==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 18-AUG-11 3THE . COMPND 2 MOLECULE: ARGINASE-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.L.D'ANTONIO,D.W.CHRISTIANSON . 628 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25091.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 453 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 94 15.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 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 . 2 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 . 56 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 188 29.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 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 2 0 6 0 1 1 2 0 2 2 0 0 0 2 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 1 5 4 4 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 . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 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 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 R 0 0 122 0, 0.0 40,-1.2 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 129.9 5.6 20.2 4.8 2 7 A T E -a 41 0A 43 38,-0.2 86,-2.2 84,-0.1 2,-0.3 -0.632 360.0-170.2 -79.0 126.0 3.9 17.2 3.3 3 8 A I E -ab 42 88A 0 38,-2.6 40,-1.4 -2,-0.4 2,-0.4 -0.881 23.5-163.3-124.7 149.7 1.4 18.0 0.4 4 9 A G E -ab 43 89A 0 84,-2.5 86,-2.8 -2,-0.3 2,-0.4 -0.908 19.9-150.8-131.1 103.8 -1.2 16.3 -1.6 5 10 A I E -ab 44 90A 0 38,-2.6 40,-3.2 -2,-0.4 2,-0.4 -0.602 14.0-177.6 -81.7 128.1 -2.2 18.1 -4.9 6 11 A I E - b 0 91A 0 84,-3.0 86,-2.5 -2,-0.4 2,-0.5 -0.987 15.3-147.2-125.5 125.6 -5.7 17.7 -6.3 7 12 A G E -ab 47 92A 0 39,-2.7 41,-3.0 -2,-0.4 86,-0.2 -0.811 11.2-172.5 -95.5 130.0 -6.7 19.4 -9.6 8 13 A A E - b 0 93A 0 84,-3.9 2,-1.9 -2,-0.5 86,-0.9 -0.691 3.0-178.3-122.7 77.8 -10.3 20.5 -9.9 9 14 A P + 0 0 39 0, 0.0 2,-0.3 0, 0.0 11,-0.2 -0.535 36.8 127.0 -78.0 82.8 -10.9 21.7 -13.5 10 15 A F + 0 0 13 -2,-1.9 85,-1.3 9,-0.3 84,-0.1 -0.999 27.1 165.6-141.0 140.5 -14.5 22.8 -13.1 11 16 A S > + 0 0 14 -2,-0.3 3,-1.7 83,-0.2 5,-0.1 0.339 46.9 106.5-137.2 7.5 -16.3 26.1 -13.9 12 17 A K T 3 + 0 0 91 1,-0.3 123,-0.3 83,-0.1 56,-0.2 0.496 66.5 76.4 -70.0 -3.3 -20.0 25.4 -13.7 13 18 A G T 3 S+ 0 0 0 121,-0.1 123,-2.1 122,-0.1 124,-0.3 0.682 107.7 27.5 -78.8 -14.3 -20.4 27.3 -10.5 14 