -59.5 -45.0 33.8 38.2 -25.4 104 111 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.912 107.8 51.7 -56.8 -45.0 31.3 35.4 -25.1 105 112 A E H X S+ 0 0 94 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.923 109.3 51.2 -61.4 -43.3 28.3 37.8 -25.6 106 113 A R H X S+ 0 0 133 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.912 109.5 48.8 -58.3 -44.8 29.9 39.1 -28.7 107 114 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.917 111.8 49.1 -63.0 -45.5 30.5 35.7 -30.2 108 115 A F H X S+ 0 0 21 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.877 109.3 53.2 -61.6 -34.8 26.9 34.7 -29.5 109 116 A A H X S+ 0 0 26 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.929 108.4 49.2 -68.6 -41.4 25.7 37.9 -31.1 110 117 A V H X S+ 0 0 11 -4,-2.2 4,-0.6 1,-0.2 -1,-0.2 0.899 115.0 45.1 -58.1 -44.5 27.6 37.2 -34.3 111 118 A A H ><>S+ 0 0 3 -4,-2.2 5,-2.5 1,-0.2 3,-1.0 0.917 111.2 53.4 -65.1 -44.0 26.2 33.7 -34.4 112 119 A R H ><5S+ 0 0 163 -4,-2.7 3,-1.4 1,-0.3 -2,-0.2 0.910 103.6 55.0 -62.2 -43.0 22.7 35.0 -33.6 113 120 A E H 3<5S+ 0 0 146 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.725 115.1 40.9 -66.1 -17.4 22.6 37.5 -36.5 114 121 A R T <<5S- 0 0 98 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.309 109.3-118.3-109.9 1.1 23.4 34.7 -38.9 115 122 A G T < 5 + 0 0 51 -3,-1.4 2,-0.3 -4,-0.5 -3,-0.2 0.736 66.2 146.0 67.5 22.4 21.2 32.0 -37.4 116 123 A L < - 0 0 21 -5,-2.5 2,-0.4 -6,-0.2 -1,-0.2 -0.675 50.0-122.0 -98.4 150.4 24.2 29.9 -36.7 117 124 A L - 0 0 9 -2,-0.3 -26,-2.7 -3,-0.1 2,-0.5 -0.764 22.7-174.7 -86.4 134.1 24.8 27.5 -33.7 118 125 A L E -e 91 0A 8 -2,-0.4 2,-0.4 -28,-0.2 -26,-0.2 -1.000 13.3-176.0-123.0 119.8 27.8 28.2 -31.5 119 126 A M E -e 92 0A 7 -28,-2.4 -26,-3.0 -2,-0.5 2,-0.5 -0.978 24.8-137.2-123.5 131.9 28.2 25.4 -28.9 120 127 A E E -e 93 0A 18 -2,-0.4 2,-2.2 -28,-0.2 -26,-0.2 -0.777 27.3-129.3 -82.7 122.6 30.7 25.1 -26.1 121 128 A N E +e 94 0A 2 -28,-2.9 2,-1.6 -2,-0.5 -26,-0.5 -0.366 46.2 155.3 -83.6 65.0 31.9 21.5 -26.1 122 129 A F > + 0 0 2 -2,-2.2 3,-1.4 1,-0.2 4,-0.3 -0.697 18.3 179.8 -77.7 83.9 31.4 20.6 -22.4 123 130 A M G > + 0 0 17 -2,-1.6 3,-2.0 1,-0.3 4,-0.2 0.806 69.3 68.8 -62.5 -31.6 31.2 16.9 -23.4 124 131 A F G > S+ 0 0 1 1,-0.3 3,-1.9 2,-0.2 6,-0.3 0.785 86.1 66.8 -61.2 -25.8 30.7 15.8 -19.8 125 132 A L G < S+ 0 0 55 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.718 96.1 59.9 -63.6 -18.8 27.2 17.5 -19.7 126 133 A H G < S+ 0 0 42 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.454 79.4 101.4 -89.2 -2.4 26.2 14.8 -22.2 127 134 A H X - 0 0 4 -3,-1.9 3,-1.4 -4,-0.2 4,-0.5 -0.719 69.9-141.6 -86.2 122.9 27.0 11.9 -20.0 128 135 A P T 3> S+ 0 0 41 0, 0.0 4,-1.9 0, 0.0 3,-0.5 0.681 87.7 84.4 -51.6 -19.2 