==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-MAY-04 1TBL . COMPND 2 MOLECULE: ARGINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR E.CAMA,J.D.COX,D.E.ASH,D.W.CHRISTIANSON . 942 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34302.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 682 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 132 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 89 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 126 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 270 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.6 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 0 3 3 6 0 3 0 3 3 3 0 0 0 0 3 0 3 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 9 0 0 6 6 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 3 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 6 A K 0 0 138 0, 0.0 40,-2.1 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 151.7 32.9 -4.6 -3.0 2 7 A P E -a 41 0A 46 0, 0.0 86,-3.1 0, 0.0 2,-0.4 -0.616 360.0-154.0 -90.9 150.0 34.1 -4.4 0.6 3 8 A I E -ab 42 88A 3 38,-2.5 40,-2.5 -2,-0.2 2,-0.6 -0.972 2.4-162.2-123.6 132.7 33.6 -1.6 3.1 4 9 A E E -ab 43 89A 11 84,-2.5 86,-2.4 -2,-0.4 2,-0.4 -0.919 4.6-159.3-119.5 108.0 35.9 -0.8 6.0 5 10 A I E -ab 44 90A 1 38,-2.2 40,-2.1 -2,-0.6 2,-0.5 -0.711 14.5-166.1 -81.0 129.5 34.4 1.5 8.7 6 11 A I E - b 0 91A 0 84,-2.3 86,-1.7 -2,-0.4 2,-0.3 -0.975 14.4-132.1-124.2 122.4 37.3 3.0 10.6 7 12 A G E +ab 47 92A 0 39,-3.7 41,-2.1 -2,-0.5 86,-0.1 -0.513 22.9 177.9 -75.3 131.1 36.9 4.7 14.0 8 13 A A E + b 0 93A 0 84,-1.4 2,-2.5 -2,-0.3 86,-1.0 -0.481 2.8 175.3-130.8 64.7 38.5 8.1 14.5 9 14 A P + 0 0 38 0, 0.0 2,-0.3 0, 0.0 41,-0.2 -0.420 32.8 138.9 -71.2 74.6 37.6 9.4 18.0 10 15 A F + 0 0 9 -2,-2.5 85,-0.9 9,-0.2 12,-0.1 -0.879 23.4 156.7-122.3 152.3 39.8 12.5 17.8 11 16 A S > + 0 0 29 -2,-0.3 3,-2.2 83,-0.2 5,-0.1 0.452 49.4 99.7-149.3 -9.8 39.4 16.1 18.8 12 17 A K T 3 + 0 0 58 1,-0.3 123,-0.3 83,-0.1 56,-0.1 0.705 68.9 82.5 -58.8 -17.3 42.7 17.8 19.3 13 18 A G T 3 S+ 0 0 0 121,-0.1 123,-0.3 122,-0.1 -1,-0.3 0.632 105.4 16.2 -61.7 -11.5 42.3 19.3 15.9 14 19 A Q S < S- 0 0 16 -3,-2.2 81,-0.1 120,-0.2 -3,-0.0 -0.946 78.0-108.8-153.4 171.7 40.1 22.0 17.6 15 20 A P S S+ 0 0 91 0, 0.0 2,-0.7 0, 0.0 -3,-0.1 0.515 84.4 92.1 -85.0 -7.1 39.2 23.6 21.0 16 21 A R S > S- 0 0 138 -5,-0.1 3,-0.8 1,-0.0 2,-0.1 -0.796 71.8-134.6 -97.9 110.7 35.6 22.3 21.4 17 22 A G T 3 S+ 0 0 61 -2,-0.7 -6,-0.0 1,-0.2 259,-0.0 -0.351 76.4 59.4 -62.2 127.0 