==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-NOV-09 3KSR . COMPND 2 MOLECULE: PUTATIVE SERINE HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: XANTHOMONAS CAMPESTRIS PV. CAMPESTRIS . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 243 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11792.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 175 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 13.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 14 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 15.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 68 28.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 1 0 1 0 2 1 1 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 0 2 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 . 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A X 0 0 193 0, 0.0 2,-0.2 0, 0.0 25,-0.1 0.000 360.0 360.0 360.0 133.8 0.9 4.3 48.3 2 2 A E E -A 25 0A 134 23,-0.5 23,-1.6 24,-0.2 2,-0.3 -0.488 360.0-152.9 -94.1 151.6 3.4 2.0 46.4 3 3 A A E -A 24 0A 49 21,-0.2 2,-0.5 -2,-0.2 19,-0.1 -0.863 8.5-140.7-119.0 147.8 3.3 -1.8 45.9 4 4 A K E -A 23 0A 110 19,-3.7 19,-2.1 -2,-0.3 2,-0.6 -0.954 14.9-147.4-108.5 127.8 6.1 -4.4 45.3 5 5 A L E -A 22 0A 114 -2,-0.5 2,-0.5 17,-0.2 17,-0.2 -0.842 19.2-178.7 -94.8 120.4 5.3 -7.2 42.8 6 6 A S E -A 21 0A 30 15,-2.6 15,-2.8 -2,-0.6 2,-0.1 -0.978 23.4-132.1-124.3 118.1 7.0 -10.4 43.8 7 7 A S E -A 20 0A 98 -2,-0.5 2,-0.3 13,-0.2 13,-0.3 -0.404 32.5-178.8 -70.0 146.4 6.6 -13.4 41.6 8 8 A I E -A 19 0A 55 11,-2.2 11,-2.4 -2,-0.1 2,-0.4 -0.896 25.9-127.0-142.2 166.6 5.7 -16.6 43.5 9 9 A E E -A 18 0A 104 -2,-0.3 9,-0.2 9,-0.2 7,-0.0 -0.972 17.5-159.2-122.3 130.9 5.1 -20.2 43.0 10 10 A I E -A 17 0A 74 7,-3.1 7,-3.2 -2,-0.4 2,-0.2 -0.945 13.4-143.5-115.9 111.6 1.9 -21.8 44.3 11 11 A P E +A 16 0A 100 0, 0.0 2,-0.3 0, 0.0 5,-0.2 -0.519 27.9 162.3 -77.8 146.6 2.0 -25.6 44.7 12 12 A V E > -A 15 0A 81 3,-2.1 3,-1.6 1,-0.3 -2,-0.1 -0.800 62.3 -45.5-159.4 113.5 -1.1 -27.6 44.0 13 13 A G T 3 S- 0 0 79 -2,-0.3 -1,-0.3 1,-0.3 0, 0.0 -0.167 118.5 -20.2 59.6-145.8 -0.6 -31.4 43.4 14 14 A Q T 3 S+ 0 0 195 -3,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.512 129.7 70.9 -65.8 -5.5 2.2 -32.5 41.1 15 15 A D E < -A 12 0A 120 -3,-1.6 -3,-2.1 -5,-0.0 2,-0.4 -0.608 67.3-144.1-115.5 166.0 2.2 -29.0 39.6 16 16 A E E -A 11 0A 121 -5,-0.2 2,-0.2 -2,-0.2 -3,-0.0 -0.961 15.5-145.9-138.3 124.4 3.2 -25.4 40.6 17 17 A L E -A 10 0A 97 -7,-3.2 -7,-3.1 -2,-0.4 2,-0.3 -0.525 14.9-125.8 -86.8 147.2 1.3 -22.3 39.6 18 18 A S E +A 9 0A 103 -9,-0.2 2,-0.3 -2,-0.2 -9,-0.2 -0.674 41.0 155.9 -88.2 147.0 2.9 -19.0 38.8 19 19 A G E -A 8 0A 14 -11,-2.4 -11,-2.2 -2,-0.3 2,-0.4 -0.924 35.3-119.0-158.1 179.1 1.6 -15.9 40.7 20 20 A T E -A 7 0A 81 -2,-0.3 2,-0.5 -13,-0.3 -13,-0.2 -0.998 12.1-157.4-134.2 129.3 2.3 -12.4 42.0 21 21 A L E -A 6 0A 89 -15,-2.8 -15,-2.6 -2,-0.4 2,-0.6 -0.924 11.4-156.6-100.5 126.1 2.3 -11.2 45.5 22 22 A L E +A 5 0A 109 -2,-0.5 -17,-0.2 -17,-0.2 -2,-0.0 -0.937 21.7 166.3-103.6 123.6 1.7 -7.4 45.9 23 23 A T E -A 4 0A 52 -19,-2.1 -19,-3.7 -2,-0.6 -2,-0.0 -0.927 39.3 -88.4-131.3 156.3 3.0 -5.9 49.1 24 24 A P E +A 3 0A 65 