23.8 10.4 -18.5 129 136 A Q H 3> S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.829 86.0 54.4 -62.5 -32.5 25.6 9.8 -15.1 130 137 A H H <> S+ 0 0 7 -3,-1.4 4,-2.8 -6,-0.3 -1,-0.2 0.897 108.1 46.7 -70.2 -35.7 25.0 13.4 -13.9 131 138 A R H > S+ 0 0 168 -4,-0.5 4,-2.5 -3,-0.5 -1,-0.2 0.861 110.3 55.4 -71.4 -30.9 21.2 13.3 -14.5 132 139 A Q H X S+ 0 0 61 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.927 110.6 45.4 -69.0 -39.4 21.2 9.9 -12.7 133 140 A V H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.941 112.3 50.2 -62.6 -49.1 22.9 11.5 -9.7 134 141 A A H X S+ 0 0 25 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.888 107.9 54.3 -60.4 -35.4 20.6 14.5 -9.8 135 142 A D H X S+ 0 0 53 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.887 108.7 48.6 -66.3 -40.7 17.6 12.2 -9.9 136 143 A M H <>S+ 0 0 27 -4,-1.8 5,-1.9 2,-0.2 4,-0.5 0.933 112.5 48.3 -59.3 -47.5 18.8 10.4 -6.8 137 144 A L H ><5S+ 0 0 13 -4,-2.6 3,-1.3 1,-0.2 5,-0.2 0.906 110.3 51.0 -60.0 -41.2 19.4 13.7 -5.0 138 145 A D H 3<5S+ 0 0 138 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.786 103.1 60.3 -66.5 -26.8 15.9 14.9 -6.0 139 146 A E T 3<5S- 0 0 146 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.581 120.2-111.3 -74.6 -11.2 14.5 11.7 -4.6 140 147 A G T X 5 + 0 0 40 -3,-1.3 3,-1.2 -4,-0.5 -3,-0.2 0.668 64.3 151.7 92.5 20.4 15.9 12.7 -1.2 141 148 A V T 3 - 0 0 101 0, 0.0 3,-1.3 0, 0.0 -1,-0.2 -0.189 60.5 -89.8 -51.5 149.4 55.3 18.3 -20.4 159 166 A Q T 3 S+ 0 0 161 1,-0.3 3,-0.1 -3,-0.1 0, 0.0 -0.338 116.8 40.4 -55.5 145.8 57.1 21.6 -20.7 160 167 A G T 3 S+ 0 0 66 1,-0.3 -1,-0.3 -3,-0.1 2,-0.1 0.528 80.4 146.6 87.4 2.5 55.9 23.5 -23.7 161 168 A D X - 0 0 29 -3,-1.3 3,-1.6 -4,-0.2 -1,-0.3 -0.465 60.1-120.1 -67.0 147.7 52.3 22.5 -23.1 162 169 A I G > S+ 0 0 54 1,-0.2 3,-1.6 2,-0.2 7,-1.4 0.788 108.9 69.1 -55.7 -27.6 49.8 25.2 -24.2 163 170 A R G 3 S+ 0 0 58 1,-0.3 8,-0.5 6,-0.2 -1,-0.2 0.736 92.7 57.4 -71.5 -17.7 48.5 25.4 -20.6 164 171 A Y G < S+ 0 0 11 -3,-1.6 2,-0.6 7,-0.1 -1,-0.3 0.437 90.7 82.0 -88.0 -1.1 51.8 27.0 -19.4 165 172 A Q X>> - 0 0 86 -3,-1.6 5,-2.9 -4,-0.2 3,-1.9 -0.913 66.9-157.3-110.8 114.2 51.5 29.9 -21.8 166 173 A A T 345S+ 0 0 41 -2,-0.6 -1,-0.1 39,-0.4 41,-0.1 0.749 92.7 44.5 -63.6 -27.2 49.2 32.6 -20.5 167 174 A D T 345S+ 0 0 126 2,-0.1 -1,-0.3 -93,-0.0 -5,-0.0 0.169 124.7 31.5-105.4 18.7 48.4 34.0 -23.9 168 175 A V T <45S+ 0 0 37 -3,-1.9 -93,-2.2 -6,-0.3 -92,-0.4 0.362 137.1 8.7-134.0 -80.3 47.9 30.7 -25.6 169 176 A G T <5S- 0 0 0 -7,-1.4 -95,-0.3 -4,-0.8 -6,-0.2 0.809 89.1-141.6 -84.8 -25.4 46.4 28.0 -23.3 170 177 A G >< - 0 0 16 -5,-2.9 4,-0.7 -8,-0.5 3,-0.3 0.558 34.8 -90.5 86.7 3.7 45.8 30.3 -20.5 171 178 A G H > - 0 0 0 -8,-0.5 4,-2.3 -9,-0.3 