35.2 19.1 23.4 18 23 A G T > + 0 0 0 -2,-0.1 3,-1.7 258,-0.1 4,-0.3 -0.043 61.5 95.8 153.7 -48.6 32.9 16.6 21.7 19 24 A V G X S+ 0 0 0 -3,-0.8 3,-1.4 1,-0.3 -9,-0.2 0.697 79.5 68.1 -48.9 -24.8 33.8 15.4 18.2 20 25 A E G 3 S+ 0 0 52 1,-0.3 4,-0.4 -11,-0.2 -1,-0.3 0.937 93.5 60.0 -60.4 -43.2 35.6 12.3 19.5 21 26 A K G <> S+ 0 0 106 -3,-1.7 4,-1.9 1,-0.2 -1,-0.3 0.581 81.8 95.1 -60.3 -10.9 32.1 11.0 20.6 22 27 A G H X> S+ 0 0 0 -3,-1.4 4,-2.4 -4,-0.3 3,-1.0 0.943 80.4 45.6 -45.7 -70.8 31.1 11.2 16.9 23 28 A P H 3> S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.812 111.6 54.0 -46.3 -36.9 31.7 7.6 15.9 24 29 A A H 3> S+ 0 0 61 -4,-0.4 4,-2.3 -3,-0.2 -2,-0.2 0.901 111.0 46.4 -66.3 -39.1 30.0 6.3 19.0 25 30 A A H S+ 0 0 1 -4,-2.4 5,-1.3 2,-0.2 -2,-0.2 0.921 113.7 46.8 -66.4 -44.5 26.9 7.3 14.5 27 32 A R H ><5S+ 0 0 44 -4,-2.7 3,-3.0 -5,-0.2 4,-0.3 0.947 108.2 55.0 -62.3 -48.1 27.3 3.6 15.3 28 33 A K H 3<5S+ 0 0 187 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.894 100.7 62.6 -50.6 -41.1 24.6 3.8 18.0 29 34 A A T 3<5S- 0 0 34 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.496 127.2-100.4 -64.1 -6.0 22.4 5.2 15.3 30 35 A G T <>5S+ 0 0 14 -3,-3.0 4,-2.0 -4,-0.1 5,-0.2 0.776 71.9 148.1 90.9 29.4 22.7 1.9 13.4 31 36 A L H > S+ 0 0 6 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.882 116.5 46.2 -64.2 -42.4 27.1 -0.4 10.5 33 38 A E H > S+ 0 0 101 -6,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.946 111.0 52.1 -67.6 -47.3 24.0 -2.6 10.4 34 39 A K H < S+ 0 0 96 -4,-2.0 3,-0.2 1,-0.2 -2,-0.2 0.901 107.5 53.2 -56.1 -43.7 22.2 -0.4 7.9 35 40 A L H >< S+ 0 0 1 -4,-1.9 3,-4.4 1,-0.2 5,-0.4 0.969 99.6 60.7 -56.5 -57.0 25.1 -0.5 5.6 36 41 A K H 3< S+ 0 0 117 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.846 93.4 65.8 -36.9 -48.6 25.2 -4.3 5.6 37 42 A E T 3< S+ 0 0 159 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.578 92.3 85.5 -54.8 -6.6 21.7 -4.3 4.1 38 43 A T S < S- 0 0 29 -3,-4.4 262,-0.1 2,-0.2 258,-0.0 -0.278 104.1 -94.0 -86.9 178.5 23.3 -2.7 1.1 39 44 A E S S+ 0 0 132 260,-0.4 2,-0.3 -2,-0.1 -3,-0.1 0.261 98.8 88.7 -78.7 12.6 25.0 -4.5 -1.8 40 45 A Y S S- 0 0 37 -5,-0.4 2,-0.4 -4,-0.2 -2,-0.2 -0.803 79.3-118.2-113.1 155.0 28.4 -4.2 -0.1 41 46 A N E -a 2 0A 134 -40,-2.1 -38,-2.5 -2,-0.3 2,-0.4 -0.732 35.0-153.8 -87.7 136.1 30.2 -6.4 2.4 42 47 A V E +a 3 0A 22 -2,-0.4 2,-0.4 -40,-0.2 -38,-0.2 -0.948 19.1 178.2-123.4 133.8 30.9 -4.5 5.6 43 48 A R E -a 4 0A 155 -40,-2.5 -38,-2.2 -2,-0.4 2,-0.9 -0.997 20.6-145.8-129.1 129.4 