0, 0.0 2,-0.3 0, 0.0 -21,-0.2 -0.297 50.0 160.1 -67.7 152.8 3.7 -2.4 50.4 25 25 A T E +A 2 0A 24 -23,-1.6 -23,-0.5 1,-0.1 71,-0.2 -0.950 47.9 48.2-164.4 166.0 7.0 -0.7 49.8 26 26 A G S S+ 0 0 29 69,-0.5 71,-0.3 -2,-0.3 -24,-0.2 0.851 76.5 166.2 56.2 37.5 8.6 2.7 49.7 27 27 A X E -b 97 0B 21 69,-3.4 71,-2.6 1,-0.1 -1,-0.2 -0.487 42.5-101.8 -82.2 151.3 6.9 3.5 53.0 28 28 A P E - 0 0 20 0, 0.0 28,-2.0 0, 0.0 2,-0.4 -0.457 36.4-144.3 -67.0 145.7 7.8 6.4 55.1 29 29 A G E -bc 102 56B 0 72,-1.9 74,-2.6 69,-0.4 2,-0.5 -0.945 7.2-156.2-116.6 135.2 10.0 5.5 58.1 30 30 A V E -bc 103 57B 2 26,-2.7 28,-2.0 -2,-0.4 2,-0.5 -0.954 3.4-162.4-114.6 127.1 9.8 7.2 61.6 31 31 A L E -bc 104 58B 0 72,-3.0 74,-3.4 -2,-0.5 2,-0.5 -0.910 5.4-157.1-109.1 124.7 12.8 7.2 64.0 32 32 A F E -b 105 0B 5 26,-2.3 2,-0.5 -2,-0.5 28,-0.4 -0.898 5.3-168.3-103.2 123.4 12.2 7.9 67.7 33 33 A V E -b 106 0B 2 72,-2.2 74,-1.8 -2,-0.5 77,-0.1 -0.961 15.9-143.8-110.9 121.7 15.1 9.2 69.7 34 34 A H - 0 0 3 -2,-0.5 3,-0.1 26,-0.4 6,-0.1 -0.366 13.9-113.1 -83.4 164.0 14.5 9.2 73.6 35 35 A G > - 0 0 6 74,-0.2 3,-1.8 1,-0.2 2,-0.2 -0.211 51.8 -61.2 -83.2-178.8 15.7 11.8 76.1 36 36 A W T 3 S+ 0 0 59 1,-0.3 -1,-0.2 71,-0.1 3,-0.1 -0.455 125.6 16.0 -70.5 128.9 18.2 11.3 78.9 37 37 A G T 3 S+ 0 0 47 1,-0.3 -1,-0.3 -2,-0.2 2,-0.1 0.401 109.7 107.9 85.2 -0.7 17.2 8.7 81.4 38 38 A G < - 0 0 22 -3,-1.8 2,-0.3 27,-0.0 -1,-0.3 -0.113 52.6-150.7 -95.3-163.5 14.6 7.4 78.9 39 39 A S > - 0 0 21 -3,-0.1 3,-1.1 22,-0.1 4,-0.4 -0.969 37.1 -87.3-162.0 169.9 14.5 4.2 76.8 40 40 A Q T 3 S+ 0 0 65 -2,-0.3 3,-0.3 1,-0.2 4,-0.2 0.669 115.3 65.9 -59.3 -15.8 13.2 2.7 73.6 41 41 A H T > S+ 0 0 98 1,-0.2 3,-1.3 2,-0.2 4,-0.3 0.754 78.7 74.3 -88.5 -23.2 9.9 1.9 75.4 42 42 A H T < S+ 0 0 66 -3,-1.1 3,-0.4 1,-0.2 4,-0.3 0.873 100.9 46.2 -59.4 -31.3 8.5 5.3 76.1 43 43 A S T 3> S+ 0 0 7 -4,-0.4 4,-2.8 -3,-0.3 3,-0.4 0.517 79.4 98.1 -89.3 -6.0 7.6 5.8 72.3 44 44 A L H <> S+ 0 0 71 -3,-1.3 4,-2.7 1,-0.2 -1,-0.2 0.823 80.2 56.2 -60.7 -31.5 5.9 2.5 71.5 45 45 A V H > S+ 0 0 96 -3,-0.4 4,-1.5 -4,-0.3 -1,-0.2 0.944 116.1 38.1 -66.0 -42.5 2.4 3.8 71.9 46 46 A R H > S+ 0 0 9 -3,-0.4 4,-2.2 -4,-0.3 -2,-0.2 0.858 111.5 56.7 -71.6 -39.2 3.1 6.5 69.3 47 47 A A H X S+ 0 0 10 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.964 108.9 51.0 -56.1 -47.8 5.3 4.2 67.1 48 48 A R H X S+ 0 0 190 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.889 108.1 48.6 -50.6 -50.0 2.2 2.0 66.9 49 49 A E H < S+ 0 0 77 -4,-1.5 4,-0.5 1,-0.2 -1,-0.2 0.845 109.7 54.7 -68.4 -29.6 -0.2 4.7 66.0 50 50 A A H ><>S+ 0 0 0 -4,-2.2 5,-1.2 2,-0.2 3,-0.9 0.840 101.6 55.7 -70.1 -35.5 2.4 5.8 63.3 51 51 A V H ><5S+ 0 0 81 -4,-2.0 3,-2.3 1,-0.3 4,-0.3 0.912 99.8 64.1 -62.3 -38.7 2.3 2.3 61.8 52 52 A G T 3<5S+ 0 0 67 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.752 97.1 54.8 -48.1 -33.3 -1.4 2.9 61.6 53 53 A L T < 5S- 0 0 66 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.491 132.7 -91.8 -81.4 -3.2 -0.7 5.7 59.1 54 54 A G T < 5S+ 0 0 21 -3,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.779 83.2 134.2 94.3 33.7 1.3 3.3 56.9 55 55 A C < - 0 0 4 -5,-1.2 2,-0.4 -4,-0.3 -1,-0.3 -0.720 54.4-131.9-108.8 165.1 