5,-0.3 -0.080 58.9 -48.0 92.5 175.8 46.6 28.4 -17.3 172 179 A A H >>S+ 0 0 0 36,-2.7 5,-3.0 1,-0.2 4,-1.6 0.758 126.7 52.1 -71.5 -26.9 44.9 26.1 -14.8 173 180 A L H 4>S+ 0 0 8 -3,-0.3 5,-1.2 3,-0.2 -1,-0.2 0.979 115.5 39.3 -71.6 -50.7 41.8 28.2 -14.2 174 181 A L H <5S+ 0 0 11 -4,-0.7 -2,-0.2 1,-0.2 -1,-0.1 0.886 126.6 34.2 -67.3 -37.6 40.8 28.7 -17.8 175 182 A D H <5S+ 0 0 11 -4,-2.3 -1,-0.2 -12,-0.1 -3,-0.2 0.809 137.8 6.7 -92.9 -25.7 41.7 25.2 -18.9 176 183 A I T ><5S+ 0 0 7 -4,-1.6 3,-1.8 -5,-0.3 -3,-0.2 0.707 117.3 63.5-127.7 -41.2 40.9 23.0 -16.0 177 184 A G T 3> S+ 0 0 45 -3,-1.8 4,-2.4 2,-0.2 5,-0.2 0.973 107.6 37.3 -63.8 -58.7 35.2 21.9 -15.2 180 187 A P H > S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.881 116.5 55.3 -65.8 -27.9 34.4 22.0 -11.5 181 188 A I H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.937 110.1 46.8 -64.4 -41.6 32.9 25.5 -11.9 182 189 A R H X S+ 0 0 17 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.2 0.885 108.6 53.0 -69.8 -37.6 30.7 24.2 -14.6 183 190 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.864 106.0 56.4 -62.4 -36.9 29.6 21.1 -12.5 184 191 A A H X>S+ 0 0 0 -4,-2.0 4,-3.0 1,-0.2 5,-0.6 0.944 108.7 45.4 -62.9 -40.0 28.7 23.6 -9.7 185 192 A G H X5S+ 0 0 20 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.919 110.0 56.2 -64.8 -40.1 26.3 25.5 -12.1 186 193 A L H <5S+ 0 0 69 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.933 121.3 26.0 -59.2 -44.9 24.9 22.2 -13.3 187 194 A F H <5S+ 0 0 32 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.825 127.6 38.5 -94.4 -33.0 23.9 21.0 -9.9 188 195 A L H <5S- 0 0 29 -4,-3.0 3,-0.2 -5,-0.3 -3,-0.2 0.694 104.1-131.0 -96.5 -20.5 23.4 24.1 -7.8 189 196 A G ><< - 0 0 30 -4,-1.5 3,-0.7 -5,-0.6 -1,-0.3 -0.495 33.8 -44.0 111.8-166.6 21.7 26.3 -10.4 190 197 A A T 3 S+ 0 0 64 1,-0.2 -1,-0.2 -2,-0.2 -5,-0.1 0.454 112.0 70.0 -86.2 -5.3 21.9 29.7 -12.0 191 198 A D T 3 + 0 0 62 -3,-0.2 -1,-0.2 -6,-0.1 27,-0.1 0.188 61.4 141.8-102.9 21.2 22.2 31.9 -8.9 192 199 A L < - 0 0 18 -3,-0.7 2,-0.4 25,-0.1 25,-0.2 -0.360 29.7-166.9 -63.6 138.9 25.8 31.1 -7.8 193 200 A E E -H 216 0B 80 23,-2.5 23,-2.4 -2,-0.1 2,-0.1 -0.964 23.9-106.8-131.0 140.6 27.8 34.0 -6.6 194 201 A F E +H 215 0B 55 -2,-0.4 21,-0.2 21,-0.2 3,-0.1 -0.391 35.4 168.9 -65.3 138.0 31.6 34.3 -5.9 195 202 A V E - 0 0 80 19,-2.5 2,-0.3 1,-0.4 20,-0.2 0.711 59.7 -38.2-112.6 -48.6 32.8 34.4 -2.3 196 203 A G E +H 214 0B 26 18,-1.9 18,-3.2 2,-0.0 -1,-0.4 -0.973 53.1 179.9-169.4 160.3 36.6 33.9 -2.3 197 204 A A E -H 213 0B 13 121,-0.4 123,-2.9 -2,-0.3 2,-0.4 -0.981 17.9-141.3-160.3 162.1 39.3 32.1 -4.1 198 205 A V E -Hi 212 320B 57 14,-2.7 14,-1.9 -2,-0.3 2,-0.5 -0.996 12.8-165.9-123.8 138.4 43.1 31.6 -4.2 199 206 