33.6 -4.9 8.3 44 49 A D E -a 5 0A 61 -2,-0.4 -38,-0.1 -40,-0.2 3,-0.1 -0.848 9.7-170.6 -97.4 103.5 33.9 -2.6 11.3 45 50 A H E - 0 0 62 -40,-2.1 -39,-0.1 -2,-0.9 -1,-0.1 0.511 39.2-131.2 -70.8 -4.8 37.6 -2.2 12.1 46 51 A G E - 0 0 25 -41,-0.3 -39,-3.7 2,-0.0 2,-0.4 -0.325 36.9 -45.1 83.8-171.2 36.6 -0.5 15.3 47 52 A D E -a 7 0A 73 -41,-0.2 -39,-0.2 -3,-0.1 2,-0.1 -0.832 54.0-124.5-101.4 138.5 38.0 2.7 16.7 48 53 A L - 0 0 14 -41,-2.1 2,-0.6 -2,-0.4 -2,-0.0 -0.388 20.6-129.2 -73.0 157.9 41.6 3.5 16.7 49 54 A A - 0 0 82 -41,-0.1 2,-0.6 -2,-0.1 -1,-0.0 -0.949 20.1-148.0-112.5 112.0 43.2 4.4 20.1 50 55 A F - 0 0 40 -2,-0.6 2,-0.4 -41,-0.2 21,-0.1 -0.728 9.0-135.3 -89.1 119.8 45.2 7.6 19.9 51 56 A V - 0 0 96 -2,-0.6 2,-0.8 1,-0.1 20,-0.1 -0.563 20.8-129.1 -72.8 123.1 48.2 7.9 22.2 52 57 A D - 0 0 105 -2,-0.4 -1,-0.1 18,-0.1 15,-0.1 -0.647 14.7-138.3 -81.8 108.7 48.4 11.3 23.9 53 58 A V > - 0 0 41 -2,-0.8 3,-0.5 11,-0.1 2,-0.2 -0.503 22.7-131.8 -66.5 117.1 51.7 12.9 23.5 54 59 A P T 3 S+ 0 0 109 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 -0.502 83.3 14.3 -74.6 138.6 52.6 14.5 26.9 55 60 A N T 3 S+ 0 0 141 -2,-0.2 2,-1.8 1,-0.2 -2,-0.0 0.947 72.3 177.8 62.0 52.6 53.9 18.1 26.9 56 61 A D < - 0 0 17 -3,-0.5 8,-0.5 9,-0.0 -1,-0.2 -0.556 16.7-163.2 -84.7 69.6 52.7 18.9 23.4 57 62 A S - 0 0 51 -2,-1.8 9,-0.2 -3,-0.2 2,-0.1 -0.216 27.5 -91.0 -57.8 146.0 53.9 22.5 23.5 58 63 A P - 0 0 86 0, 0.0 2,-1.4 0, 0.0 5,-0.2 -0.324 25.5-132.9 -62.2 134.1 52.4 24.9 20.8 59 64 A F B > S-H 62 0B 44 3,-1.6 2,-0.7 -3,-0.1 3,-0.7 -0.728 71.4 -65.4 -87.3 90.8 54.4 25.3 17.6 60 65 A Q T 3 S- 0 0 133 -2,-1.4 73,-0.1 1,-0.3 0, 0.0 -0.518 120.3 -15.5 63.1-107.8 54.2 29.1 17.6 61 66 A I T 3 S+ 0 0 78 -2,-0.7 -1,-0.3 66,-0.3 72,-0.2 0.933 111.9 100.2 -89.4 -55.4 50.4 29.3 17.1 62 67 A V B < -H 59 0B 0 -3,-0.7 -3,-1.6 65,-0.3 2,-0.3 0.041 68.0-136.6 -36.0 128.1 49.4 25.8 16.0 63 68 A K - 0 0 85 70,-2.3 72,-0.3 1,-0.2 5,-0.1 -0.688 68.7 -2.9 -99.8 149.0 48.0 23.8 18.9 64 69 A N S > S+ 0 0 60 -8,-0.5 4,-2.1 -2,-0.3 5,-0.3 0.845 73.7 167.5 43.6 48.0 48.7 20.2 20.0 65 70 A P H > S+ 0 0 0 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.932 70.5 44.3 -54.0 -52.7 50.9 19.6 17.0 66 71 A R H > S+ 0 0 77 -9,-0.2 4,-2.9 2,-0.2 5,-0.3 0.915 110.6 54.4 -60.5 -46.6 52.4 16.4 18.1 67 72 A S H > S+ 0 0 4 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.938 115.3 39.8 -52.2 -53.0 49.1 14.9 19.3 68 73 A V H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 5,-0.3 0.902 113.6 53.8 -64.3 -45.9 