4.8 3.8 58.4 56 56 A I E -c 29 0B 32 -28,-2.0 -26,-2.7 -2,-0.3 2,-0.3 -0.939 34.8-163.3-105.9 135.7 7.6 1.7 59.5 57 57 A C E -c 30 0B 31 -2,-0.4 2,-0.3 -28,-0.2 -26,-0.2 -0.850 14.2-168.2-125.5 157.5 8.9 2.7 62.9 58 58 A X E +c 31 0B 42 -28,-2.0 -26,-2.3 -2,-0.3 2,-0.3 -0.988 5.8 177.7-146.8 133.1 11.9 2.2 65.0 59 59 A T + 0 0 23 -2,-0.3 2,-0.3 -28,-0.2 -19,-0.1 -0.886 14.2 174.8-124.1 160.8 12.8 2.9 68.7 60 60 A F - 0 0 32 -28,-0.4 2,-0.7 -2,-0.3 -26,-0.4 -0.988 35.3-100.7-163.7 156.8 16.1 2.1 70.4 61 61 A D - 0 0 43 -2,-0.3 4,-0.1 -22,-0.1 -22,-0.1 -0.786 35.9-135.7 -88.2 111.4 18.1 2.5 73.6 62 62 A L > - 0 0 0 -2,-0.7 3,-1.1 -27,-0.1 6,-0.3 -0.355 36.5 -93.6 -54.6 144.5 20.7 5.2 73.4 63 63 A R T 3 S+ 0 0 63 1,-0.2 6,-0.1 16,-0.1 3,-0.1 -0.298 115.4 47.4 -60.3 150.4 24.1 4.1 74.9 64 64 A G T 3 S+ 0 0 0 4,-1.1 2,-0.3 1,-0.3 -1,-0.2 0.377 106.1 84.8 90.4 -1.1 24.5 5.1 78.6 65 65 A H S X S- 0 0 2 -3,-1.1 3,-2.4 -4,-0.1 -1,-0.3 -0.957 94.8 -27.4-132.8 147.8 21.0 3.6 79.0 66 66 A E G > S+ 0 0 101 -2,-0.3 3,-2.4 1,-0.3 4,-0.3 -0.266 135.1 19.9 60.6-115.5 19.5 0.1 79.6 67 67 A G G 3 S+ 0 0 72 1,-0.3 -1,-0.3 -2,-0.2 3,-0.1 0.625 141.4 37.0 -62.1 -16.3 21.8 -2.6 78.1 68 68 A Y G X S+ 0 0 125 -3,-2.4 3,-1.8 -6,-0.3 -4,-1.1 -0.208 73.5 127.6-125.4 39.4 24.5 0.1 78.3 69 69 A A G X + 0 0 51 -3,-2.4 3,-2.1 1,-0.3 4,-0.2 0.821 66.0 75.6 -57.8 -30.4 23.4 1.7 81.6 70 70 A S G 3 S+ 0 0 106 -4,-0.3 3,-0.4 1,-0.3 -1,-0.3 0.741 90.7 52.3 -52.4 -26.9 27.1 1.0 82.4 71 71 A X G X> S+ 0 0 61 -3,-1.8 4,-3.1 1,-0.2 3,-1.4 0.353 72.9 112.3 -95.4 8.0 28.1 4.0 80.2 72 72 A R T <4 S+ 0 0 77 -3,-2.1 72,-0.3 1,-0.3 -1,-0.2 0.821 83.8 38.8 -48.3 -38.9 25.7 6.6 81.8 73 73 A Q T 34 S+ 0 0 132 -3,-0.4 -1,-0.3 -4,-0.2 72,-0.2 0.574 124.6 35.6 -95.1 -10.6 28.6 8.5 83.3 74 74 A S T <4 S+ 0 0 63 -3,-1.4 -2,-0.2 68,-0.1 -1,-0.1 0.710 80.1 116.4-111.1 -31.2 31.1 8.3 80.4 75 75 A V < - 0 0 0 -4,-3.1 68,-2.9 67,-0.2 69,-0.4 -0.117 50.4-151.2 -57.1 135.5 29.0 8.5 77.2 76 76 A T B > -G 142 0C 17 66,-0.3 4,-2.0 67,-0.1 5,-0.2 -0.589 27.4-113.2-100.0 160.7 29.7 11.6 75.0 77 77 A R H > S+ 0 0 0 62,-0.9 4,-2.9 64,-0.7 5,-0.2 0.856 118.6 64.0 -60.7 -34.3 27.4 13.4 72.6 78 78 A A H > S+ 0 0 16 61,-0.8 4,-2.2 1,-0.2 -1,-0.2 0.958 105.9 42.2 -49.4 -54.5 29.7 12.1 69.9 79 79 A Q H > S+ 0 0 58 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.867 113.4 50.3 -66.9 -39.7 28.8 8.6 70.8 80 80 A N H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.887 109.8 51.6 -68.5 -34.4 25.1 9.2 71.1 81 81 A L H X S+ 0 0 7 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.909 107.1 53.7 -64.7 -40.8 25.1 11.0 67.8 82 82 A D H X S+ 0 0 88 -4,-2.2 4,-1.9 -5,-0.2 -2,-0.2 0.869 107.2 53.1 -57.6 -38.0 26.8 7.9 66.3 83 83 A D H X S+ 0 0 21 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.885 108.9 47.5 -61.0 -45.0 23.9 5.8 67.8 84 84 A I H X S+ 0 0 0 -4,-1.8 4,-3.1 1,-0.2 -2,-0.2 0.918 111.6 50.5 -68.4 -42.3 21.3 8.0 66.1 85 85 A K H X S+ 0 0 33 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.871 110.9 50.5 -56.5 -42.4 23.2 7.8 62.8 86 86 A A H X S+ 0 0 56 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.932 112.6 44.5 -66.1 -47.4 23.3 3.9 63.2 87 87 A A