19 A Q S < S- 0 0 9 -3,-1.7 81,-0.1 121,-0.2 490,-0.1 -0.934 80.7-116.1-142.0 164.2 -20.1 30.5 -12.6 15 20 A P S S+ 0 0 47 0, 0.0 2,-0.8 0, 0.0 489,-0.2 0.573 82.9 88.5 -78.6 -14.0 -20.8 31.8 -16.2 16 21 A R > - 0 0 65 487,-0.1 3,-0.7 488,-0.1 486,-0.3 -0.786 68.2-143.3 -96.6 110.4 -17.3 32.6 -17.5 17 22 A G T 3 S+ 0 0 16 484,-2.4 259,-0.1 -2,-0.8 257,-0.0 -0.240 73.3 64.4 -65.7 153.5 -15.5 29.8 -19.1 18 23 A G T > + 0 0 4 258,-0.1 3,-1.2 257,-0.1 -1,-0.2 0.067 69.5 97.3 121.7 -23.4 -11.7 29.3 -18.7 19 24 A V G X S+ 0 0 1 -3,-0.7 3,-1.8 1,-0.3 -9,-0.3 0.717 70.7 71.5 -68.9 -23.1 -11.5 28.6 -15.0 20 25 A E G 3 S+ 0 0 57 1,-0.3 4,-0.3 -11,-0.2 -1,-0.3 0.739 91.1 62.9 -63.9 -21.9 -11.4 24.9 -15.6 21 26 A E G <> S+ 0 0 86 -3,-1.2 4,-2.6 1,-0.2 5,-0.3 0.502 72.3 97.9 -81.0 -7.1 -7.9 25.6 -16.9 22 27 A G H <> S+ 0 0 0 -3,-1.8 4,-2.2 251,-0.3 5,-0.2 0.920 82.0 50.4 -46.4 -54.5 -6.6 26.8 -13.5 23 28 A P H > S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.892 113.3 45.9 -52.2 -45.6 -5.1 23.4 -12.6 24 29 A T H > S+ 0 0 70 -4,-0.3 4,-3.0 -3,-0.2 -2,-0.2 0.935 113.1 46.2 -68.0 -47.8 -3.2 23.2 -15.9 25 30 A V H X S+ 0 0 31 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.843 114.5 50.2 -64.1 -33.1 -1.8 26.7 -16.1 26 31 A L H <>S+ 0 0 0 -4,-2.2 5,-1.5 -5,-0.3 -1,-0.2 0.880 114.2 42.6 -72.2 -39.7 -0.7 26.4 -12.4 27 32 A R H ><5S+ 0 0 47 -4,-2.0 3,-1.7 -5,-0.2 6,-0.2 0.886 111.1 58.0 -71.3 -37.4 1.0 23.1 -13.0 28 33 A K H 3<5S+ 0 0 176 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.858 98.6 58.4 -57.9 -39.6 2.4 24.6 -16.3 29 34 A A T 3<5S- 0 0 34 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.538 126.0-103.0 -69.3 -7.8 4.1 27.4 -14.3 30 35 A G T <>5 + 0 0 8 -3,-1.7 4,-3.0 -4,-0.2 5,-0.2 0.761 65.2 155.5 92.3 29.0 5.9 24.7 -12.4 31 36 A L H > S+ 0 0 21 -5,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.940 114.7 47.6 -65.5 -44.8 5.0 21.0 -8.2 33 38 A E H > S+ 0 0 103 -6,-0.2 4,-2.3 1,-0.2 5,-0.3 0.965 111.8 50.3 -58.5 -53.3 8.6 21.5 -9.1 34 39 A K H X S+ 0 0 91 -4,-3.0 4,-1.1 1,-0.2 -1,-0.2 0.837 109.3 51.3 -55.3 -37.0 8.8 24.8 -7.1 35 40 A L H < S+ 0 0 0 -4,-1.9 5,-0.3 -5,-0.2 -1,-0.2 0.930 108.7 51.7 -67.4 -43.8 7.3 23.1 -4.0 36 41 A K H X S+ 0 0 110 -4,-2.1 4,-0.7 1,-0.2 -2,-0.2 0.930 105.8 52.9 -56.4 -51.1 9.8 20.3 -4.2 37 42 A E H < S+ 0 0 167 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.834 109.2 64.1 -53.8 -32.7 12.7 22.7 -4.4 38 43 A Q T < S- 0 0 27 -4,-1.1 2,-1.9 -5,-0.3 262,-0.1 0.028 123.0 -71.0 -76.0-170.8 11.2 24.2 -1.3 39 44 A E T 4 S+ 0 0 73 260,-0.3 2,-0.4 2,-0.0 -3,-0.1 -0.536 94.0 122.4 -85.6 73.7 10.9 22.2 2.0 40 45 A C < - 0 0 20 -2,-1.9 2,-0.8 -4,-0.7 -38,-0.2 -0.987 56.2-156.0-148.3 141.1 8.2 19.9 0.6 41 46 A D E -a 2 0A 86 -40,-1.2 -38,-2.6 -2,-0.4 2,-0.3 -0.899 35.9-168.0-106.6 99.4 7.2 16.3 -0.0 42 47 A V E -a 3 0A 15 -2,-0.8 2,-0.4 -40,-0.2 -38,-0.2 -0.728 16.6-175.8 -99.9 141.2 4.7 16.6 -2.8 43 48 A K E -a 4 0A 98 -40,-1.4 -38,-2.6 -2,-0.3 2,-0.6 -0.998 17.6-142.7-133.0 127.3 2.3 14.0 -4.2 44 49 A D E -a 5 0A 61 -2,-0.4 -38,-0.2 -40,-0.2 3,-0.1 -0.806 14.5-175.4 -95.1 122.5 0.0 14.6 -7.2 45 50 A Y E - 0 0 37 -40,-3.2 -39,-0.1 -2,-0.6 -1,-0.1 0.289 45.3-129.7 -94.6 7.7 -3.4 13.0 -7.0 46 51 A G E - 0 0 25 -41,-0.3 -39,-2.7 2,-0.1 2,-0.6 -0.119 39.0 -43.9 74.1-173.0 -4.0 14.3 -10.5 47 52 A D E -a 7 0A 59 -41,-0.2 -39,-0.2 -3,-0.1 -41,-0.0 -0.843 61.7-113.5 -97.8 123.5 -7.0 16.2 -11.8 48 53 A L - 0 0 16 -41,-3.0 2,-1.2 -2,-0.6 -2,-0.1 -0.309 26.9-130.0 -55.0 127.2 -10.4 15.0 -10.7 49 54 A P - 0 0 106 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 -0.698 22.7-159.9 -85.3 95.4 -12.3 13.6 -13.8 50 55 A F - 0 0 45 -2,-1.2 21,-0.1 -41,-0.2 17,-0.0 -0.681 12.2-152.2 -80.6 109.7 -15.6 15.4 -13.6 51 56 A A - 0 0 74 -2,-0.8 2,-0.1 1,-0.1 19,-0.0 -0.153 26.4 -78.7 -77.3 171.4 -18.2 13.4 -15.7 52 57 A D - 0 0 160 1,-0.1 -1,-0.1 4,-0.0 0, 0.0 -0.447 33.9-146.3 -71.9 142.3 -21.3 14.6 -17.5 53 58 A I > - 0 0 45 1,-0.2 3,-1.4 -2,-0.1 14,-0.1 -0.906 12.3-152.9-113.0 101.6 -24.5 15.2 -15.5 54 59 A P T 3 S+ 0 0 127 0, 0.0 2,-2.3 0, 0.0 -1,-0.2 0.876 85.0 28.6 -35.1 -97.9 -27.5 14.3 -17.6 55 60 A N T 3 S+ 0 0 130 1,-0.2 2,-5.3 2,-0.0 11,-0.1 0.044 74.3 162.1 -63.6 34.3 -30.6 16.3 -16.5 56 61 A D < + 0 0 34 -2,-2.3 8,-0.3 -3,-1.4 -1,-0.2 -0.119 21.6 160.8 -57.3 60.1 -28.3 19.1 -15.3 57 62 A S - 0 0 59 -2,-5.3 9,-0.3 1,-0.1 2,-0.1 -0.559 47.3 -95.4 -87.2 146.9 -31.3 21.3 -15.3 58 63 A P - 0 0 65 0, 0.0 2,-1.0 0, 0.0 5,-0.2 -0.391 28.0-139.2 -63.5 133.7 -31.5 24.7 -13.4 59 64 A F B > -H 62 0B 49 3,-2.4 3,-2.2 74,-0.1 2,-0.2 -0.833 66.2 -60.0 -95.4 98.0 -33.1 24.4 -10.0 