==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-FEB-10 3LP4 . COMPND 2 MOLECULE: ARGINASE-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.DI COSTANZO,D.W.CHRISTIANSON . 628 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24576.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 454 72.3 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 . 6 1.0 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 . 57 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 185 29.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.8 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 3 2 0 2 1 1 0 1 2 0 0 0 2 0 2 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 6 6 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 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 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 0 150 0, 0.0 40,-0.9 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0-153.6 18.8 -11.1 -5.3 2 7 A T E -a 41 0A 37 38,-0.2 86,-3.6 84,-0.1 2,-0.2 -0.773 360.0-157.7 -88.2 113.9 15.4 -11.1 -3.6 3 8 A I E -ab 42 88A 0 38,-1.4 40,-1.1 -2,-0.7 2,-0.4 -0.619 23.0-165.7 -99.8 151.9 15.5 -13.6 -0.7 4 9 A G E -ab 43 89A 0 84,-2.5 86,-2.2 -2,-0.2 2,-0.3 -0.858 19.5-157.1-134.0 94.6 12.9 -15.6 1.2 5 10 A I E +ab 44 90A 1 38,-1.2 40,-4.2 -2,-0.4 2,-0.4 -0.563 13.1 179.1 -78.9 133.3 14.4 -17.0 4.5 6 11 A I E - b 0 91A 1 84,-2.4 86,-2.1 -2,-0.3 2,-0.4 -0.975 18.9-142.5-137.2 122.2 12.9 -20.0 6.1 7 12 A G E -ab 47 92A 0 39,-2.8 41,-2.9 -2,-0.4 86,-0.2 -0.670 13.2-173.2 -84.8 135.9 14.1 -21.7 9.3 8 13 A A - 0 0 0 84,-3.0 2,-2.2 -2,-0.4 86,-0.5 -0.637 2.2-175.8-129.5 74.7 13.9 -25.5 9.5 9 14 A P + 0 0 37 0, 0.0 2,-0.4 0, 0.0 11,-0.2 -0.449 33.5 140.6 -71.4 78.2 14.9 -26.7 13.0 10 15 A F + 0 0 12 -2,-2.2 85,-1.9 9,-0.2 84,-0.7 -0.961 22.1 158.6-126.3 143.9 14.7 -30.4 12.3 11 16 A S > + 0 0 19 -2,-0.4 3,-2.1 83,-0.2 -1,-0.1 0.446 48.7 100.8-137.0 -12.1 17.0 -33.2 13.5 12 17 A K T 3 + 0 0 80 1,-0.3 123,-0.3 55,-0.1 56,-0.2 0.345 66.7 77.7 -64.8 5.9 15.0 -36.4 13.2 13 18 A G T 3 S+ 0 0 1 121,-0.1 123,-2.5 122,-0.1 -1,-0.3 0.530 110.1 14.3 -88.9 -7.9 16.7 -37.4 10.0 14 19 A Q S < S- 0 0 2 -3,-2.1 81,-0.1 121,-0.2 -1,-0.1 -0.941 82.9-100.1-154.5 173.2 19.6 -38.4 12.2 15 20 A P S S+ 0 0 44 0, 0.0 2,-0.5 0, 0.0 488,-0.1 