A L E -Hi 211 321B 2 121,-2.6 123,-2.8 -2,-0.4 2,-0.6 -0.994 11.6-147.3-122.4 127.1 45.1 31.2 -7.5 200 207 A R E -Hi 210 322B 90 10,-2.9 9,-2.9 -2,-0.5 10,-1.1 -0.837 16.1-166.4 -90.1 121.4 48.7 30.0 -7.3 201 208 A H E -Hi 208 323B 18 121,-3.1 123,-2.5 -2,-0.6 2,-0.6 -0.924 17.6-135.9-112.6 126.9 50.8 31.5 -10.1 202 209 A E E >> -Hi 207 324B 30 5,-2.5 4,-1.3 -2,-0.5 5,-1.1 -0.732 12.4-152.1 -80.5 120.4 54.2 30.1 -10.9 203 210 A R T 45S+ 0 0 143 121,-2.6 -1,-0.2 -2,-0.6 120,-0.0 0.857 87.0 62.4 -62.6 -36.8 56.5 33.1 -11.3 204 211 A D T 45S+ 0 0 131 120,-0.4 -1,-0.2 1,-0.2 -2,-0.0 0.950 121.8 18.4 -61.8 -52.3 58.9 31.4 -13.7 205 212 A R T 45S- 0 0 69 2,-0.1 -39,-0.4 -3,-0.0 -1,-0.2 0.501 99.6-130.3 -96.2 -0.1 56.4 30.8 -16.5 206 213 A D T <5 + 0 0 92 -4,-1.3 -40,-0.3 1,-0.2 2,-0.3 0.968 63.0 124.1 46.0 64.3 53.9 33.4 -15.3 207 214 A V E < -H 202 0B 4 -5,-1.1 -5,-2.5 -42,-0.1 2,-0.4 -0.995 68.2-104.5-145.4 149.9 50.9 31.1 -15.4 208 215 A V E +H 201 0B 20 -2,-0.3 -36,-2.7 -7,-0.2 -7,-0.3 -0.625 35.3 175.2 -70.2 132.4 48.2 29.9 -13.0 209 216 A V E - 0 0 5 -9,-2.9 20,-3.1 -2,-0.4 21,-0.3 0.528 59.7 -7.6-119.6 -10.3 48.9 26.3 -11.9 210 217 A G E +HJ 200 228B 2 -10,-1.1 -10,-2.9 18,-0.3 -1,-0.3 -0.974 59.4 168.0-174.5 165.7 46.3 25.7 -9.3 211 218 A G E -HJ 199 227B 14 16,-2.6 16,-2.2 -2,-0.3 2,-0.3 -0.997 23.0-135.9-171.5 173.3 43.5 27.2 -7.3 212 219 A N E -HJ 198 226B 67 -14,-1.9 -14,-2.7 -2,-0.3 2,-0.3 -0.987 19.9-168.8-146.8 137.1 40.6 26.9 -5.0 213 220 A A E -HJ 197 225B 2 12,-2.3 12,-2.8 -2,-0.3 2,-0.5 -0.950 11.2-155.1-130.4 143.3 37.3 28.8 -5.2 214 221 A L E +HJ 196 224B 65 -18,-3.2 -19,-2.5 -2,-0.3 -18,-1.9 -0.990 21.5 171.9-118.8 122.1 34.3 29.2 -2.8 215 222 A L E -HJ 194 223B 0 8,-2.3 8,-2.3 -2,-0.5 2,-0.3 -0.803 10.6-160.2-120.1 164.3 31.0 30.1 -4.3 216 223 A T E -HJ 193 222B 28 -23,-2.4 -23,-2.5 -2,-0.3 6,-0.2 -0.999 17.0-131.8-143.8 147.6 27.5 30.2 -2.8 217 224 A T > - 0 0 12 4,-2.2 3,-2.0 -2,-0.3 -25,-0.1 -0.461 45.2-101.9 -82.8 171.0 23.8 30.2 -3.8 218 225 A R T 3 S+ 0 0 176 1,-0.3 -1,-0.1 -2,-0.1 -26,-0.1 0.713 124.5 58.3 -74.5 -11.7 21.7 32.9 -2.2 219 226 A Q T 3 S- 0 0 174 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.428 123.5-104.0 -90.0 0.2 20.4 30.3 0.2 220 227 A G < + 0 0 46 -3,-2.0 2,-0.7 1,-0.3 -2,-0.1 0.694 68.4 149.5 89.6 17.1 24.0 29.5 1.4 221 228 A V - 0 0 27 -33,-0.1 -4,-2.2 -74,-0.1 -1,-0.3 -0.791 38.1-150.0 -81.7 116.4 24.5 26.3 -0.4 222 229 A T E -gJ 147 216B 44 -76,-1.1 -74,-2.0 -2,-0.7 2,-0.4 -0.546 16.7-155.6 -96.9 155.6 28.3 26.5 -0.9 223 230 A A E -gJ 148 215B 0 -8,-2.3 -8,-2.3 -76,-0.2 2,-0.6 -0.993 3.4-165.7-129.0 123.8 30.6 25.1 -3.6 224 231 A Q E -gJ 149 214B 90 -76,-2.3 -74,-1.9 -2,-0.4 2,-0.4 -0.957 15.6-172.2-108.8 113.8 