47.5 15.5 15.9 69 74 A G H X S+ 0 0 0 -4,-2.9 4,-2.5 86,-0.4 -2,-0.2 0.942 113.0 43.4 -56.1 -49.0 50.6 14.5 13.9 70 75 A K H X S+ 0 0 77 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.921 111.6 52.1 -62.9 -49.4 50.8 11.2 15.6 71 76 A A H X S+ 0 0 3 -4,-2.2 4,-2.0 -5,-0.3 -1,-0.2 0.950 113.1 45.9 -53.5 -50.8 47.1 10.4 15.5 72 77 A N H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.934 107.0 58.2 -59.3 -46.9 47.1 11.0 11.8 73 78 A E H X S+ 0 0 71 -4,-2.5 4,-1.2 -5,-0.3 -1,-0.2 0.905 107.9 47.3 -46.9 -48.9 50.3 9.0 11.3 74 79 A Q H X S+ 0 0 52 -4,-2.3 4,-1.8 2,-0.2 3,-0.2 0.919 112.3 50.0 -59.4 -47.1 48.5 6.0 12.8 75 80 A L H X S+ 0 0 0 -4,-2.0 4,-3.3 1,-0.2 5,-0.3 0.931 106.0 53.7 -59.3 -51.0 45.4 6.5 10.6 76 81 A A H X S+ 0 0 0 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.808 107.8 54.9 -56.4 -28.9 47.3 6.8 7.3 77 82 A A H X S+ 0 0 47 -4,-1.2 4,-1.7 -5,-0.3 -1,-0.2 0.928 112.6 39.5 -70.2 -46.8 48.8 3.5 8.3 78 83 A V H X S+ 0 0 23 -4,-1.8 4,-2.0 2,-0.2 5,-0.2 0.934 117.7 47.5 -69.4 -47.0 45.4 1.8 8.7 79 84 A V H X S+ 0 0 0 -4,-3.3 4,-2.8 1,-0.2 5,-0.3 0.948 111.1 52.0 -57.2 -51.7 43.8 3.5 5.7 80 85 A A H X S+ 0 0 12 -4,-1.9 4,-1.6 -5,-0.3 -1,-0.2 0.891 109.9 52.2 -49.9 -45.6 46.8 2.7 3.5 81 86 A E H X S+ 0 0 102 -4,-1.7 4,-1.2 2,-0.2 -1,-0.2 0.864 112.8 39.4 -60.3 -48.4 46.5 -1.0 4.7 82 87 A T H <>S+ 0 0 7 -4,-2.0 5,-1.8 2,-0.2 -1,-0.2 0.869 112.4 56.0 -73.5 -40.2 42.8 -1.6 3.9 83 88 A Q H ><5S+ 0 0 3 -4,-2.8 3,-1.8 -5,-0.2 -2,-0.2 0.898 104.9 56.0 -54.8 -40.8 42.9 0.4 0.6 84 89 A K H 3<5S+ 0 0 125 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.896 101.8 54.6 -55.5 -46.5 45.8 -2.1 -0.2 85 90 A N T 3<5S- 0 0 104 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.312 121.8-113.9 -73.8 10.1 43.3 -4.9 0.4 86 91 A G T < 5 + 0 0 30 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.781 69.8 137.2 62.8 32.3 41.1 -3.2 -2.2 87 92 A T < - 0 0 18 -5,-1.8 2,-0.6 -86,-0.1 -84,-0.2 -0.816 59.7-111.3-107.7 149.8 38.3 -2.3 0.2 88 93 A I E -b 3 0A 9 -86,-3.1 -84,-2.5 -2,-0.3 179,-0.2 -0.700 36.5-140.9 -83.4 118.2 36.5 1.1 0.2 89 94 A S E -bc 4 267A 0 177,-0.8 179,-0.8 -2,-0.6 2,-0.4 -0.479 16.2-167.8 -81.2 149.2 37.4 3.0 3.4 90 95 A V E -bc 5 268A 1 -86,-2.4 -84,-2.3 177,-0.2 2,-0.8 -0.847 8.9-157.0-138.8 101.1 35.0 5.1 5.5 91 96 A V E -bc 6 269A 0 177,-2.9 179,-2.3 -2,-0.4 2,-0.6 -0.682 1.2-158.2 -88.0 105.9 36.5 7.3 8.2 92 97 A L E -bc 7 270A 1 -86,-1.7 -84,-1.4 -2,-0.8 179,-0.2 -0.697 32.6-146.8 -79.0 119.5 34.1 8.3 11.0 93 98 A G E -b 8 