0.911 90.5 78.2 -67.7 -51.9 20.7 -39.3 15.8 16 21 A R > - 0 0 55 486,-0.2 3,-0.7 1,-0.1 485,-0.2 -0.526 63.2-161.2 -70.2 115.5 22.5 -36.2 17.2 17 22 A G G > + 0 0 7 483,-2.1 3,-2.0 -2,-0.5 484,-0.2 0.802 68.3 84.0 -68.4 -38.2 19.9 -33.6 18.2 18 23 A G G > S+ 0 0 5 1,-0.3 3,-1.0 483,-0.2 258,-0.3 0.434 70.9 85.7 -50.7 1.3 21.7 -30.2 18.4 19 24 A V G X S+ 0 0 0 -3,-0.7 3,-1.7 1,-0.2 -1,-0.3 0.737 73.1 70.3 -76.5 -22.7 21.3 -29.7 14.6 20 25 A E G < S+ 0 0 50 -3,-2.0 4,-0.3 1,-0.3 -1,-0.2 0.481 88.7 67.3 -72.9 0.9 17.8 -28.2 15.1 21 26 A E G <> + 0 0 79 -3,-1.0 4,-1.9 252,-0.2 3,-0.5 0.566 69.4 99.5 -93.6 -12.0 19.6 -25.2 16.5 22 27 A G H <> S+ 0 0 0 -3,-1.7 4,-2.6 251,-0.4 5,-0.3 0.869 80.1 50.5 -39.9 -56.2 21.1 -24.3 13.2 23 28 A P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.911 109.8 52.6 -51.1 -47.7 18.6 -21.6 12.4 24 29 A T H > S+ 0 0 61 -3,-0.5 4,-1.9 -4,-0.3 -2,-0.2 0.914 114.8 37.5 -55.8 -53.3 19.1 -20.0 15.9 25 30 A V H X S+ 0 0 32 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.832 114.2 55.6 -72.4 -32.5 22.9 -19.7 15.7 26 31 A L H <>S+ 0 0 1 -4,-2.6 5,-1.1 -5,-0.3 -1,-0.2 0.881 113.5 42.2 -68.1 -34.2 22.9 -18.8 12.0 27 32 A R H ><5S+ 0 0 41 -4,-2.2 3,-1.5 -5,-0.3 -2,-0.2 0.830 110.3 56.2 -77.9 -34.9 20.5 -15.9 12.8 28 33 A K H 3<5S+ 0 0 158 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.792 96.5 63.9 -66.4 -28.8 22.4 -14.9 15.9 29 34 A A T 3<5S- 0 0 31 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.537 125.1-109.3 -71.3 -3.0 25.5 -14.5 13.8 30 35 A G T <>5 + 0 0 12 -3,-1.5 4,-2.2 -5,-0.1 -3,-0.2 0.866 62.1 158.7 79.1 39.7 23.4 -11.8 12.2 31 36 A L H > S+ 0 0 26 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.954 111.7 46.6 -55.6 -54.5 19.6 -11.3 8.1 33 38 A E H > S+ 0 0 98 1,-0.2 4,-1.8 -6,-0.2 -1,-0.2 0.916 112.8 51.3 -54.5 -46.4 21.4 -8.0 8.7 34 39 A K H < S+ 0 0 76 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.926 111.3 46.5 -58.1 -49.1 24.4 -9.2 6.7 35 40 A L H ><>S+ 0 0 0 -4,-2.9 3,-1.6 1,-0.2 5,-0.6 0.971 111.4 50.7 -58.1 -54.0 22.2 -10.1 3.7 36 41 A K H 3<5S+ 0 0 111 -4,-3.1 4,-0.3 1,-0.3 -1,-0.2 0.815 94.3 74.9 -53.3 -30.4 20.3 -6.8 4.0 37 42 A E T 3<5S+ 0 0 137 -4,-1.8 -1,-0.3 -5,-0.3 2,-0.2 0.274 103.8 44.8 -67.9 16.7 23.8 -5.3 4.0 38 43 A Q T < 5S- 0 0 35 -3,-1.6 2,-1.4 2,-0.2 