34.2 24.4 -2.9 225 232 A L E -gJ 150 213B 0 -12,-2.8 -12,-2.3 -2,-0.6 2,-0.4 -0.927 6.7-173.3-116.2 129.5 36.1 23.9 -6.2 226 233 A T E +gJ 151 212B 43 -76,-2.4 -74,-1.8 -2,-0.4 2,-0.3 -0.927 12.6 158.5-122.4 144.5 39.7 22.8 -6.5 227 234 A F E +gJ 152 211B 0 -16,-2.2 -16,-2.6 -2,-0.4 2,-0.3 -0.990 5.9 130.2-155.9 159.7 41.7 22.6 -9.7 228 235 A G E -gJ 153 210B 0 -76,-1.4 -74,-1.9 -2,-0.3 -18,-0.3 -0.935 48.5-126.2 168.4 169.2 45.3 22.5 -10.8 229 236 A M S S+ 0 0 2 -20,-3.1 -72,-0.2 -2,-0.3 -19,-0.1 -0.048 95.6 71.8-128.3 34.2 48.2 21.0 -12.8 230 237 A E S S+ 0 0 71 -21,-0.3 2,-0.3 -75,-0.1 -1,-0.1 -0.259 89.6 78.7-130.1 43.8 50.7 20.6 -10.0 231 238 A H S S- 0 0 64 -77,-1.8 2,-0.1 -3,-0.1 3,-0.1 -0.842 85.4 -86.8-145.0 167.1 48.9 17.7 -8.4 232 239 A A - 0 0 81 -2,-0.3 2,-0.3 1,-0.1 -2,-0.1 -0.488 69.5 -78.3 -75.0 161.8 48.1 14.0 -8.4 233 240 A Y + 0 0 112 -2,-0.1 2,-0.3 -81,-0.1 -79,-0.2 -0.461 59.4 163.3 -70.5 127.5 45.1 13.1 -10.5 234 241 A T E +F 153 0B 44 -81,-2.3 -81,-2.4 -2,-0.3 2,-0.2 -0.992 9.5 165.5-139.2 140.1 41.7 13.9 -9.0 235 242 A N E +F 152 0B 4 -2,-0.3 16,-1.4 -83,-0.2 15,-1.0 -0.705 36.5 111.5-157.8 81.6 38.4 14.1 -10.9 236 243 A N E -FK 151 249B 48 -85,-2.2 -85,-2.4 -2,-0.2 2,-0.3 -0.959 42.8-152.2-147.6 167.7 35.5 14.0 -8.5 237 244 A Y E -FK 150 248B 0 11,-1.8 11,-2.0 -2,-0.3 2,-0.3 -0.975 10.9-168.2-144.2 166.2 32.5 15.7 -6.9 238 245 A E E -FK 149 247B 41 -89,-2.4 -89,-2.2 -2,-0.3 2,-0.4 -0.994 8.5-153.0-153.2 139.3 30.7 15.2 -3.6 239 246 A F E -FK 148 246B 0 7,-3.0 7,-2.2 -2,-0.3 2,-0.5 -0.969 7.5-153.1-114.4 137.7 27.4 16.5 -2.1 240 247 A R E -FK 147 245B 122 -93,-2.6 -94,-3.2 -2,-0.4 -93,-1.8 -0.938 23.1-175.8-111.9 128.1 26.9 16.9 1.6 241 248 A G E -F 145 0B 16 3,-2.8 -96,-0.2 -2,-0.5 -98,-0.2 -0.586 41.7-101.3-117.3 172.3 23.2 16.6 2.6 242 249 A S S S+ 0 0 54 -98,-2.0 -99,-0.2 -100,-0.2 -97,-0.1 0.733 121.6 18.9 -70.1 -18.2 21.1 17.0 5.7 243 250 A T S S- 0 0 85 -101,-2.3 24,-0.5 -99,-0.2 2,-0.3 0.252 131.6 -7.3-133.4 11.4 20.9 13.1 6.0 244 251 A G - 0 0 15 -102,-0.9 -3,-2.8 22,-0.2 2,-0.3 -0.979 59.5-114.6-178.0-177.5 23.8 11.7 4.0 245 252 A R E -KL 240 265B 67 20,-2.1 20,-2.4 -2,-0.3 2,-0.4 -0.972 17.3-160.7-140.1 155.2 26.6 12.4 1.5 246 253 A L E +KL 239 264B 0 -7,-2.2 -7,-3.0 -2,-0.3 2,-0.3 -1.000 15.6 168.1-134.7 136.3 27.1 11.3 -2.1 247 254 A W E -KL 238 263B 63 16,-2.5 16,-2.8 -2,-0.4 2,-0.3 -0.966 9.1-176.7-146.6 164.0 30.3 11.2 -4.1 248 255 A M E -K 237 0B 0 -11,-2.0 -11,-1.8 -2,-0.3 3,-0.2 -0.987 13.5-141.4-156.8 151.6 31.7 9.9 -7.3 249 256 A N E S+K 236 0B 73 12,-0.5 12,-0.2 -2,-0.3 -13,-0.2 -0.561 78.9 38.0-108.0 177.2 35.1 9.7 -9.2 250 257 A R S S+ 0 0 93 -15,-1.0 -14,-0.2 -2,-0.2 -1,-0.2 0.880 73.3 151.3 47.0 44.2 35.9 10.0 -12.9 