H X S+ 0 0 10 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.970 113.5 51.7 -59.7 -53.1 19.6 3.6 63.9 88 88 A Y H X S+ 0 0 7 -4,-3.1 4,-3.3 1,-0.2 3,-0.4 0.945 110.1 48.6 -47.8 -56.2 18.9 6.0 61.0 89 89 A D H X S+ 0 0 66 -4,-2.8 4,-2.3 1,-0.3 -1,-0.2 0.887 111.0 49.8 -56.1 -41.2 21.0 4.0 58.6 90 90 A Q H < S+ 0 0 132 -4,-2.3 -1,-0.3 2,-0.2 4,-0.2 0.871 114.8 44.0 -66.7 -34.3 19.4 0.7 59.6 91 91 A L H >< S+ 0 0 0 -4,-2.5 3,-1.3 -3,-0.4 -2,-0.2 0.940 115.0 47.7 -73.6 -47.8 15.9 2.2 59.1 92 92 A A H 3< S+ 0 0 15 -4,-3.3 7,-0.3 1,-0.3 -2,-0.2 0.903 106.6 58.6 -60.0 -41.6 16.7 3.9 55.8 93 93 A S T 3< S+ 0 0 93 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.492 76.8 113.9 -71.3 -5.8 18.4 0.8 54.3 94 94 A L S X S- 0 0 41 -3,-1.3 3,-1.6 -4,-0.2 5,-0.1 -0.561 70.5-132.2 -66.8 134.6 15.2 -1.4 54.7 95 95 A P T 3 S+ 0 0 106 0, 0.0 -69,-0.5 0, 0.0 -1,-0.1 0.794 104.5 49.6 -57.2 -37.5 13.9 -2.4 51.3 96 96 A Y T 3 S+ 0 0 98 -71,-0.2 -69,-3.4 -70,-0.1 2,-0.4 0.490 99.1 82.9 -83.8 -3.6 10.2 -1.4 52.1 97 97 A V E < S-b 27 0B 10 -3,-1.6 2,-0.9 -71,-0.3 -71,-0.1 -0.843 76.3-133.8-102.7 139.1 11.2 2.0 53.4 98 98 A D E > - 0 0 50 -71,-2.6 3,-2.7 -2,-0.4 -69,-0.4 -0.815 10.4-156.5 -90.5 104.0 11.8 5.1 51.2 99 99 A A E 3 S+ 0 0 40 -2,-0.9 3,-0.4 -7,-0.3 -1,-0.2 0.755 92.2 65.9 -52.2 -25.0 15.0 6.6 52.5 100 100 A H E 3 S+ 0 0 144 1,-0.2 -1,-0.3 -8,-0.1 23,-0.0 0.390 101.0 53.1 -78.5 6.4 13.8 9.9 50.9 101 101 A S E < + 0 0 17 -3,-2.7 -72,-1.9 -74,-0.2 2,-0.5 -0.437 69.2 142.7-142.2 67.5 11.0 9.9 53.5 102 102 A I E -b 29 0B 1 -3,-0.4 22,-1.3 -74,-0.2 23,-1.2 -0.934 30.5-158.9-111.1 127.4 12.3 9.6 57.1 103 103 A A E -bd 30 125B 2 -74,-2.6 -72,-3.0 -2,-0.5 2,-0.5 -0.838 5.9-155.9 -93.8 136.7 10.7 11.4 60.0 104 104 A V E -bd 31 126B 0 21,-2.0 23,-2.9 -2,-0.4 2,-0.5 -0.980 6.0-168.7-113.0 131.6 12.9 11.9 63.1 105 105 A V E -bd 32 127B 5 -74,-3.4 -72,-2.2 -2,-0.5 2,-0.3 -0.915 15.5-179.1-121.5 98.8 11.0 12.4 66.5 106 106 A G E -bd 33 128B 1 21,-2.2 23,-2.9 -2,-0.5 2,-0.4 -0.828 17.3-151.7-112.3 143.3 13.3 13.5 69.3 107 107 A L E > - d 0 129B 22 -74,-1.8 3,-2.0 -2,-0.3 23,-0.2 -0.933 55.4 -56.6-114.9 129.1 12.8 14.3 73.0 108 108 A S T 3> S+ 0 0 14 21,-2.3 4,-2.1 -2,-0.4 24,-1.3 -0.190 135.4 12.8 41.7-115.0 15.0 16.7 75.1 109 109 A Y H 3> S+ 0 0 0 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.913 134.8 51.4 -48.2 -48.4 18.6 15.4 74.8 110 110 A G H <> S+ 0 0 0 -3,-2.0 4,-2.0 1,-0.2 -2,-0.3 0.861 107.5 53.5 -57.4 -38.1 17.4 13.2 71.9 111 111 A G H > S+ 0 0 0 -3,-0.4 4,-2.4 18,-0.2 -2,-0.2 0.885 107.2 50.4 -64.8 -41.7 15.8 16.3 70.3 112 112 A Y H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.947 113.4 44.8 -58.1 -52.6 19.1 18.3 70.4 113 113 A L H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.828 110.8 54.7 -65.0 -33.7 21.0 15.4 68.8 114 114 A S H X S+ 0 0 0 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.917 104.0 54.4 -65.4 -45.3 18.2 14.9 66.3 115 115 A A H >< S+ 0 0 1 -4,-2.4 3,-0.8 1,-0.2 4,-0.4 0.963 112.3 45.0 -47.4 -53.6 18.5 18.6 65.3 116 116 A L H >< S+ 0 0 19 -4,-2.1 3,-2.0 1,-0.2 4,-0.3 0.914 102.7 65.8 -58.3 -46.0 22.2 17.9 64.7 117 117 A L H >X S+ 0 0 1 -4,-2.9 3,-2.3 1,-0.3 4,-1.3 