60 65 A Q T 3 S- 0 0 131 -2,-1.0 0, 0.0 1,-0.3 0, 0.0 -0.467 121.7 -17.1 61.9-124.8 -35.2 27.5 -9.9 61 66 A I T 3 S+ 0 0 62 66,-0.2 2,-0.4 -2,-0.2 -1,-0.3 0.687 117.4 104.5 -83.0 -18.6 -32.6 30.3 -10.3 62 67 A V B < -H 59 0B 1 -3,-2.2 -3,-2.4 65,-0.1 2,-0.3 -0.490 63.2-147.8 -70.3 121.6 -29.8 27.9 -9.3 63 68 A K - 0 0 54 70,-1.6 72,-0.3 -2,-0.4 5,-0.1 -0.627 65.8 -6.3 -94.8 148.5 -27.7 26.9 -12.3 64 69 A N S > S+ 0 0 44 -8,-0.3 4,-3.0 -2,-0.3 5,-0.4 0.759 74.1 159.8 41.9 38.9 -25.9 23.6 -12.9 65 70 A P H > S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.889 70.7 48.2 -55.2 -42.2 -26.8 22.4 -9.4 66 71 A R H > S+ 0 0 72 -9,-0.3 4,-2.6 2,-0.2 5,-0.2 0.903 115.4 44.0 -66.5 -41.6 -26.3 18.7 -10.2 67 72 A S H > S+ 0 0 6 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.971 118.4 42.9 -65.7 -56.4 -22.9 19.3 -11.9 68 73 A V H X S+ 0 0 0 -4,-3.0 4,-2.4 1,-0.2 5,-0.2 0.916 117.1 48.6 -56.8 -45.2 -21.6 21.6 -9.2 69 74 A G H X S+ 0 0 0 -4,-2.8 4,-2.4 -5,-0.4 -1,-0.2 0.925 113.5 44.6 -62.4 -47.1 -23.0 19.4 -6.5 70 75 A K H X S+ 0 0 100 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.875 110.9 55.9 -65.0 -38.4 -21.5 16.2 -7.9 71 76 A A H X S+ 0 0 2 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.947 111.5 42.0 -59.2 -49.7 -18.2 18.0 -8.6 72 77 A S H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 -1,-0.2 0.878 110.3 58.4 -65.7 -37.3 -17.9 19.0 -4.9 73 78 A E H X S+ 0 0 62 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.916 110.0 42.9 -58.5 -43.1 -19.1 15.6 -3.8 74 79 A Q H X S+ 0 0 62 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.885 113.2 51.4 -69.5 -41.7 -16.2 14.0 -5.6 75 80 A L H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.948 105.6 56.7 -59.7 -48.4 -13.7 16.5 -4.5 76 81 A A H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.3 -1,-0.2 0.899 107.4 48.1 -50.0 -47.0 -14.8 16.0 -0.9 77 82 A G H X S+ 0 0 33 -4,-1.5 4,-1.5 1,-0.2 -1,-0.3 0.872 112.2 49.0 -63.9 -37.3 -14.0 12.3 -1.2 78 83 A K H X S+ 0 0 46 -4,-1.9 4,-2.0 -3,-0.2 -2,-0.2 0.905 112.1 47.2 -69.2 -42.6 -10.6 13.0 -2.7 79 84 A V H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 5,-0.3 0.925 109.2 54.0 -64.2 -44.8 -9.7 15.5 -0.0 80 85 A A H X S+ 0 0 2 -4,-2.5 4,-1.3 -5,-0.3 -1,-0.2 0.887 108.2 53.0 -55.8 -38.0 -10.8 13.2 2.7 81 86 A E H X S+ 0 0 76 -4,-1.5 4,-1.1 1,-0.2 -1,-0.2 0.919 109.4 45.2 -65.2 -46.1 -8.5 10.7 1.1 82 87 A V H <>S+ 0 0 0 -4,-2.0 5,-2.1 1,-0.2 -2,-0.2 0.847 110.2 54.7 -69.0 -32.3 -5.4 12.9 1.2 83 88 A K H ><5S+ 0 0 15 -4,-2.6 3,-0.9 1,-0.2 -1,-0.2 0.799 106.8 52.5 -69.7 -26.8 -6.1 14.0 4.8 84 89 A K H 3<5S+ 0 0 150 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.786 101.5 59.3 -78.4 -25.7 -6.2 10.4 5.7 85 90 A N T 3<5S- 0 0 84 -4,-1.1 -1,-0.2 -5,-0.1 -2,-0.2 0.275 122.6-107.7 -84.3 12.6 -2.8 9.9 4.1 86 91 A G T < 5S+ 0 0 53 -3,-0.9 2,-0.3 1,-0.2 -3,-0.2 0.764 77.3 128.8 69.0 29.2 -1.5 12.5 6.5 87 92 A R < - 0 0 34 -5,-2.1 2,-0.4 -86,-0.0 -1,-0.2 -0.831 65.5-112.4-118.2 154.3 -1.1 15.2 3.9 88 93 A I E -b 3 0A 7 -86,-2.2 -84,-2.5 -2,-0.3 2,-0.5 -0.687 41.5-123.1 -78.0 131.4 -2.2 18.8 3.6 89 94 A S E -bc 4 267A 0 177,-1.5 179,-3.0 -2,-0.4 2,-0.7 -0.670 24.6-166.5 -82.5 125.8 -4.8 19.0 0.8 90 95 A L E -bc 5 268A 0 -86,-2.8 -84,-3.0 -2,-0.5 2,-0.5 -0.881 5.1-168.8-115.7 101.4 -3.9 21.4 -2.0 91 96 A V E -bc 6 269A 0 177,-3.1 179,-2.4 -2,-0.7 2,-0.5 -0.790 6.6-174.0 -95.6 123.6 -6.9 22.1 -4.3 92 97 A L E +bc 7 270A 0 -86,-2.5 -84,-3.9 -2,-0.5 2,-0.2 -0.969 32.5 140.8-111.2 120.7 -6.2 23.9 -7.5 93 98 A G E -b 8 0A 0 177,-1.8 180,-0.5 -2,-0.5 -71,-0.1 -0.597 52.6 -98.7-143.7-157.9 -9.4 24.6 -9.2 94 99 A G S S+ 0 0 0 -86,-0.9 178,-3.0 1,-0.4 179,-0.3 0.372 85.5 2.8 -99.2-123.2 -12.0 26.5 -11.2 95 100 A D S > S- 0 0 0 -85,-1.3 3,-1.2 176,-0.2 -1,-0.4 -0.108 73.6-109.2 -67.8 163.8 -14.7 28.4 -9.4 96 101 A H G > S+ 0 0 0 1,-0.3 3,-2.2 2,-0.2 4,-0.2 0.501 100.8 89.4 -71.0 -7.5 -15.1 28.7 -5.7 97 102 A S G > S+ 0 0 0 1,-0.3 3,-2.5 2,-0.2 4,-0.4 0.883 75.6 72.2 -58.0 -34.2 -18.2 26.5 -5.6 98 103 A L G <> S+ 0 0 0 -3,-1.2 4,-2.4 1,-0.3 3,-0.4 0.657 73.8 81.5 -55.2 -16.2 -15.7 23.7 -5.1 99 104 A A H <> S+ 0 0 0 -3,-2.2 4,-2.1 1,-0.2 5,-0.4 0.749 81.7 66.7 -63.0 -21.0 -15.0 25.0 -1.6 100 105 A I H <> S+ 0 0 0 -3,-2.5 4,-1.8 -4,-0.2 -1,-0.2 0.967 108.6 35.4 -63.2 -49.9 -18.1 23.0 -0.7 101 106 A G H > S+ 0 0 0 -3,-0.4 4,-2.6 -4,-0.4 5,-0.3 0.889 117.2 52.7 -70.6 -41.2 -16.3 19.8 -1.5 102 107 A S H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.953 116.4 36.9 -60.5 -53.5 -12.9 20.8 -0.2 103 108 A I H X S+ 0 0 1 -4,-2.1 4,-3.2 2,-0.2 5,-0.2 0.917 117.7 50.9 -68.3 -43.6 -14.0 21.9 3.2 104 109 