262,-0.1 -0.669 119.2 -61.7-140.0-166.0 23.7 -6.1 0.3 39 44 A E T 5S+ 0 0 78 260,-0.3 2,-0.5 -2,-0.2 -3,-0.1 -0.138 92.5 129.4 -78.1 42.9 21.5 -6.0 -2.8 40 45 A C < - 0 0 13 -2,-1.4 2,-1.1 -5,-0.6 -2,-0.2 -0.902 51.7-160.1-113.8 122.5 19.2 -8.3 -0.9 41 46 A D E -a 2 0A 75 -40,-0.9 -38,-1.4 -2,-0.5 2,-0.5 -0.824 30.8-163.8 -92.6 97.1 15.5 -7.8 -0.3 42 47 A V E +a 3 0A 7 -2,-1.1 2,-0.4 -40,-0.2 -38,-0.2 -0.772 22.5 172.5 -99.2 128.3 15.2 -10.1 2.7 43 48 A K E -a 4 0A 97 -40,-1.1 -38,-1.2 -2,-0.5 2,-0.6 -0.948 20.5-150.2-130.5 108.0 11.9 -11.5 4.1 44 49 A D E -a 5 0A 64 -2,-0.4 -38,-0.2 -40,-0.2 3,-0.1 -0.704 5.0-162.3 -83.4 117.8 12.2 -14.1 6.9 45 50 A Y E - 0 0 82 -40,-4.2 -39,-0.1 -2,-0.6 -1,-0.1 0.187 43.7-125.7 -81.8 17.7 9.3 -16.5 6.8 46 51 A G E - 0 0 25 -41,-0.2 -39,-2.8 -40,-0.1 2,-0.5 -0.101 42.4 -43.9 68.5-169.5 10.3 -17.4 10.4 47 52 A D E -a 7 0A 80 -41,-0.2 -39,-0.2 -3,-0.1 -41,-0.0 -0.837 59.5-118.3 -99.1 133.0 11.0 -20.9 11.7 48 53 A L - 0 0 15 -41,-2.9 2,-0.9 -2,-0.5 -2,-0.0 -0.400 25.7-122.0 -66.7 143.2 8.7 -23.7 10.6 49 54 A P - 0 0 101 0, 0.0 2,-1.3 0, 0.0 -1,-0.1 -0.806 22.9-163.5 -91.1 106.9 6.9 -25.4 13.6 50 55 A F - 0 0 46 -2,-0.9 3,-0.1 -41,-0.2 21,-0.1 -0.592 17.0-149.2 -94.2 76.7 7.8 -29.1 13.5 51 56 A A - 0 0 75 -2,-1.3 19,-0.1 1,-0.1 20,-0.1 -0.003 23.8 -94.5 -46.7 142.5 5.1 -30.5 15.7 52 57 A D - 0 0 145 1,-0.1 -1,-0.1 2,-0.0 3,-0.1 -0.295 28.9-167.5 -60.7 136.6 5.9 -33.6 17.8 53 58 A I + 0 0 51 -3,-0.1 14,-0.2 1,-0.1 13,-0.1 -0.598 11.4 177.2-127.5 68.2 5.0 -37.0 16.3 54 59 A P + 0 0 58 0, 0.0 2,-1.1 0, 0.0 -1,-0.1 0.689 68.8 64.1 -40.6 -38.0 5.4 -39.2 19.4 55 60 A N + 0 0 105 1,-0.1 2,-0.0 -3,-0.1 11,-0.0 -0.729 63.6 127.5 -98.1 85.4 4.3 -42.4 17.7 56 61 A D + 0 0 21 -2,-1.1 8,-0.6 10,-0.1 -1,-0.1 -0.455 31.6 178.9-139.5 64.3 6.9 -42.9 15.0 57 62 A S - 0 0 28 1,-0.1 9,-0.2 7,-0.1 5,-0.0 -0.330 42.8 -84.4 -66.7 148.5 8.3 -46.4 15.2 58 63 A P - 0 0 43 0, 0.0 2,-0.8 0, 0.0 5,-0.2 -0.101 30.0-132.4 -52.3 148.6 11.0 -47.4 12.7 59 64 A F B > S-H 62 0B 51 3,-2.5 3,-2.2 -3,-0.1 2,-0.7 -0.931 73.3 -57.9-104.1 102.4 9.8 -48.6 9.2 60 65 A Q T 3 S- 0 0 120 -2,-0.8 68,-0.1 1,-0.3 0, 0.0 -0.456 124.9 -16.8 60.5-105.8 12.0 -51.7 9.0 61 66 A I T 3 S+ 0 0 62 -2,-0.7 -1,-0.3 66,-0.3 2,-0.2 0.673 114.4 104.8 -99.2 -26.0 15.4 -50.0 