0A 1 177,-2.4 180,-0.2 -2,-0.6 2,-0.1 -0.458 42.3-164.1 -84.8 156.0 35.6 11.5 12.6 94 99 A G S S- 0 0 0 -86,-1.0 178,-3.2 1,-0.3 179,-0.4 0.522 86.1 -16.1 -31.6-141.2 36.3 13.5 15.2 95 100 A D S > S- 0 0 0 -85,-0.9 3,-1.5 176,-0.2 -1,-0.3 -0.397 74.1-103.2 -80.6 160.8 37.3 16.8 13.7 96 101 A H G > S+ 0 0 0 1,-0.3 3,-4.5 40,-0.2 4,-0.3 0.792 102.9 90.4 -55.1 -34.5 38.3 17.3 10.1 97 102 A S G > S+ 0 0 0 1,-0.3 3,-1.6 2,-0.2 4,-0.3 0.746 78.4 65.6 -36.3 -32.3 42.0 17.5 11.0 98 103 A M G <> S+ 0 0 0 -3,-1.5 4,-1.4 1,-0.3 -1,-0.3 0.487 75.4 85.9 -75.0 0.7 42.1 13.8 10.5 99 104 A A H <> S+ 0 0 0 -3,-4.5 4,-1.6 2,-0.2 5,-0.4 0.848 78.7 69.9 -65.4 -33.4 41.4 14.3 6.9 100 105 A I H X> S+ 0 0 0 -3,-1.6 4,-2.2 -4,-0.3 3,-0.7 0.958 108.1 29.2 -47.2 -68.3 45.2 14.7 6.6 101 106 A G H 3> S+ 0 0 0 -4,-0.3 4,-2.0 1,-0.2 5,-0.2 0.687 112.7 64.7 -69.4 -21.0 46.0 11.1 7.3 102 107 A S H 3X S+ 0 0 0 -4,-1.4 4,-0.6 2,-0.2 -1,-0.2 0.758 112.9 35.5 -73.8 -24.4 42.8 9.6 5.8 103 108 A I H X S+ 0 0 0 -4,-0.6 4,-3.4 1,-0.3 3,-0.7 0.923 105.9 49.7 -55.3 -51.6 44.7 6.5 0.4 107 112 A A H 3< S+ 0 0 9 -4,-3.2 -1,-0.3 1,-0.2 -2,-0.2 0.852 102.6 66.4 -58.2 -31.3 47.0 8.3 -2.0 108 113 A R H 3< S+ 0 0 135 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.916 114.9 25.8 -56.4 -46.1 49.6 5.8 -1.0 109 114 A V H << S+ 0 0 47 -4,-1.3 -2,-0.2 -3,-0.7 -1,-0.2 0.810 137.2 33.7 -86.4 -34.0 47.6 3.0 -2.6 110 115 A H >< + 0 0 56 -4,-3.4 3,-1.0 -5,-0.2 -1,-0.3 -0.812 66.7 172.4-124.8 86.0 45.9 5.2 -5.2 111 116 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.669 76.1 57.5 -67.6 -19.6 48.3 8.0 -6.1 112 117 A D T 3 S+ 0 0 92 -5,-0.1 2,-0.1 52,-0.1 -5,-0.1 -0.010 77.9 136.7-104.7 32.3 46.1 9.3 -8.8 113 118 A L < - 0 0 3 -3,-1.0 2,-0.3 107,-0.1 109,-0.2 -0.425 42.4-144.9 -78.8 150.9 43.0 10.0 -6.7 114 119 A C E -d 222 0A 0 107,-2.7 109,-2.1 -2,-0.1 2,-0.4 -0.723 14.1-137.2-107.3 161.7 40.8 13.2 -7.0 115 120 A V E -de 223 169A 2 53,-2.8 55,-2.1 -2,-0.3 2,-0.7 -0.978 12.8-164.7-133.1 126.8 39.1 14.8 -4.0 116 121 A I E -de 224 170A 1 107,-1.6 109,-1.0 -2,-0.4 2,-0.8 -0.927 18.1-160.7-105.3 107.1 35.6 16.3 -3.6 117 122 A W E -de 225 171A 1 53,-2.0 55,-1.8 -2,-0.7 2,-0.7 -0.807 5.5-168.8 -96.9 100.8 35.8 18.4 -0.4 118 123 A V E +de 226 172A 0 107,-0.9 109,-5.2 -2,-0.8 2,-0.3 -0.808 38.8 110.9 -92.7 114.7 32.3 19.1 1.0 119 124 A D - 0 0 0 53,-1.1 53,-0.2 -2,-0.7 111,-0.1 -0.905 68.8-124.0-164.8 178.8 32.5 21.8 3.7 120 125 A A S S+ 0 0 0 -2,-0.3 55,-3.6 54,-0.1 56,-2.0 0.406 99.7 54.5-114.8 -7.8 31.5 25.4 4.3 