A S H X S+ 0 0 8 -4,-1.8 4,-1.2 -5,-0.4 -2,-0.2 0.941 113.0 46.0 -59.3 -47.5 -16.6 19.2 3.6 105 110 A G H X S+ 0 0 0 -4,-2.6 4,-0.7 -5,-0.2 3,-0.4 0.906 115.0 47.9 -61.6 -40.9 -14.1 16.5 2.7 106 111 A H H >X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.3 3,-0.9 0.907 106.4 56.1 -66.6 -43.3 -11.5 18.1 5.0 107 112 A A H 3< S+ 0 0 7 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.758 96.2 67.1 -61.7 -24.6 -14.0 18.4 7.9 108 113 A R H 3< S+ 0 0 133 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.879 113.6 28.9 -63.7 -38.4 -14.6 14.6 7.7 109 114 A V H << S+ 0 0 39 -3,-0.9 -2,-0.2 -4,-0.7 -1,-0.2 0.758 137.8 27.7 -91.6 -30.4 -11.1 13.9 8.9 110 115 A H >< + 0 0 56 -4,-2.4 3,-1.8 -5,-0.1 -1,-0.2 -0.583 65.4 172.2-134.3 72.4 -10.6 17.0 10.9 111 116 A P T 3 S+ 0 0 94 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.572 75.6 63.1 -56.2 -12.3 -14.1 18.2 12.2 112 117 A D T 3 S+ 0 0 80 -3,-0.1 -5,-0.1 52,-0.1 52,-0.0 0.232 75.1 132.2-100.7 13.6 -12.4 20.8 14.4 113 118 A L < - 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0 0 6 -5,-1.7 2,-0.4 -6,-0.3 -1,-0.2 -0.399 31.2-113.4 -68.0 138.2 -19.3 36.1 11.7 191 196 A K E +f 170 0A 52 -22,-0.7 -20,-1.7 -25,-0.5 2,-0.3 -0.573 48.8 163.0 -73.0 126.4 -15.8 37.4 12.2 192 197 A Y E -f 171 0A 64 -2,-0.4 2,-0.4 -22,-0.2 -20,-0.2 -0.992 35.7-159.0-148.1 153.9 -14.6 39.5 9.2 193 198 A F E -f 172 0A 6 -22,-1.4 -20,-2.7 -2,-0.3 -19,-0.5 -0.862 22.4-169.3-131.9 92.3 -12.0 42.0 8.2 194 199 A S >> - 0 0 22 -2,-0.4 4,-2.2 -21,-0.2 3,-0.7 -0.225 48.5 -89.7 -72.0 174.5 -13.3 44.0 5.1 195 200 A M H 3> S+ 0 0 18 -21,-2.5 4,-2.5 1,-0.3 5,-0.2 0.794 132.3 62.6 -56.8 -24.1 -10.8 46.2 3.3 196 201 A T H 3> S+ 0 0 74 -22,-0.3 4,-2.5 2,-0.2 -1,-0.3 0.927 105.4 43.3 -64.3 -47.1 -12.1 48.8 5.8 197 202 A E H <> S+ 0 0 28 -3,-0.7 4,-2.7 2,-0.2 5,-0.5 0.835 113.1 52.3 -67.4 -36.5 -10.7 46.7 8.6 198 203 A V H X S+ 0 0 2 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.900 111.6 47.1 -67.1 -39.9 -7.5 46.0 6.7 199 204 A D H < S+ 0 0 126 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.934 117.9 41.8 -65.3 -47.6 -7.0 49.8 6.1 200 205 A R H < S+ 0 0 165 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.959 127.8 26.6 -63.3 -56.6 -7.7 50.7 9.7 201 206 A L H < S- 0 0 64 -4,-2.7 4,-0.5 -5,-0.1 -3,-0.2 0.769 101.2-125.0 -83.1 -31.8 -5.8 47.9 11.5 202 207 A G X - 0 0 30 -4,-1.9 4,-2.3 -5,-0.5 5,-0.1 0.043 31.6 -86.2 93.4 149.7 -3.1 47.0 9.0 203 208 A I H > S+ 0 0 26 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.784 125.4 59.8 -64.2 -28.2 -2.5 43.5 7.8 204 209 A G H > S+ 0 0 28 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.954 111.1 38.6 -65.3 -48.6 -0.3 42.6 10.7 205 210 A K H > S+ 0 0 79 -4,-0.5 4,-3.1 2,-0.2 5,-0.3 0.900 113.8 57.9 -67.5 -39.3 -3.0 43.3 13.3 206 211 A V H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.922 110.2 42.4 -56.4 -47.9 -5.6 41.7 10.9 207 212 A M H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.3 0.921 112.5 54.2 -67.5 -41.0 -3.6 38.5 10.9 208 213 A E H X S+ 0 0 104 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.947 113.5 41.7 -55.8 -51.1 -3.0 38.6 14.6 209 214 A E H X S+ 0 0 61 -4,-3.1 4,-1.8 2,-0.2 -1,-0.2 0.774 112.0 55.5 -69.1 -28.2 -6.7 39.0 15.3 210 215 A T H X S+ 0 0 0 -4,-1.8 4,-1.8 -5,-0.3 -1,-0.2 0.938 114.0 39.6 -69.0 -45.9 -7.7 36.4 12.7 211 216 A L H X S+ 0 0 23 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.820 113.1 54.6 -73.6 -32.7 -5.5 33.8 14.3 212 217 A S H X S+ 0 0 70 -4,-2.1 4,-1.5 -5,-0.3 -1,-0.2 0.941 109.5 48.8 -65.7 -45.8 -6.3 34.8 17.9 213 218 A Y H < S+ 0 0 71 -4,-1.8 4,-0.3 1,-0.2 -2,-0.2 0.921 118.4 38.1 -58.4 -50.3 -10.0 34.4 17.2 214 219 A L H < S+ 0 0 4 -4,-1.8 4,-0.2 1,-0.2 -2,-0.2 0.851 129.3 27.9 -74.1 -37.4 -9.7 31.0 15.6 215 220 A L H < S+ 0 0 9 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.309 88.6 103.7-110.8 9.9 -7.0 29.4 17.8 216 221 A G S < S+ 0 0 53 -4,-1.5 3,-0.1 1,-0.2 -3,-0.1 0.949 87.9 35.9 -55.2 -59.0 -7.5 31.2 21.1 217 222 A R S S- 0 0 195 -4,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.890 136.7 -18.8 -63.5 -43.2 -9.3 28.4 23.0 218 223 A K S S- 0 0 141 -4,-0.2 -1,-0.2 2,-0.0 2,-0.0 -0.980 71.4 -94.5-164.5 153.0 -7.3 25.6 21.4 219 224 A K + 0 0 141 -2,-0.3 -4,-0.1 -3,-0.1 -3,-0.0 -0.364 49.1 166.0 -68.1 152.9 -5.1 24.8 18.4 220 225 A R - 0 0 32 -2,-0.0 -107,-0.1 -106,-0.0 -106,-0.1 -0.973 42.9 -74.6-165.7 154.2 -6.9 23.2 15.5 221 226 A P - 0 0 21 0, 0.0 -107,-2.2 0, 0.0 2,-0.5 -0.259 47.7-140.8 -55.5 137.5 -6.3 22.4 11.8 222 227 A I E -dg 114 265A 0 42,-3.1 44,-3.6 -109,-0.2 45,-1.6 -0.892 11.3-161.8-109.0 133.2 -6.6 25.5 9.5 223 228 