0.813 90.2 65.9 -42.1 -42.0 21.4 14.6 62.8 118 118 A T T << S+ 0 0 22 -4,-1.5 -1,-0.3 -3,-0.8 5,-0.2 0.757 92.4 59.9 -61.9 -27.9 19.7 16.6 60.1 119 119 A R T <4 S+ 0 0 62 -3,-2.0 -1,-0.3 -4,-0.4 -2,-0.2 0.522 117.9 32.1 -72.8 -8.7 23.1 18.3 59.0 120 120 A E T <4 S+ 0 0 99 -3,-2.3 -2,-0.2 -4,-0.3 -1,-0.2 0.465 123.1 33.6-128.2 -9.7 24.5 14.7 58.3 121 121 A R S < S- 0 0 67 -4,-1.3 2,-0.5 2,-0.0 -1,-0.3 -0.991 87.1 -96.8-144.3 152.0 21.5 12.7 57.1 122 122 A P + 0 0 84 0, 0.0 2,-0.5 0, 0.0 -20,-0.2 -0.563 40.2 177.5 -72.7 118.7 18.3 13.4 55.1 123 123 A V - 0 0 10 -2,-0.5 53,-0.2 -5,-0.2 -20,-0.2 -0.945 12.5-172.8-124.3 106.3 15.3 14.0 57.4 124 124 A E S S+ 0 0 45 -22,-1.3 53,-1.7 -2,-0.5 2,-0.4 0.865 79.0 21.0 -64.1 -41.5 12.1 14.9 55.5 125 125 A W E -de 103 177B 3 -23,-1.2 -21,-2.0 51,-0.2 2,-0.4 -0.989 68.8-165.8-134.0 136.5 10.2 15.7 58.6 126 126 A L E -de 104 178B 0 51,-2.5 53,-2.2 -2,-0.4 2,-0.5 -0.993 3.1-173.8-130.1 120.9 11.6 16.6 62.0 127 127 A A E -de 105 179B 2 -23,-2.9 -21,-2.2 -2,-0.4 2,-0.5 -0.983 6.9-171.7-119.5 118.4 9.5 16.7 65.2 128 128 A L E -de 106 180B 1 51,-2.8 53,-2.1 -2,-0.5 2,-0.7 -0.959 7.9-163.4-116.4 121.8 11.2 18.0 68.4 129 129 A R E S-de 107 181B 7 -23,-2.9 -21,-2.3 -2,-0.5 -18,-0.2 -0.895 75.0 -32.3-106.1 112.8 9.6 17.7 71.8 130 130 A S S S- 0 0 1 51,-2.3 -1,-0.2 -2,-0.7 -19,-0.1 0.920 82.7-155.5 48.4 53.1 11.2 20.0 74.4 131 131 A P - 0 0 0 0, 0.0 -22,-0.2 0, 0.0 -1,-0.2 -0.367 8.2-125.4 -65.2 137.6 14.6 19.8 72.8 132 132 A A - 0 0 0 -24,-1.3 2,-0.3 -2,-0.1 57,-0.1 -0.243 15.5-149.0 -73.2 159.4 17.6 20.4 75.1 133 133 A L + 0 0 0 19,-0.1 2,-0.3 34,-0.0 23,-0.1 -0.986 17.8 174.2-129.2 141.3 20.3 23.0 74.5 134 134 A Y - 0 0 5 -2,-0.3 33,-0.2 21,-0.1 2,-0.2 -0.915 40.5 -91.0-136.3 158.6 24.0 22.6 75.7 135 135 A K - 0 0 60 -2,-0.3 30,-0.1 1,-0.1 17,-0.0 -0.513 30.3-127.2 -73.3 142.4 27.1 24.7 75.0 136 136 A D S S+ 0 0 54 28,-0.4 3,-0.4 -2,-0.2 -1,-0.1 0.795 81.6 105.6 -54.5 -30.6 29.1 23.7 71.9 137 137 A A S S+ 0 0 59 1,-0.2 -2,-0.1 2,-0.1 0, 0.0 -0.169 77.9 19.7 -52.7 142.2 32.2 23.6 74.2 138 138 A H > + 0 0 135 2,-0.1 3,-1.8 1,-0.1 -1,-0.2 0.860 63.3 171.5 68.4 47.9 33.5 20.1 75.2 139 139 A W T 3 S+ 0 0 71 -3,-0.4 -62,-0.9 1,-0.3 -61,-0.8 0.885 79.2 47.8 -50.9 -45.9 31.9 17.8 72.5 140 140 A D T 3 S+ 0 0 113 -64,-0.1 -1,-0.3 -63,-0.1 -2,-0.1 0.220 91.0 104.3 -90.3 11.2 34.0 14.7 73.7 141 141 A Q S < S- 0 0 88 -3,-1.8 -64,-0.7 1,-0.1 -63,-0.2 -0.626 88.5 -84.3 -83.5 152.3 33.2 15.1 77.4 142 142 A P B >> -G 76 0C 35 0, 0.0 3,-0.9 0, 0.0 4,-0.6 -0.318 36.0-129.2 -46.3 128.9 30.7 12.9 79.2 143 143 A K H >> S+ 0 0 7 -68,-2.9 3,-1.2 1,-0.3 4,-0.9 0.834 108.0 63.0 -61.0 -30.7 27.2 14.3 78.6 144 144 A V H 3> S+ 0 0 35 -69,-0.4 4,-1.0 -72,-0.3 3,-0.5 0.873 93.5 64.0 -60.9 -33.6 26.6 14.3 82.4 145 145 A S H <> S+ 0 0 43 -3,-0.9 4,-1.3 1,-0.2 -1,-0.3 0.812 93.0 63.0 -57.6 -29.0 29.4 16.8 82.7 146 146 A L H << S+ 0 0 16 -3,-1.2 3,-0.3 -4,-0.6 -1,-0.2 0.926 105.8 43.0 -64.2 -44.0 27.3 19.2 80.7 147 147 A N H < S+ 0 0 71 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.603 101.3 71.0 -76.4 -15.0 24.6 19.3 83.5 148 148 A A H < S+ 0 0 77 -4,-1.0 -1,-0.2 -3,-0.1 -2,-0.2 0.946 79.0 88.0 -60.9 -46.6 27.4 19.5 86.1 149 149 A D S >< S- 0 0 56 -4,-1.3 3,-1.8 -3,-0.3 4,-0.2 -0.353 70.9-156.4 -55.8 110.7 28.0 23.1 84.9 150 150 A P T > S+ 0 0 101 0, 0.0 3,-1.5 0, 0.0 4,-0.4 0.808 87.3 72.4 -65.1 -27.2 25.6 25.2 87.1 151 151 A D T 3> S+ 0 0 58 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.579 71.9 88.3 -61.8 -12.4 25.6 27.9 84.4 152 152 A L H <> S+ 0 0 10 -3,-1.8 4,-1.8 1,-0.2 -1,-0.3 0.837 82.0 58.7 -53.4 -35.7 23.5 25.5 82.2 153 153 A X H <4 S+ 0 0 119 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.935 107.6 44.5 -60.0 -50.4 20.3 27.0 83.8 154 154 A D H >> S+ 0 0 84 -4,-0.4 3,-1.9 1,-0.2 4,-0.6 0.904 108.7 57.2 -61.8 -41.7 21.2 30.5 82.7 155 155 A Y H >< S+ 0 0 11 -4,-2.0 3,-0.7 1,-0.3 -1,-0.2 0.844 106.1 49.9 -60.2 -39.5 22.1 29.3 79.2 156 156 A R T 3< S+ 0 0 13 -4,-1.8 37,-0.4 1,-0.2 -1,-0.3 0.329 110.5 51.1 -80.6 0.7 18.7 27.8 78.6 157 157 A R T <4 S+ 0 0 112 -3,-1.9 -2,-0.2 35,-0.1 -1,-0.2 0.383 97.7 90.2-114.5 0.1 17.1 31.1 79.8 158 158 A R S << S- 0 0 115 -3,-0.7 2,-0.3 -4,-0.6 38,-0.2 -0.524 82.4-109.5 -89.3 157.1 19.2 33.2 77.4 159 159 A A - 0 0 87 -2,-0.2 2,-0.4 36,-0.1 -2,-0.1 -0.690 41.0-174.0 -80.5 138.1 18.5 34.3 73.8 160 160 A L - 0 0 12 -2,-0.3 40,-0.1 32,-0.2 5,-0.0 -0.986 15.3-149.3-144.3 127.4 20.8 32.5 71.3 161 161 A A > - 0 0 49 -2,-0.4 3,-2.2 1,-0.1 4,-0.4 -0.521 38.4-102.3 -86.8 161.0 21.3 32.9 67.6 162 162 A P G > S+ 0 0 45 0, 0.0 3,-1.1 0, 0.0 7,-0.5 0.818 122.5 62.7 -45.8 -36.9 22.3 30.1 65.2 163 163 A G G 3 S+ 0 0 74 1,-0.2 3,-0.1 5,-0.1 6,-0.0 0.699 100.0 52.3 -63.9 -22.2 25.8 31.5 65.3 164 164 A D G < S+ 0 0 88 -3,-2.2 -28,-0.4 1,-0.2 2,-0.3 0.513 113.6 38.8 -92.5 -5.9 26.1 30.9 69.1 165 165 A N <> - 0 0 3 -3,-1.1 4,-2.2 -4,-0.4 -1,-0.2 -0.954 63.5-141.5-158.3 125.7 25.1 27.2 69.0 166 166 A L H > S+ 0 0 92 -2,-0.3 4,-1.8 2,-0.2 -1,-0.1 0.805 105.4 48.6 -59.8 -35.5 25.8 24.2 66.7 167 167 A A H > S+ 0 0 0 -33,-0.2 4,-1.6 2,-0.2 3,-0.3 0.977 111.6 48.4 -69.0 -53.1 22.2 22.7 67.1 168 168 A L H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.819 110.0 54.7 -54.4 -35.2 20.6 26.1 66.4 169 169 A A H X S+ 0 0 37 -4,-2.2 4,-1.6 -7,-0.5 -1,-0.2 0.905 103.0 55.4 -61.9 -45.9 22.9 26.4 63.3 170 170 A A H X S+ 0 0 6 -4,-1.8 4,-1.1 -3,-0.3 -2,-0.2 0.843 107.2 50.7 -57.0 -35.9 21.7 23.0 62.1 171 171 A C H < S+ 0 0 0 -4,-1.6 32,-0.4 2,-0.2 -1,-0.2 0.900 102.9 57.6 -69.7 -42.7 18.1 24.3 62.2 172 172 A A H < S+ 0 0 27 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.855 112.6 42.8 -55.0 -36.0 19.0 27.4 60.2 173 173 A Q H < S+ 0 0 133 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.735 91.7 111.3 -79.2 -22.8 20.3 25.0 57.5 174 174 A Y < + 0 0 14 -4,-1.1 29,-0.3 -3,-0.2 4,-0.1 -0.281 37.1 174.8 -64.0 132.6 17.2 22.7 57.9 175 175 A K + 0 0 138 29,-0.1 30,-1.3 -52,-0.1 -1,-0.1 0.500 47.8 90.0-115.7 -11.2 14.8 22.7 54.9 176 176 A G S S- 0 0 6 -53,-0.2 29,-1.7 28,-0.2 30,-0.8 0.219 89.5 -74.0 -68.0-163.9 12.2 19.9 55.8 177 177 A D E -ef 125 206B 15 -53,-1.7 -51,-2.5 28,-0.2 2,-0.4 -0.819 50.0-151.4 -95.9 146.8 9.0 20.4 57.8 178 178 A V E -ef 126 207B 0 28,-2.0 30,-3.3 -2,-0.3 2,-0.5 -0.953 15.5-167.4-127.4 132.9 9.2 21.0 61.5 179 179 A L E -ef 127 208B 4 -53,-2.2 -51,-2.8 -2,-0.4 2,-0.5 -0.985 9.3-169.6-114.6 126.4 7.0 20.2 64.6 180 180 A L E -ef 128 209B 9 28,-2.3 30,-1.7 -2,-0.5 2,-0.5 -0.962 3.6-175.2-118.5 114.8 7.9 21.9 67.9 181 181 A V E -ef 129 210B 2 -53,-2.1 -51,-2.3 -2,-0.5 2,-0.3 -0.951 6.6-176.6-109.3 126.4 6.0 20.7 71.0 182 182 A E E - f 0 211B 26 28,-1.7 30,-3.9 -2,-0.5 2,-0.6 -0.909 27.0-128.5-121.7 154.5 6.5 22.4 74.4 183 183 A A E > - f 0 212B 3 -2,-0.3 3,-1.9 6,-0.3 30,-0.1 -0.895 23.4-137.9 -97.8 120.1 5.3 21.8 78.0 184 184 A E T 3 S+ 0 0 110 28,-2.6 7,-0.2 -2,-0.6 -1,-0.1 0.834 99.1 34.0 -51.0 -42.3 3.9 25.1 79.3 185 185 A N T 3 S+ 0 0 102 30,-2.5 -1,-0.3 27,-0.2 32,-0.2 -0.019 80.9 147.0-108.2 29.2 5.5 24.8 82.8 186 186 A D < - 0 0 10 -3,-1.9 5,-0.3 30,-0.2 30,-0.1 -0.461 22.9-180.0 -62.0 127.1 8.7 23.0 81.9 187 187 A V S S+ 0 0 111 -2,-0.2 -1,-0.1 3,-0.1 29,-0.0 0.386 80.4 54.5-107.1 -4.1 11.6 24.0 84.2 188 188 A I S S+ 0 0 87 1,-0.3 -32,-0.1 -56,-0.0 -2,-0.0 0.856 127.8 14.6 -92.1 -51.1 14.2 21.7 82.5 189 189 A V S S- 0 0 2 -57,-0.1 -6,-0.3 -6,-0.1 -1,-0.3 -0.859 93.8-172.7-121.2 90.0 13.7 23.0 78.9 190 190 A P >> - 0 0 13 0, 0.0 3,-1.8 0, 0.0 4,-1.0 -0.270 39.8 -82.4 -85.5 175.4 11.8 26.2 79.5 191 191 A H H 3> S+ 0 0 70 -5,-0.3 4,-2.8 1,-0.3 3,-0.3 0.817 120.4 64.2 -46.1 -44.8 10.2 28.6 76.9 192 192 A P H 3> S+ 0 0 41 0, 0.0 4,-2.2 0, 0.0 -1,-0.3 0.813 99.5 53.3 -58.4 -28.2 13.4 30.5 76.0 193 193 A V H <> S+ 0 0 0 -3,-1.8 4,-2.2 -37,-0.4 -2,-0.2 0.955 112.1 46.2 -63.4 -46.1 15.0 27.3 74.6 194 194 A X H X S+ 0 0 9 -4,-1.0 4,-2.8 -3,-0.3 5,-0.3 0.895 108.5 54.2 -59.9 -47.0 11.9 26.9 72.4 195 195 A R H X S+ 0 0 151 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.937 109.7 49.4 -55.0 -45.9 11.9 30.6 71.4 196 196 A N H X S+ 0 0 8 -4,-2.2 4,-1.9 -5,-0.2 -2,-0.2 0.875 113.4 46.0 -60.6 -44.2 15.6 30.0 70.2 197 197 A Y H X S+ 0 0 0 -4,-2.2 4,-1.1 2,-0.2 3,-0.3 0.982 112.9 47.9 -61.4 -62.3 14.7 26.9 68.2 198 198 A A H >< S+ 0 0 33 -4,-2.8 3,-1.2 1,-0.2 -2,-0.2 0.927 113.5 49.1 -41.3 -57.0 11.6 28.4 66.6 199 199 A D H >< S+ 0 0 108 -4,-2.7 3,-0.6 -5,-0.3 -1,-0.2 0.882 108.8 53.2 -53.3 -42.9 13.6 31.6 65.6 200 200 A A H 3< S+ 0 0 2 -4,-1.9 -1,-0.2 -3,-0.3 -2,-0.2 0.637 93.1 73.6 -71.4 -15.6 16.5 29.5 64.2 201 201 A F T X< + 0 0 4 -3,-1.2 3,-1.8 -4,-1.1 2,-0.4 0.053 52.0 132.9 -90.7 29.9 14.3 27.4 61.8 202 202 A T T < + 0 0 116 -3,-0.6 -1,-0.2 1,-0.3 -30,-0.1 0.215 67.9 54.5 -77.1 24.3 13.6 30.2 59.3 203 203 A N T 3 S+ 0 0 91 -2,-0.4 -1,-0.3 -32,-0.4 2,-0.1 0.278 78.4 116.3-126.4 4.2 14.4 27.9 56.2 204 204 A A S < S- 0 0 22 -3,-1.8 -28,-0.2 1,-0.1 -27,-0.2 -0.489 75.1-120.3 -77.1 147.4 12.0 25.0 56.9 205 205 A R S S- 0 0 128 -29,-1.7 2,-0.3 -30,-1.3 -28,-0.2 0.831 95.5 -11.7 -47.9 -33.9 9.1 24.2 54.5 206 206 A S E -f 177 0B 37 -30,-0.8 -28,-2.0 -5,-0.1 2,-0.4 -0.981 57.6-145.6-166.6 159.5 6.9 24.7 57.5 207 207 A L E -f 178 0B 75 -2,-0.3 2,-0.3 -30,-0.2 -28,-0.2 -0.933 16.2-176.9-139.4 105.8 7.0 25.2 61.2 208 208 A T E -f 179 0B 56 -30,-3.3 -28,-2.3 -2,-0.4 2,-0.3 -0.815 7.1-171.2 -99.9 150.5 4.1 23.9 63.3 209 209 A S E -f 180 0B 75 -2,-0.3 2,-0.3 -30,-0.2 -28,-0.2 -0.878 9.3-177.3-150.2 110.7 4.2 24.5 67.0 210 210 A R E -f 181 0B 33 -30,-1.7 -28,-1.7 -2,-0.3 2,-0.4 -0.803 9.8-159.6-103.0 142.6 2.0 23.2 69.8 211 211 A V E -f 182 0B 72 -2,-0.3 2,-0.7 -30,-0.2 -28,-0.2 -0.998 17.9-136.5-112.6 130.2 2.3 24.2 73.5 212 212 A I E > -f 183 0B 3 -30,-3.9 -28,-2.6 -2,-0.4 3,-1.4 -0.786 29.0-118.7 -88.1 119.2 0.7 21.7 75.9 213 213 A A T 3 S- 0 0 56 -2,-0.7 -1,-0.0 1,-0.3 -30,-0.0 -0.293 84.3 -11.6 -64.4 131.0 -1.2 23.8 78.4 214 214 A G T 3 S+ 0 0 35 1,-0.2 -1,-0.3 -31,-0.0 -31,-0.1 0.463 96.7 143.6 63.2 4.5 0.1 23.4 82.0 215 215 A A < - 0 0 0 -3,-1.4 -30,-2.5 -33,-0.2 2,-0.2 -0.237 39.9-140.0 -73.5 162.1 2.3 20.4 81.3 216 216 A D > - 0 0 60 -32,-0.1 3,-2.3 -31,-0.1 -30,-0.2 -0.668 38.8 -89.0-110.4 171.5 5.8 19.7 82.8 217 217 A H T 3 S+ 0 0 28 1,-0.3 -31,-0.1 -2,-0.2 -109,-0.0 0.840 128.5 48.3 -53.0 -36.6 8.9 18.2 81.1 218 218 A A T 3 S- 0 0 65 1,-0.0 -1,-0.3 -35,-0.0 -3,-0.0 0.551 101.3-132.0 -78.1 -3.3 7.8 14.6 81.8 219 219 A L < + 0 0 2 -3,-2.3 6,-0.4 1,-0.1 -2,-0.1 0.936 42.2 173.9 41.6 51.6 4.2 15.3 80.5 220 220 A S + 0 0 80 4,-0.1 2,-0.3 5,-0.1 -1,-0.1 0.698 46.6 83.7 -67.2 -21.0 3.4 13.5 83.8 221 221 A V S >> S- 0 0 60 1,-0.1 4,-2.3 -5,-0.1 3,-0.7 -0.694 81.8-132.4 -80.6 137.8 -0.3 14.1 83.6 222 222 A K H 3> S+ 0 0 145 -2,-0.3 4,-1.7 1,-0.2 5,-0.2 0.908 104.1 54.9 -53.5 -47.5 -2.0 11.5 81.4 223 223 A E H 3> S+ 0 0 112 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.792 109.8 46.4 -61.4 -32.6 -4.0 14.0 79.4 224 224 A H H <> S+ 0 0 30 -3,-0.7 4,-2.4 2,-0.2 -1,-0.2 0.893 106.4 57.3 -75.0 -44.9 -0.9 15.9 78.4 225 225 A Q H X S+ 0 0 56 -4,-2.3 4,-1.3 -6,-0.4 -2,-0.2 0.865 113.4 42.5 -50.7 -35.4 0.9 12.7 77.5 226 226 A Q H X S+ 0 0 95 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.757 104.6 61.2 -86.5 -31.7 -2.1 12.2 75.1 227 227 A E H X S+ 0 0 91 -4,-1.6 4,-3.2 2,-0.2 -2,-0.2 0.941 108.1 48.0 -54.3 -45.9 -2.3 15.8 73.8 228 228 A Y H X S+ 0 0 8 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.937 109.0 51.0 -65.3 -45.4 1.2 15.2 72.6 229 229 A T H X S+ 0 0 15 -4,-1.3 4,-2.7 -5,-0.2 5,-0.2 0.955 114.1 45.3 -53.9 -48.2 0.4 11.8 71.0 230 230 A R H X S+ 0 0 85 -4,-2.7 4,-2.8 1,-0.2 5,-0.3 0.941 113.0 51.1 -63.3 -44.7 -2.5 13.5 69.2 231 231 A A H X S+ 0 0 25 -4,-3.2 4,-1.8 1,-0.2 -1,-0.2 0.904 113.8 43.7 -56.3 -45.9 -0.3 16.5 68.2 232 232 A L H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 -1,-0.2 0.932 116.0 46.3 -67.6 -47.3 2.4 14.3 66.7 233 233 A I H X S+ 0 0 10 -4,-2.7 4,-2.6 -5,-0.3 -2,-0.2 0.855 110.3 52.2 -68.6 -37.2 0.0 11.9 64.9 234 234 A D H X S+ 0 0 96 -4,-2.8 4,-3.0 -5,-0.2 -1,-0.2 0.928 112.8 47.3 -59.3 -45.1 -2.1 14.7 63.4 235 235 A W H X S+ 0 0 6 -4,-1.8 4,-3.5 -5,-0.3 5,-0.2 0.952 112.7 46.6 -64.0 -50.0 1.1 16.3 62.1 236 236 A L H X>S+ 0 0 0 -4,-2.8 4,-3.9 2,-0.2 5,-0.5 0.917 111.6 53.2 -58.8 -44.8 2.5 13.0 60.7 237 237 A T H X5S+ 0 0 47 -4,-2.6 4,-3.1 1,-0.2 5,-0.4 0.968 113.7 42.3 -52.1 -57.3 -0.9 12.3 59.1 238 238 A E H X5S+ 0 0 124 -4,-3.0 4,-1.5 1,-0.2 -2,-0.2 0.894 120.2 43.5 -57.0 -43.6 -0.8 15.8 57.5 239 239 A X H <5S+ 0 0 25 -4,-3.5 4,-0.2 -5,-0.2 -2,-0.2 0.931 124.5 32.3 -65.3 -47.2 2.9 15.4 56.5 240 240 A V H ><5S+ 0 0 18 -4,-3.9 3,-1.0 -5,-0.2 -3,-0.2 0.814 114.3 58.5 -90.6 -33.1 2.8 11.9 55.3 241 241 A V H 3<