121 126 A H S S- 0 0 12 53,-0.2 56,-0.1 54,-0.2 106,-0.1 -0.904 77.3-136.7-125.1 152.4 35.1 26.2 5.0 122 127 A T - 0 0 0 54,-0.3 18,-0.2 -2,-0.3 -1,-0.1 0.850 23.0-157.1 -75.7 -38.6 38.2 25.6 2.9 123 128 A D + 0 0 9 1,-0.1 17,-1.5 16,-0.1 18,-0.5 0.825 53.9 124.3 62.6 32.6 40.3 24.5 5.8 124 129 A I + 0 0 0 16,-0.2 14,-0.3 15,-0.2 2,-0.2 0.002 25.8 136.3-112.5 27.2 43.4 25.4 3.9 125 130 A N - 0 0 8 12,-4.1 16,-0.3 4,-0.1 12,-0.1 -0.568 46.2-141.9 -73.8 135.4 44.9 27.8 6.4 126 131 A T >> - 0 0 6 -2,-0.2 3,-2.4 15,-0.1 4,-2.0 -0.624 31.9 -95.8 -96.5 160.5 48.6 27.2 6.8 127 132 A P T 34 S+ 0 0 7 0, 0.0 -65,-0.3 0, 0.0 -66,-0.3 0.660 129.4 49.3 -47.8 -16.8 50.5 27.4 10.1 128 133 A L T 34 S+ 0 0 97 22,-0.1 23,-0.0 1,-0.1 -3,-0.0 0.663 114.0 44.4 -95.9 -21.0 51.3 31.0 9.2 129 134 A T T <4 S+ 0 0 29 -3,-2.4 51,-0.2 51,-0.0 52,-0.1 0.705 81.6 110.6 -98.9 -21.9 47.8 31.9 8.2 130 135 A T < - 0 0 10 -4,-2.0 3,-0.1 1,-0.2 -68,-0.1 -0.303 49.5-159.8 -61.8 136.8 45.6 30.5 11.0 131 136 A S S S+ 0 0 109 3,-0.1 2,-0.3 -70,-0.0 -1,-0.2 0.747 88.5 33.8 -81.9 -29.7 44.0 33.0 13.3 132 137 A S S S- 0 0 45 2,-0.2 -70,-0.1 -69,-0.0 -71,-0.1 -0.852 90.9-117.7-120.6 158.4 43.6 30.2 15.8 133 138 A G + 0 0 1 -2,-0.3 -70,-2.3 -72,-0.2 2,-0.5 0.394 68.8 136.3 -77.9 8.1 46.1 27.4 16.3 134 139 A N > - 0 0 21 1,-0.2 3,-1.3 -72,-0.2 -2,-0.2 -0.377 49.0-156.7 -66.4 111.6 43.3 25.0 15.3 135 140 A L G > S+ 0 0 0 -2,-0.5 3,-0.7 -123,-0.3 -1,-0.2 0.272 78.7 96.3 -65.1 16.5 44.6 22.4 12.9 136 141 A N G 3 S+ 0 0 29 -123,-0.3 -1,-0.3 1,-0.2 -40,-0.2 0.447 85.6 37.0 -95.4 8.4 41.1 22.3 12.0 137 142 A G G < S+ 0 0 10 -3,-1.3 -12,-4.1 -12,-0.1 -1,-0.2 0.027 108.2 68.6-134.5 24.2 41.3 24.6 9.1 138 143 A Q X> + 0 0 0 -3,-0.7 4,-1.2 -14,-0.3 3,-1.0 0.474 58.0 105.2-123.6 -6.7 44.7 23.4 7.9 139 144 A P H >> S+ 0 0 0 0, 0.0 3,-0.7 0, 0.0 4,-0.5 0.867 84.8 48.2 -41.4 -51.1 44.1 19.9 6.6 140 145 A V H >> S+ 0 0 1 -17,-1.5 4,-2.0 1,-0.2 3,-0.6 0.791 103.3 61.8 -63.2 -31.9 44.4 20.9 3.0 141 146 A A H <4 S+ 0 0 1 -3,-1.0 -1,-0.2 -18,-0.5 -17,-0.1 0.815 104.0 48.6 -65.3 -32.3 47.6 22.8 3.5 142 147 A F H << S+ 0 0 12 -4,-1.2 -1,-0.2 -3,-0.7 -2,-0.2 0.603 114.3 47.9 -82.6 -12.1 49.5 19.7 4.7 143 148 A L H << S+ 0 0 2 -3,-0.6 21,-1.1 -4,-0.5 20,-0.3 0.750 88.9 94.7 -99.4 -29.3 48.2 17.8 1.7 144 149 A L B < -i 164 0C 0 -4,-2.0 21,-0.2 1,-0.2 3,-0.1 -0.465 56.5-157.7 -74.8 132.2 48.9 20.2 -1.1 145 150 A K S > S+ 0 0 107 19,-1.7 3,-1.9 -2,-0.3 -1,-0.2 0.868 95.7 61.3 -68.5 -38.7 52.2 19.8 -3.1 146 151 A E T 3 S+ 0 0 76 