A H E -dg 115 267A 0 -109,-2.9 -107,-2.7 -2,-0.5 2,-0.7 -0.949 5.4-160.6-112.2 121.0 -8.2 25.6 6.1 224 229 A L E -dg 116 268A 0 43,-3.0 45,-2.8 -2,-0.5 2,-0.8 -0.899 4.3-170.5-105.5 111.7 -7.3 28.5 3.8 225 230 A S E -dg 117 269A 0 -109,-2.5 -107,-1.9 -2,-0.7 2,-0.6 -0.896 13.0-169.0-101.1 108.5 -9.8 29.0 1.0 226 231 A F E -dg 118 270A 3 43,-2.2 45,-2.7 -2,-0.8 2,-0.7 -0.874 14.2-169.3-109.1 110.9 -8.2 31.6 -1.3 227 232 A D E > - g 0 271A 2 -109,-2.9 3,-2.9 -2,-0.6 4,-0.3 -0.864 22.2-141.1 -94.1 117.0 -10.1 33.3 -4.0 228 233 A V G > S+ 0 0 2 43,-2.2 3,-0.9 -2,-0.7 -1,-0.1 0.644 97.3 70.7 -56.1 -13.1 -7.6 35.1 -6.2 229 234 A D G 3 S+ 0 0 1 1,-0.2 14,-0.4 42,-0.1 -1,-0.3 0.543 76.2 81.8 -81.8 -1.9 -10.0 38.0 -6.6 230 235 A G G < S+ 0 0 0 -3,-2.9 17,-1.9 -112,-0.3 -1,-0.2 0.855 86.5 68.3 -66.0 -32.0 -9.4 38.8 -2.9 231 236 A L B < S-j 247 0D 2 -3,-0.9 12,-0.3 -4,-0.3 17,-0.2 -0.482 107.8 -85.3 -83.5 159.4 -6.3 40.6 -4.2 232 237 A D >> - 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0 0 10 -2,-0.4 3,-2.4 -21,-0.2 -21,-0.1 -0.632 27.8-120.3 -86.6 146.3 -20.6 45.7 -20.8 481 171 B A G > S+ 0 0 4 1,-0.3 3,-0.7 -2,-0.3 25,-0.5 0.722 115.0 59.5 -57.4 -22.7 -20.9 42.0 -21.6 482 172 B K G 3 S+ 0 0 115 1,-0.2 -1,-0.3 23,-0.1 22,-0.0 0.559 95.6 64.8 -83.9 -7.4 -23.3 41.7 -18.7 483 173 B D G < S+ 0 0 23 -3,-2.4 -53,-3.1 -54,-0.1 2,-0.4 0.130 91.3 72.7-102.3 18.7 -25.6 44.2 -20.4 484 174 B I E < -o 430 0E 1 -3,-0.7 22,-0.8 -55,-0.2 2,-0.4 -0.992 54.7-167.5-135.7 143.2 -26.5 42.2 -23.5 485 175 B V E -op 431 506E 0 -55,-2.3 -53,-2.8 -2,-0.4 2,-0.3 -0.999 12.4-148.2-130.7 129.0 -28.7 39.1 -24.0 486 176 B Y E -op 432 507E 0 20,-2.0 22,-1.8 -2,-0.4 2,-0.4 -0.719 13.1-173.7 -95.8 147.6 -28.8 37.0 -27.2 487 177 B I E +op 433 508E 0 -55,-2.3 -53,-1.9 -2,-0.3 22,-0.2 -0.975 62.2 21.8-143.5 127.0 -31.8 35.2 -28.5 488 178 B G E S+ 0 0 0 20,-2.3 21,-0.2 -2,-0.4 22,-0.1 0.498 70.3 166.2 101.7 7.4 -32.1 32.8 -31.4 489 179 B L E + p 0 509E 7 19,-0.5 21,-3.2 1,-0.1 22,-0.4 -0.269 16.4 137.0 -62.5 137.2 -28.5 31.6 -31.8 490 180 B R + 0 0 53 -55,-2.4 -54,-0.2 19,-0.2 -1,-0.1 0.273 64.7 53.2-160.3 7.2 -28.0 28.6 -34.0 491 181 B D + 0 0 72 -56,-1.5 2,-0.5 67,-0.1 -54,-0.4 -0.602 62.9 159.1-152.5 83.8 -24.8 29.3 -36.1 492 182 B V - 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