9.4 62 67 A V B < -H 59 0B 0 -3,-2.2 -3,-2.5 65,-0.2 2,-0.3 -0.408 62.5-143.3 -64.9 124.7 14.3 -46.4 8.7 63 68 A K - 0 0 49 70,-2.4 72,-0.4 -5,-0.2 -6,-0.1 -0.698 68.2 -6.2 -97.1 143.4 14.1 -44.2 11.7 64 69 A N S > S+ 0 0 31 -8,-0.6 4,-2.1 -2,-0.3 5,-0.3 0.826 73.1 164.4 47.3 44.3 11.5 -41.5 12.5 65 70 A P H > + 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.1 0.826 69.2 48.7 -57.6 -36.0 10.0 -41.8 9.0 66 71 A R H > S+ 0 0 83 2,-0.2 4,-2.1 3,-0.2 5,-0.2 0.894 111.9 44.6 -74.3 -42.8 6.8 -39.9 9.9 67 72 A S H > S+ 0 0 15 2,-0.2 4,-2.4 -14,-0.2 -1,-0.2 0.864 119.2 45.7 -70.3 -34.3 8.3 -36.9 11.6 68 73 A V H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 5,-0.3 0.959 113.4 47.6 -70.3 -52.2 10.8 -36.7 8.8 69 74 A G H X S+ 0 0 0 -4,-2.7 4,-1.4 86,-0.3 -2,-0.2 0.839 115.9 46.8 -57.3 -33.7 8.2 -37.2 6.1 70 75 A K H X S+ 0 0 88 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.910 109.2 51.9 -74.6 -45.7 6.1 -34.6 7.8 71 76 A A H X S+ 0 0 3 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.866 113.2 45.9 -60.0 -37.3 8.9 -32.0 8.3 72 77 A S H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.851 110.9 52.5 -74.7 -35.4 9.7 -32.3 4.6 73 78 A E H X S+ 0 0 70 -4,-1.4 4,-1.5 -5,-0.3 -2,-0.2 0.924 110.5 47.7 -65.0 -45.2 6.1 -32.0 3.5 74 79 A Q H X S+ 0 0 35 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.884 113.1 48.3 -62.6 -42.1 5.6 -28.8 5.6 75 80 A L H X S+ 0 0 0 -4,-1.7 4,-2.8 -5,-0.2 5,-0.3 0.879 103.9 60.5 -67.2 -39.4 8.8 -27.3 4.2 76 81 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.909 106.8 46.3 -55.4 -44.7 7.9 -28.1 0.6 77 82 A G H X S+ 0 0 25 -4,-1.5 4,-1.6 1,-0.2 -1,-0.2 0.873 112.8 50.1 -66.3 -36.7 4.8 -26.0 0.8 78 83 A K H X S+ 0 0 80 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.874 111.4 47.3 -69.2 -39.5 6.7 -23.2 2.5 79 84 A V H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 5,-0.2 0.902 110.1 53.0 -67.9 -42.1 9.4 -23.1 -0.2 80 85 A A H X S+ 0 0 5 -4,-2.2 4,-2.5 -5,-0.3 -2,-0.2 0.884 109.2 52.2 -60.3 -37.2 6.7 -23.2 -2.9 81 86 A E H X S+ 0 0 79 -4,-1.6 4,-1.0 2,-0.2 -2,-0.2 0.974 109.8 44.8 -63.3 -57.4 5.2 -20.2 -1.2 82 87 A V H <>S+ 0 0 0 -4,-2.3 5,-1.4 1,-0.2 -1,-0.2 0.827 114.7 51.1 -58.3 -31.8 8.3 -18.1 -1.1 83 88 A K H ><5S+ 0 0 16 -4,-2.3 3,-2.5 1,-0.2 -1,-0.2 0.918 105.8 52.8 -72.3 -41.5 9.1 -19.1 -4.7 84 89 A K H 3<5S+ 0 0 135 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.698 103.9 60.9 -64.6 -15.4 5.6 -18.1 -5.8 85 90 A N T 3<5S- 0 0 67 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.327 122.0-111.8 -91.2 6.1 6.5 -14.8 -4.1 86 91 A G T < 5S+ 0 0 56 -3,-2.5 2,-0.4 1,-0.2 -3,-0.2 0.915 73.9 131.6 64.7 45.6 9.4 -14.5 -6.6 87 92 A R < - 0 0 30 -5,-1.4 2,-0.7 -4,-0.1 -84,-0.3 -0.977 65.2-113.0-133.8 144.6 12.1 -15.0 -4.0 88 93 A I E -b 3 0A 14 -86,-3.6 -84,-2.5 -2,-0.4 2,-0.3 -0.632 40.5-130.3 -73.0 112.8 15.2 -17.1 -3.7 89 94 A S E -bc 4 267A 0 177,-1.6 179,-2.9 -2,-0.7 2,-0.6 -0.511 22.2-168.8 -70.9 127.4 14.4 -19.6 -0.9 90 95 A L E -bc 5 268A 0 -86,-2.2 -84,-2.4 -2,-0.3 2,-0.6 -0.905 6.6-167.3-118.7 98.6 17.1 -19.8 1.7 91 96 A V E -bc 6 269A 0 177,-2.9 179,-2.3 -2,-0.6 2,-0.6 -0.795 5.3-159.0 -95.1 118.2 16.4 -22.8 4.0 92 97 A L E -bc 7 270A 1 -86,-2.1 -84,-3.0 -2,-0.6 179,-0.2 -0.838 34.1-119.9 -95.8 117.2 18.4 -23.0 7.2 93 98 A G - 0 0 0 177,-2.5 2,-0.2 -2,-0.6 180,-0.1 -0.315 45.9-179.3 -93.0-178.3 18.6 -26.5 8.6 94 99 A G S S- 0 0 0 -84,-0.7 178,-2.2 -86,-0.5 179,-0.3 0.477 78.6 -27.5 90.7 144.6 18.3 -28.7 10.3 95 100 A D > - 0 0 0 -85,-1.9 3,-1.3 176,-0.2 -1,-0.1 -0.272 69.2-100.4 -74.4 166.5 19.6 -32.1 9.1 96 101 A H G > S+ 0 0 0 1,-0.2 3,-1.3 2,-0.2 4,-0.3 0.467 106.0 85.4 -69.4 -4.5 19.8 -32.9 5.3 97 102 A S G > S+ 0 0 0 1,-0.3 3,-1.8 2,-0.2 4,-0.3 0.840 79.2 70.6 -65.8 -27.2 16.6 -35.0 5.2 98 103 A L G X> S+ 0 0 0 -3,-1.3 4,-2.2 1,-0.3 3,-1.3 0.718 74.2 81.9 -59.6 -24.0 14.8 -31.7 4.7 99 104 A A H <> S+ 0 0 0 -3,-1.3 4,-2.7 1,-0.3 5,-0.4 0.825 81.5 67.6 -52.6 -30.4 16.3 -31.4 1.2 100 105 A I H <> S+ 0 0 0 -3,-1.8 4,-1.3 -4,-0.3 -1,-0.3 0.915 108.1 34.4 -57.1 -44.1 13.5 -33.7 0.2 101 106 A G H <> S+ 0 0 0 -3,-1.3 4,-2.7 -4,-0.3 -2,-0.2 0.839 117.0 54.1 -80.7 -33.3 10.9 -31.0 0.9 102 107 A S H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.956 115.0 38.6 -64.4 -52.5 13.0 -28.1 -0.1 103 108 A I H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.868 116.5 52.1 -67.8 -38.2 13.8 -29.5 -3.6 104 109 A S H X S+ 0 0 9 -4,-1.3 4,-0.6 -5,-0.4 -2,-0.2 0.957 111.5 46.0 -63.0 -50.5 10.2 -30.9 -4.0 105 110 A G H X S+ 0 0 0 -4,-2.7 4,-0.8 1,-0.2 3,-0.5 0.831 113.1 50.9 -61.2 -33.5 8.6 -27.5 -3.2 