1,-0.3 -1,-0.2 18,-0.2 19,-0.1 0.831 100.8 52.6 -58.6 -33.0 51.9 23.5 -4.1 147 152 A L T > S+ 0 0 2 -6,-0.1 3,-1.2 -3,-0.1 2,-0.8 0.261 79.5 134.6 -91.3 18.6 52.0 24.6 -0.4 148 153 A K T < S- 0 0 129 -3,-1.9 -3,-0.1 1,-0.3 -6,-0.1 -0.542 82.2 -4.1 -74.1 103.3 55.3 22.6 0.2 149 154 A G T 3 S+ 0 0 63 -2,-0.8 -1,-0.3 2,-0.3 -2,-0.1 0.402 95.9 118.6 96.9 3.0 57.8 24.7 2.1 150 155 A K S < S+ 0 0 108 -3,-1.2 -2,-0.1 2,-0.1 -22,-0.1 0.309 84.3 21.6 -83.6 13.1 55.5 27.6 2.0 151 156 A F S S- 0 0 30 -4,-0.1 -2,-0.3 793,-0.1 3,-0.1 -0.959 100.0 -76.9-169.0 157.3 55.5 27.3 5.8 152 157 A P - 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0 0 17 -2,-0.2 759,-0.6 -56,-0.1 5,-0.1 -0.877 27.3-138.7-112.0 121.4 36.4 31.9 3.9 178 183 A D > - 0 0 56 -2,-0.6 4,-1.5 757,-0.1 5,-0.2 -0.197 28.9-107.4 -65.9 157.5 39.2 33.8 5.7 179 184 A P H >> S+ 0 0 71 0, 0.0 4,-2.9 0, 0.0 3,-1.8 0.959 119.4 45.5 -48.9 -63.7 41.3 36.2 3.9 180 185 A G H 3> S+ 0 0 8 1,-0.3 4,-2.5 2,-0.2 5,-0.1 0.865 114.8 51.0 -47.6 -44.2 44.5 34.1 3.8 181 186 A E H 3> S+ 0 0 5 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.683 110.0 47.4 -69.6 -22.2 42.4 31.2 2.7 182 187 A H H X S+ 0 0 25 -4,-2.9 4,-2.5 753,-0.2 3,-1.5 0.990 107.7 48.3 -55.9 -66.8 44.0 34.3 -1.2 184 189 A I H 3X S+ 0 0 0 -4,-2.5 4,-3.2 1,-0.3 5,-0.2 0.863 111.3 48.9 -40.2 -57.6 45.6 30.8 -1.5 185 190 A I H 3<>S+ 0 0 1 -4,-1.1 5,-2.3 1,-0.2 -1,-0.3 0.728 114.5 46.1 -61.2 -24.3 42.7 29.3 -3.5 186 191 A K H <<5S+ 0 0 96 -3,-1.5 3,-0.5 -4,-1.3 -1,-0.2 0.794 114.2 50.2 -84.5 -32.0 42.7 32.3 -5.9 187 192 A T H <5S+ 0 0 66 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.907 116.6 38.0 -71.2 -46.2 46.5 32.0 -6.2 188 193 A L T <5S- 0 0 29 -4,-3.2 -1,-0.2 -5,-0.2 -2,-0.1 0.187 107.0-123.2 -92.9 16.4 46.6 28.2 -6.9 189 194 A G T 5 - 0 0 38 -3,-0.5 2,-0.5 -5,-0.2 -3,-0.2 0.919 40.4-174.5 39.4 67.5 43.5 28.3 -9.1 190 195 A I < - 0 0 4 -5,-2.3 2,-0.4 -6,-0.1 -1,-0.2 -0.835 25.1-120.2 -96.1 125.7 41.6 25.8 -7.0 191 196 A K B +f 170 0A 74 -25,-0.6 -20,-1.3 -22,-0.5 2,-0.3 -0.494 46.9 156.7 -70.3 123.3 38.3 24.7 -8.4 192 197 A Y - 0 0 31 -2,-0.4 2,-0.2 -22,-0.2 -20,-0.2 -0.864 39.6-149.5-140.9 171.1 35.4 25.4 -6.1 193 198 A F - 0 0 2 -22,-0.4 -20,-2.0 -2,-0.3 -19,-0.3 -0.680 24.0-166.3-144.3 81.2 31.6 26.0 -6.0 194 199 A S >> - 0 0 0 -21,-0.2 4,-1.8 -2,-0.2 3,-1.0 -0.186 47.6 -85.8 -63.4 165.5 30.8 28.3 -3.1 195 200 A M H 3> S+ 0 0 0 -21,-2.0 4,-2.9 1,-0.3 5,-0.1 0.823 131.4 58.8 -43.3 -35.8 27.2 28.5 -2.1 196 201 A T H 3> S+ 0 0 15 -22,-0.3 4,-3.3 