251 258 A V + 0 0 0 -16,-1.4 -15,-0.1 -3,-0.2 -1,-0.1 0.833 63.6 33.4 -77.1 -31.5 33.3 12.6 -13.2 252 259 A F S S+ 0 0 1 1,-0.2 -1,-0.2 -127,-0.0 -128,-0.1 0.759 130.3 24.3 -98.4 -25.2 34.5 14.8 -16.0 253 260 A T + 0 0 27 -18,-0.1 -1,-0.2 -130,-0.0 -2,-0.2 -0.319 69.3 166.0-139.8 54.5 36.2 12.3 -18.2 254 261 A P - 0 0 0 0, 0.0 26,-0.4 0, 0.0 -4,-0.0 -0.465 44.7-105.9 -68.9 137.8 34.9 8.7 -17.8 255 262 A P > - 0 0 34 0, 0.0 3,-1.7 0, 0.0 23,-0.4 -0.258 28.8-110.8 -53.5 157.3 36.0 6.4 -20.5 256 263 A A T 3 S+ 0 0 36 1,-0.3 -3,-0.0 21,-0.1 0, 0.0 0.760 120.5 41.0 -61.1 -27.4 33.4 5.4 -23.0 257 264 A T T 3 S+ 0 0 125 20,-0.1 2,-0.4 2,-0.1 -1,-0.3 0.367 90.8 111.0-101.8 4.7 33.4 1.9 -21.6 258 265 A Y < - 0 0 62 -3,-1.7 20,-0.5 20,-0.2 0, 0.0 -0.678 60.1-140.5 -92.0 134.5 33.7 2.8 -17.9 259 266 A Q - 0 0 106 -2,-0.4 18,-0.2 18,-0.2 -2,-0.1 -0.808 21.8-131.3 -92.7 116.1 30.8 2.1 -15.5 260 267 A P - 0 0 0 0, 0.0 15,-2.8 0, 0.0 2,-0.4 -0.279 12.7-148.9 -59.3 151.3 30.3 5.0 -13.0 261 268 A V E - M 0 274B 40 -12,-0.2 2,-0.5 13,-0.2 -12,-0.5 -0.976 4.9-155.2-126.1 114.8 29.9 4.1 -9.3 262 269 A V E - M 0 273B 0 11,-2.8 11,-2.2 -2,-0.4 2,-0.5 -0.779 11.8-156.3 -88.0 123.7 27.8 6.4 -7.2 263 270 A H E -LM 247 272B 48 -16,-2.8 -16,-2.5 -2,-0.5 2,-0.4 -0.912 12.9-179.4-103.9 133.6 28.7 6.2 -3.5 264 271 A I E -LM 246 271B 1 7,-2.8 7,-2.4 -2,-0.5 2,-0.4 -0.964 3.5-175.6-125.4 143.1 26.2 7.2 -0.8 265 272 A E E +LM 245 270B 72 -20,-2.4 -20,-2.1 -2,-0.4 2,-0.2 -0.999 11.9 156.8-134.6 136.9 26.8 7.2 2.9 266 273 A R E > - M 0 269B 61 3,-3.0 3,-1.7 -2,-0.4 2,-0.2 -0.803 59.2 -43.2-141.6-173.1 24.3 7.9 5.6 267 274 A Q T 3 S- 0 0 156 -24,-0.5 3,-0.0 1,-0.3 -24,-0.0 -0.374 122.5 -17.9 -64.6 126.5 24.1 7.0 9.3 268 275 A D T 3 S+ 0 0 152 -2,-0.2 2,-0.3 1,-0.1 -1,-0.3 0.596 126.5 76.3 59.6 16.8 25.1 3.3 9.8 269 276 A H E < +M 266 0B 95 -3,-1.7 -3,-3.0 2,-0.0 2,-0.3 -0.973 49.8 178.3-154.4 137.5 24.6 2.5 6.1 270 277 A A E -M 265 0B 56 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.959 8.5-172.2-135.7 151.4 26.5 3.1 2.9 271 278 A E E -M 264 0B 57 -7,-2.4 -7,-2.8 -2,-0.3 2,-0.4 -0.992 11.6-154.6-140.3 153.9 25.6 1.9 -0.7 272 279 A Q E -M 263 0B 112 -2,-0.3 2,-0.5 -9,-0.2 -9,-0.2 -0.993 9.5-161.3-129.1 133.6 27.3 1.9 -4.1 273 280 A F E -M 262 0B 77 -11,-2.2 -11,-2.8 -2,-0.4 2,-0.5 -0.990 9.3-146.3-115.8 128.5 25.4 1.9 -7.4 274 281 A V E -M 261 0B 96 -2,-0.5 -13,-0.2 -13,-0.2 -2,-0.0 -0.777 20.3-163.2 -94.5 125.9 27.0 0.9 -10.7 275 282 A L - 0 0 9 -15,-2.8 -146,-0.0 -2,-0.5 2,-0.0 -0.658 27.2 -86.3-103.5 166.4 25.6 2.8 -13.6 276 283 A P - 0 0 64 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.335 43.0-111.0 -70.5 151.7 25.8 2.0 -17.3 277 284 A A - 0 0 34 -18,-0.2 2,-0.3 -20,-0.2 -18,-0.2 -0.527 37.2-178.6 -76.5 152.4 28.7 3.2 -19.4 278 285 A H - 0 0 48 -20,-0.5 2,-1.0 -23,-0.4 -20,-0.2 -0.988 32.0-123.7-152.8 151.8 28.2 5.9 -22.0 279 286 A D > - 0 0 61 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 -0.812 27.0-178.7-100.0 96.5 30.4 7.6 -24.6 280 287 A Q H > S+ 0 0 3 -2,-1.0 4,-2.4 -26,-0.4 -1,-0.2 0.820 79.4 56.7 -74.3 -25.4 30.1 11.2 -23.7 281 288 A F H > S+ 0 0 11 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.938 110.3 44.4 -62.9 -53.8 32.3 12.4 -26.6 282 289 A A H > S+ 0 0 29 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.916 113.8 51.5 -56.3 -45.6 30.1 10.7 -29.1 283 290 A K H X S+ 0 0 89 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.883 109.3 48.9 -62.1 -37.9 27.0 12.0 -27.4 284 291 A S H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.921 112.9 46.7 -69.4 -40.2 28.2 15.6 -27.4 285 292 A I H X S+ 0 0 2 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.907 112.4 51.0 -73.3 -35.7 29.1 15.5 -31.1 286 293 A R H X S+ 0 0 95 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.911 108.6 51.3 -67.0 -38.8 25.8 13.9 -31.9 287 294 A A H X S+ 0 0 18 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.924 111.4 48.0 -62.1 -40.6 23.9 16.6 -30.0 288 295 A F H X S+ 0 0 6 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.951 113.2 47.6 -62.2 -51.6 25.8 19.3 -31.9 289 296 A A H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.897 111.3 50.5 -60.0 -42.9 25.1 17.6 -35.3 290 297 A Q H X S+ 0 0 90 -4,-2.8 4,-2.6 2,-0.2 6,-0.4 0.885 109.7 50.4 -62.0 -37.5 21.4 17.1 -34.5 291 298 A A H X S+ 0 0 5 -4,-2.0 4,-1.6 -5,-0.2 5,-0.3 0.903 112.9 46.3 -64.1 -40.7 21.0 20.8 -33.5 292 299 A V H < S+ 0 0 18 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.906 116.1 45.7 -67.9 -44.7 22.7 21.9 -36.7 293 300 A L H < S+ 0 0 82 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.908 122.0 35.2 -67.1 -42.7 20.6 19.5 -38.8 294 301 A S H < S- 0 0 61 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.676 98.6-130.4 -79.3 -21.3 17.2 20.3 -37.2 295 302 A G < + 0 0 47 -4,-1.6 2,-1.0 1,-0.2 -3,-0.1 0.458 65.7 132.2 69.7 6.0 17.9 24.1 -36.6 296 303 A E - 0 0 144 -6,-0.4 -1,-0.2 -5,-0.3 -2,-0.2 -0.818 33.9-177.8 -91.0 101.1 16.8 23.6 -32.9 297 304 A H - 0 0 59 -2,-1.0 5,-0.1 -3,-0.1 -9,-0.0 -0.888 30.4-122.6-103.8 101.7 19.6 25.4 -31.1 298 305 A P >> - 0 0 52 0, 0.0 4,-1.0 0, 0.0 3,-0.9 -0.163 10.7-149.9 -60.2 127.8 18.8 25.0 -27.4 299 306 A R H 3> S+ 0 0 180 1,-0.2 4,-2.0 2,-0.2 3,-0.2 0.847 94.3 63.7 -61.2 -36.8 18.5 28.3 -25.6 300 307 A E H 3> S+ 0 0 138 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.778 95.1 60.1 -59.9 -31.6 19.8 26.8 -22.4 301 308 A W H <> S+ 0 0 65 -3,-0.9 4,-2.2 2,-0.2 -1,-0.2 0.928 110.0 38.4 -65.1 -48.8 23.2 26.0 -23.9 302 309 A S H X S+ 0 0 33 -4,-1.0 4,-2.4 -3,-0.2 -2,-0.2 0.904 116.5 51.4 -70.3 -36.4 24.1 29.6 -24.7 303 310 A E H X S+ 0 0 58 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.914 112.2 47.7 -65.8 -38.9 22.6 30.9 -21.5 304 311 A D H X S+ 0 0 31 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.897 110.2 51.6 -69.5 -43.0 24.5 28.4 -19.5 305 312 A S H X S+ 0 0 9 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.882 111.3 48.8 -61.5 -35.8 27.8 29.2 -21.4 306 313 A L H X S+ 0 0 16 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.934 111.5 46.8 -68.4 -45.2 27.3 32.9 -20.6 307 314 A R H X S+ 0 0 83 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.918 112.4 52.6 -59.7 -38.4 26.6 32.3 -16.9 308 315 A Q H X S+ 0 0 9 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.913 107.2 51.6 -65.8 -44.3 29.7 30.0 -16.8 309 316 A A H X S+ 0 0 17 -4,-2.1 4,-2.5 1,-0.2 -208,-0.3 0.928 108.3 52.2 -60.5 -42.5 31.8 32.7 -18.4 310 317 A S H X S+ 0 0 41 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.884 109.4 48.5 -55.9 -45.4 30.6 35.2 -15.8 311 318 A L H X S+ 0 0 20 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.923 110.5 51.0 -68.0 -40.0 31.5 32.9 -12.9 312 319 A V H X S+ 0 0 7 -4,-2.4 4,-3.2 1,-0.2 5,-0.2 0.956 111.6 47.6 -58.6 -49.1 35.0 32.3 -14.3 313 320 A D H X S+ 0 0 28 -4,-2.5 4,-2.7 -5,-0.2 5,-0.2 0.905 110.6 52.6 -57.2 -40.7 35.5 36.0 -14.7 314 321 A A H X S+ 0 0 37 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.862 111.4 46.4 -67.9 -36.5 34.3 36.5 -11.1 315 322 A V H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.948 113.1 48.8 -69.9 -49.9 36.8 33.9 -9.9 316 323 A R H < S+ 0 0 83 -4,-3.2 -2,-0.2 -5,-0.2 -1,-0.2 0.922 120.3 36.8 -51.1 -45.0 39.7 35.4 -11.9 317 324 A T H < S+ 0 0 117 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.868 120.6 44.5 -81.9 -38.0 38.9 38.9 -10.7 318 325 A G H < S+ 0 0 40 -4,-2.5 -121,-0.4 -5,-0.2 -1,-0.2 0.637 91.3 105.7 -78.5 -17.7 37.9 38.1 -7.1 319 326 A A S < S- 0 0 9 -4,-1.8 2,-0.6 -5,-0.2 -121,-0.2 -0.334 74.6-119.6 -70.0 148.2 40.7 35.7 -6.3 320 327 A R E -i 198 0B 178 -123,-2.9 -121,-2.6 -2,-0.0 2,-0.5 -0.755 32.2-143.9 -71.6 121.3 43.7 36.3 -4.1 321 328 A D E -i 199 0B 72 -2,-0.6 2,-0.5 -123,-0.2 -121,-0.2 -0.812 17.7-172.9 -94.1 123.4 46.7 35.8 -6.5 322 329 A I E -i 200 0B 61 -123,-2.8 -121,-3.1 -2,-0.5 2,-0.4 -0.980 8.1-155.9-119.9 126.7 49.8 34.3 -4.9 323 330 A Y E -i 201 0B 88 -2,-0.5 -121,-0.2 -123,-0.2 -123,-0.1 -0.828 25.3-113.3-101.4 136.1 53.0 34.0 -6.8 324 331 A F E i 202 0B 40 -123,-2.5 -121,-2.6 -2,-0.4 -120,-0.4 -0.932 360.0 360.0-123.3 153.2 55.6 31.4 -5.9 325 332 A P 0 0 156 0, 0.0 -2,-0.0 0, 0.0 -122,-0.0 0.576 360.0 360.0 -72.7 360.0 58.2 31.0 -4.8