106 111 A H H >X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 3,-0.7 0.922 105.3 55.8 -69.0 -44.9 11.1 -25.8 -5.5 107 112 A A H 3< S+ 0 0 8 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.585 97.8 65.9 -64.3 -12.2 10.3 -28.2 -8.3 108 113 A R H 3< S+ 0 0 134 -4,-0.6 -1,-0.2 -3,-0.5 -2,-0.2 0.890 114.3 26.5 -77.2 -42.4 6.6 -27.2 -8.0 109 114 A V H << S+ 0 0 48 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.1 0.711 140.2 28.8 -90.5 -25.2 7.0 -23.6 -9.1 110 115 A H >< + 0 0 56 -4,-2.3 3,-2.1 -5,-0.2 -1,-0.2 -0.540 65.3 170.2-137.2 69.6 10.1 -24.5 -11.2 111 116 A P T 3 S+ 0 0 92 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.584 77.1 61.5 -56.8 -11.8 9.9 -28.1 -12.4 112 117 A D T 3 S+ 0 0 75 -3,-0.1 -5,-0.1 52,-0.1 52,-0.0 0.303 76.9 138.0-100.4 10.5 13.0 -27.5 -14.7 113 118 A L < - 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0 0 24 -2,-0.3 3,-1.7 -21,-0.2 4,-0.2 -0.467 34.0-107.4 -89.3 164.9 16.3 -36.8 -13.3 166 171 A A T 3 S+ 0 0 4 1,-0.3 25,-0.5 -2,-0.1 3,-0.4 0.725 121.6 50.8 -62.9 -21.1 19.6 -38.4 -12.8 167 172 A K T 3 S+ 0 0 117 1,-0.2 -1,-0.3 23,-0.1 22,-0.0 0.354 91.8 73.3-100.6 7.0 21.1 -35.8 -15.2 168 173 A D S < S+ 0 0 15 -3,-1.7 -53,-3.3 -54,-0.1 2,-0.3 0.335 92.7 68.2 -98.2 6.1 19.6 -32.7 -13.5 169 174 A I E -e 115 0A 1 -3,-0.4 22,-0.7 -55,-0.2 2,-0.4 -0.973 55.5-168.6-133.4 144.7 22.1 -33.0 -10.6 170 175 A V E -ef 116 191A 0 -55,-2.2 -53,-2.4 -2,-0.3 2,-0.3 -0.990 13.4-150.3-131.1 122.5 25.8 -32.6 -10.0 171 176 A Y E -ef 117 192A 0 20,-1.9 22,-1.5 -2,-0.4 2,-0.4 -0.676 13.3-172.0 -89.8 145.6 27.6 -33.7 -6.8 172 177 A I E +ef 118 193A 0 -55,-2.2 -53,-1.5 -2,-0.3 22,-0.2 -0.974 61.4 20.7-141.6 124.3 30.8 -31.9 -5.6 173 178 A G E S+ 0 0 0 20,-2.8 21,-0.2 -2,-0.4 22,-0.2 0.457 70.7 168.3 104.8 4.2 33.1 -32.8 -2.8 174 179 A L E + f 0 194A 3 19,-0.6 21,-2.7 1,-0.1 22,-0.3 -0.169 14.7 143.3 -56.3 137.3 32.4 -36.5 -2.3 175 180 A R + 0 0 51 -55,-2.6 -54,-0.2 19,-0.2 -1,-0.1 0.332 65.9 46.8-155.5 4.1 34.7 -38.5 -0.0 176 181 A D + 0 0 74 -56,-1.6 2,-0.5 67,-0.1 -54,-0.3 -0.546 65.7 161.1-153.1 78.2 32.6 -41.1 1.9 177 182 A V - 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0 0 52 -4,-0.4 -3,-0.2 -5,-0.2 2,-0.2 0.855 41.5-174.7 62.8 37.7 25.1 -42.2 -14.8 190 195 A I < - 0 0 8 -5,-1.9 2,-0.4 -6,-0.3 -1,-0.2 -0.438 24.5-122.4 -68.2 133.3 25.1 -39.4 -12.2 191 196 A K E +f 170 0A 48 -22,-0.7 -20,-1.9 -25,-0.5 2,-0.3 -0.619 44.1 163.0 -78.3 128.1 27.6 -36.5 -12.7 192 197 A Y E -f 171 0A 56 -2,-0.4 2,-0.4 -22,-0.2 -20,-0.2 -0.983 36.1-155.6-146.9 155.0 29.9 -36.1 -9.7 193 198 A F E -f 172 0A 5 -22,-1.5 -20,-2.8 -2,-0.3 -19,-0.6 -0.877 23.6-170.9-130.7 94.6 33.2 -34.5 -8.7 194 199 A S E >> -f 174 0A 19 -2,-0.4 4,-1.6 -21,-0.2 3,-0.5 -0.131 47.8 -87.8 -73.4-178.1 34.6 -36.4 -5.7 195 200 A M H 3> S+ 0 0 19 -21,-2.7 4,-2.0 1,-0.2 5,-0.1 0.745 129.4 63.0 -65.9 -20.1 37.6 -35.0 -3.9 196 201 A T H 3> S+ 0 0 79 -22,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.883 105.0 43.8 -70.2 -39.8 39.7 -36.9 -6.4 197 202 A E H <>>S+ 0 0 40 -3,-0.5 4,-2.7 2,-0.2 5,-0.5 0.798 111.4 53.8 -75.4 -30.4 38.4 -34.9 -9.3 198 203 A V H X5S+ 0 0 1 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.919 110.6 47.0 -68.1 -43.1 38.7 -31.6 -7.5 199 204 A D H <5S+ 0 0 121 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.884 116.7 46.1 -63.9 -39.0 42.4 -32.4 -6.8 200 205 A R H <5S+ 0 0 161 -4,-1.6 -2,-0.2 -5,-0.1 -1,-0.2 0.957 126.3 22.4 -68.1 -56.9 42.9 -33.4 -10.4 201 206 A L H <5S- 0 0 64 -4,-2.7 4,-0.4 1,-0.1 -3,-0.2 0.790 105.1-118.2 -85.3 -31.8 41.2 -30.6 -12.3 202 207 A G X< - 0 0 31 -4,-1.9 4,-1.9 -5,-0.5 3,-0.1 -0.050 33.1 -83.8 100.6 149.5 41.3 -27.8 -9.7 203 208 A I H > S+ 0 0 25 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.776 125.9 59.2 -60.1 -28.1 38.1 -26.2 -8.2 204 209 A G H > S+ 0 0 26 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.960 107.8 41.2 -66.6 -52.0 37.9 -23.8 -11.2 205 210 A K H > S+ 0 0 89 -4,-0.4 4,-3.0 1,-0.2 5,-0.3 0.887 111.6 60.1 -62.4 -39.3 37.6 -26.4 -13.9 206 211 A V H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.939 109.9 39.6 -53.6 -53.8 35.2 -28.4 -11.6 207 212 A M H X S+ 0 0 0 -4,-2.0 4,-3.0 2,-0.2 5,-0.4 0.918 112.3 57.6 -63.6 -44.1 32.7 -25.5 -11.4 208 213 A E H X S+ 0 0 124 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.926 111.6 41.7 -52.5 -48.3 33.2 -24.7 -15.1 209 214 A E H X S+ 0 0 58 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.891 114.8 52.5 -66.6 -40.1 32.2 -28.3 -16.0 210 215 A T H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 5,-0.3 0.969 113.3 40.3 -59.9 -57.7 