1,-0.2 -1,-0.3 0.936 103.6 49.4 -63.1 -45.6 26.7 31.2 -4.8 197 202 A E H <>>S+ 0 0 42 -3,-1.0 4,-3.4 2,-0.2 5,-0.5 0.895 111.6 49.8 -60.7 -38.2 27.9 28.9 -7.6 198 203 A V H X5S+ 0 0 1 -4,-1.8 4,-1.1 3,-0.2 -1,-0.2 0.959 111.9 48.7 -63.3 -47.9 25.4 26.3 -6.3 199 204 A D H <5S+ 0 0 21 -4,-2.9 635,-0.5 -5,-0.2 -2,-0.2 0.920 118.0 40.4 -53.8 -53.2 22.7 28.9 -6.3 200 205 A K H <5S+ 0 0 97 -4,-3.3 -2,-0.2 -5,-0.1 -1,-0.2 0.964 129.8 25.7 -61.7 -59.7 23.5 30.0 -9.7 201 206 A L H <5S- 0 0 57 -4,-3.4 4,-0.2 -5,-0.2 -3,-0.2 0.991 102.5-123.4 -74.2 -61.7 24.2 26.7 -11.3 202 207 A G X< - 0 0 24 -4,-1.1 4,-2.4 -5,-0.5 5,-0.3 -0.258 28.7 -87.9 123.8 146.1 22.2 24.2 -9.2 203 208 A I H > S+ 0 0 5 1,-0.2 4,-2.3 311,-0.2 5,-0.2 0.932 127.6 55.2 -51.7 -44.8 23.3 21.1 -7.4 204 209 A G H > S+ 0 0 4 310,-0.4 4,-1.5 1,-0.2 3,-0.3 0.945 110.6 39.1 -51.2 -62.8 22.8 19.2 -10.6 205 210 A K H > S+ 0 0 89 -4,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.871 113.8 57.7 -58.7 -37.9 25.0 21.3 -12.9 206 211 A V H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.889 107.3 45.9 -58.8 -44.0 27.6 21.6 -10.2 207 212 A M H X S+ 0 0 0 -4,-2.3 4,-1.1 -3,-0.3 -1,-0.2 0.772 110.1 56.3 -71.0 -25.9 28.0 17.8 -9.9 208 213 A E H X S+ 0 0 102 -4,-1.5 4,-2.0 -5,-0.2 -2,-0.2 0.890 112.5 41.2 -72.7 -39.7 28.1 17.6 -13.7 209 214 A E H X S+ 0 0 46 -4,-2.2 4,-3.4 2,-0.2 5,-0.4 0.989 109.4 54.3 -72.3 -57.8 31.1 20.1 -13.7 210 215 A T H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.3 -1,-0.2 0.844 113.9 48.7 -44.6 -34.4 33.0 18.8 -10.8 211 216 A F H X S+ 0 0 27 -4,-1.1 4,-1.5 -5,-0.2 5,-0.4 0.911 111.8 42.3 -76.2 -45.4 32.8 15.5 -12.6 212 217 A S H X S+ 0 0 76 -4,-2.0 4,-1.2 -3,-0.3 5,-0.2 0.839 118.4 51.2 -69.9 -29.3 33.9 16.5 -16.1 213 218 A Y H < S+ 0 0 76 -4,-3.4 -2,-0.2 -5,-0.2 4,-0.2 0.905 119.8 30.9 -71.4 -45.4 36.6 18.6 -14.4 214 219 A L H < S+ 0 0 4 -4,-2.1 -2,-0.2 -5,-0.4 6,-0.2 0.516 138.3 21.5 -93.3 -7.1 38.1 15.9 -12.2 215 220 A L H < S+ 0 0 16 -4,-1.5 -3,-0.2 -5,-0.1 -2,-0.2 0.485 84.2 109.3-136.4 -9.6 37.4 12.9 -14.4 216 221 A G S < S+ 0 0 44 -4,-1.2 -3,-0.1 -5,-0.4 3,-0.1 0.858 97.7 20.0 -37.0 -54.7 37.0 14.2 -18.0 217 222 A R S S+ 0 0 226 1,-0.2 2,-0.4 -5,-0.2 -1,-0.1 0.979 132.0 24.7 -83.2 -71.9 40.3 12.7 -19.1 218 223 A K S S- 0 0 153 -4,-0.1 2,-0.6 0, 0.0 -1,-0.2 -0.820 72.0-135.0-100.1 137.9 41.3 10.0 -16.7 219 224 A K + 0 0 144 -2,-0.4 -4,-0.1 -3,-0.1 -3,-0.0 -0.809 42.5 168.5 -86.7 120.7 38.8 8.1 -14.6 220 225 A R - 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