29.4 -28.3 -13.4 211 216 A L H X S+ 0 0 24 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.864 118.0 49.8 -60.7 -37.5 27.7 -25.1 -14.6 212 217 A S H X S+ 0 0 79 -4,-1.8 4,-1.2 -5,-0.4 -1,-0.2 0.854 110.8 50.5 -68.8 -37.2 28.3 -26.1 -18.2 213 218 A Y H < S+ 0 0 82 -4,-2.4 4,-0.4 2,-0.2 -2,-0.2 0.914 119.7 34.3 -67.8 -45.4 26.8 -29.5 -17.6 214 219 A L H < S+ 0 0 1 -4,-2.6 4,-0.2 1,-0.2 -2,-0.2 0.718 131.4 32.1 -83.7 -23.6 23.7 -28.2 -15.9 215 220 A L H < S+ 0 0 10 -4,-2.2 -3,-0.2 -5,-0.3 -2,-0.2 0.390 92.2 98.4-113.2 0.3 23.3 -25.0 -18.1 216 221 A G S < S+ 0 0 51 -4,-1.2 3,-0.1 1,-0.2 -3,-0.1 0.962 89.2 35.7 -51.9 -65.7 24.8 -26.4 -21.3 217 222 A R S S- 0 0 238 -4,-0.4 2,-0.3 1,-0.2 -1,-0.2 0.892 136.6 -28.3 -58.9 -42.6 21.6 -27.2 -23.2 218 223 A K S S- 0 0 149 -4,-0.2 -1,-0.2 2,-0.0 2,-0.2 -0.934 71.4 -83.5-173.5 151.6 19.7 -24.2 -21.7 219 224 A K + 0 0 139 -2,-0.3 -4,-0.1 -3,-0.1 -3,-0.0 -0.410 50.5 169.1 -65.1 128.2 19.4 -21.9 -18.7 220 225 A R - 0 0 32 -2,-0.2 -107,-0.1 -6,-0.1 -106,-0.1 -0.942 42.0 -85.4-137.7 156.5 17.4 -23.3 -15.8 221 226 A P - 0 0 23 0, 0.0 -107,-2.4 0, 0.0 2,-0.4 -0.308 48.2-133.5 -61.1 146.4 16.8 -22.2 -12.2 222 227 A I E -dg 114 265A 0 42,-3.3 44,-3.0 -109,-0.2 45,-1.9 -0.872 15.7-163.0-112.3 140.1 19.5 -23.6 -9.9 223 228 A H E -dg 115 267A 0 -109,-3.2 -107,-3.0 -2,-0.4 2,-0.6 -0.976 6.7-165.4-118.4 119.1 19.1 -25.3 -6.5 224 229 A L E -dg 116 268A 0 43,-2.9 45,-3.0 -2,-0.5 2,-0.9 -0.909 3.6-170.4-108.4 110.6 22.2 -25.4 -4.3 225 230 A S E -dg 117 269A 0 -109,-2.3 -107,-1.5 -2,-0.6 2,-0.7 -0.863 13.0-168.9-100.4 101.7 21.9 -27.9 -1.4 226 231 A F E -dg 118 270A 6 43,-2.8 45,-2.9 -2,-0.9 2,-0.5 -0.837 9.8-167.3 -99.9 113.3 25.0 -27.1 0.7 227 232 A D E > - g 0 271A 0 -109,-2.8 3,-1.7 -2,-0.7 4,-0.3 -0.852 19.0-142.4 -93.3 128.9 25.9 -29.6 3.5 228 233 A V G > S+ 0 0 4 43,-2.8 3,-1.3 -2,-0.5 -1,-0.1 0.759 97.9 68.6 -66.7 -22.2 28.5 -27.9 5.7 229 234 A D G 3 S+ 0 0 1 1,-0.3 14,-0.4 42,-0.2 -1,-0.3 0.473 81.0 81.4 -74.6 2.6 30.3 -31.2 6.2 230 235 A G G < S+ 0 0 0 -3,-1.7 17,-1.7 -112,-0.2 -1,-0.3 0.873 84.2 67.0 -71.4 -37.7 31.1 -30.8 2.6 231 236 A L B < S-j 247 0D 3 -3,-1.3 12,-0.3 -4,-0.3 17,-0.2 -0.447 109.9 -81.7 -79.9 158.2 33.9 -28.5 3.6 232 237 A D >> - 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