==== 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 27-AUG-08 2ZRI . COMPND 2 MOLECULE: PROTEIN RECA; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM SMEGMATIS STR. MC2 155; . AUTHOR J.R.PRABU,G.P.MANJUNATH,N.R.CHANDRA,K.MUNIYAPPA,M.VIJAYAN . 317 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16243.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 228 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 9.8 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 1 0.3 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 . 27 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 31.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 1 0 1 2 0 0 2 1 1 0 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 0 PARALLEL BRIDGES PER LADDER . 1 3 0 0 0 0 1 0 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 . 1 1 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 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 5 A A 0 0 149 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 33.2 -29.2 43.7 29.4 2 6 A P + 0 0 129 0, 0.0 2,-0.4 0, 0.0 0, 0.0 -0.749 360.0 160.0 -93.4 113.9 -28.6 41.7 26.2 3 7 A D >> - 0 0 99 -2,-0.7 4,-3.1 1,-0.2 3,-1.2 -0.858 20.2-164.8-128.9 95.7 -27.1 43.6 23.2 4 8 A R H 3> S+ 0 0 217 -2,-0.4 4,-3.9 1,-0.3 5,-0.3 0.918 85.9 49.1 -42.6 -69.0 -25.6 41.2 20.8 5 9 A E H 3> S+ 0 0 104 1,-0.3 4,-0.9 2,-0.2 -1,-0.3 0.698 118.0 42.0 -50.7 -23.0 -23.5 43.6 18.7 6 10 A K H <> S+ 0 0 54 -3,-1.2 4,-1.6 2,-0.2 -1,-0.3 0.816 118.8 45.0 -91.0 -34.1 -22.0 45.1 21.9 7 11 A A H X S+ 0 0 61 -4,-3.1 4,-1.2 -3,-0.3 -2,-0.2 0.763 112.3 53.1 -77.0 -27.1 -21.6 41.7 23.5 8 12 A L H X S+ 0 0 80 -4,-3.9 4,-3.5 -5,-0.3 -3,-0.2 0.906 107.9 49.0 -74.0 -44.4 -20.1 40.3 20.3 9 13 A E H X S+ 0 0 81 -4,-0.9 4,-3.4 -5,-0.3 5,-0.3 0.945 108.7 52.3 -59.9 -52.2 -17.5 43.0 20.0 10 14 A L H X S+ 0 0 126 -4,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.901 114.5 44.8 -52.3 -42.3 -16.3 42.7 23.6 11 15 A A H X S+ 0 0 40 -4,-1.2 4,-3.3 2,-0.2 -2,-0.2 0.981 112.4 49.3 -65.7 -57.7 -16.0 38.9 23.0 12 16 A M H X S+ 0 0 24 -4,-3.5 4,-2.9 1,-0.2 5,-0.2 0.912 110.9 51.5 -46.7 -51.3 -14.3 39.3 19.6 13 17 A A H X S+ 0 0 59 -4,-3.4 4,-2.7 2,-0.2 -1,-0.2 0.922 111.0 47.2 -52.2 -51.0 -11.8 41.8 21.1 14 18 A Q H X S+ 0 0 90 -4,-2.1 4,-2.8 -5,-0.3 5,-0.3 0.961 110.7 53.1 -56.1 -52.1 -11.0 39.4 24.0 15 19 A I H X S+ 0 0 64 -4,-3.3 4,-1.7 1,-0.3 -2,-0.2 0.894 112.0 44.7 -50.0 -47.2 -10.6 36.6 21.4 16 20 A D H X S+ 0 0 45 -4,-2.9 4,-2.8 -5,-0.2 -1,-0.3 0.874 112.5 52.2 -67.4 -37.0 -8.1 38.7 19.4 17 21 A K H < S+ 0 0 166 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.868 111.9 45.3 -67.7 -36.7 -6.3 39.7 22.6 18 22 A N H < S+ 0 0 93 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.814 132.7 17.5 -76.9 -29.3 -5.9 36.2 23.8 19 23 A F H < S- 0 0 154 -4,-1.7 -2,-0.2 -5,-0.3 -3,-0.2 0.428 115.1 -92.5-123.9 -2.7 -4.7 34.8 20.5 20 24 A G >< - 0 0 32 -4,-2.8 3,-2.1 -5,-0.2 -3,-0.1 0.124 55.0 -47.8 102.8 143.8 -3.7 37.7 18.3 21 25 A K T 3 S+ 0 0 93 1,-0.3 -8,-0.0 2,-0.1 -4,-0.0 -0.188 126.0 30.3 -47.0 121.4 -5.1 40.1 15.8 22 26 A G T 3 S+ 0 0 14 2,-0.3 -1,-0.3 219,-0.1 3,-0.1 0.336 73.1 127.3 107.1 -4.1 -7.0 38.1 13.2 23 27 A S S < S- 0 0 38 -3,-2.1 2,-0.3 1,-0.2 -2,-0.1 0.915 89.7 -1.4 -49.5 -42.9 -8.0 35.2 15.5 24 28 A V S S+ 0 0 53 -12,-0.1 -2,-0.3 216,-0.1 2,-0.3 -0.996 74.9 167.1-147.4 147.1 -11.5 35.9 14.2 25 29 A M - 0 0 48 -2,-0.3 4,-0.1 -3,-0.1 217,-0.0 -0.923 39.7-102.5-166.8 137.8 -13.0 38.4 11.8 26 30 A R > - 0 0 92 -2,-0.3 3,-0.6 1,-0.1 -2,-0.0 -0.235 39.2-127.1 -55.3 151.3 -16.2 39.2 9.8 27 31 A L T 3 S+ 0 0 106 1,-0.2 2,-0.3 216,-0.1 -1,-0.1 0.831 100.6 48.4 -76.6 -35.1 -15.6 38.3 6.2 28 32 A G T 3 S+ 0 0 76 2,-0.0 2,-0.4 0, 0.0 -1,-0.2 -0.219 85.3 132.9-100.0 50.8 -16.5 41.5 4.3 29 33 A E < - 0 0 103 -3,-0.6 2,-0.3 -2,-0.3 -4,-0.0 -0.795 50.1-136.4-103.4 142.5 -14.4 43.7 6.6 30 34 A E - 0 0 178 -2,-0.4 2,-0.6 212,-0.1 -2,-0.0 -0.753 21.0-132.8 -96.2 144.0 -11.9 46.4 5.4 31 35 A V - 0 0 53 -2,-0.3 -2,-0.0 19,-0.2 -1,-0.0 -0.810 22.2-174.8-110.4 106.6 -8.4 46.7 7.1 32 36 A R + 0 0 87 -2,-0.6 -1,-0.2 2,-0.1 -2,-0.0 0.936 68.2 92.2 -53.5 -50.1 -6.7 49.8 8.5 33 37 A Q - 0 0 125 1,-0.2 -2,-0.1 208,-0.0 208,-0.0 -0.231 53.0-174.5 -52.7 117.2 -3.5 47.8 9.3 34 38 A P - 0 0 100 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.547 12.3-166.6 -90.1 -12.0 -1.1 47.9 6.3 35 39 A I - 0 0 59 20,-0.1 2,-0.3 1,-0.0 16,-0.0 -0.422 39.6 -97.3 57.5-136.8 1.4 45.5 7.9 36 40 A S - 0 0 76 18,-0.1 20,-1.3 17,-0.1 2,-0.2 -0.661 58.3-178.0-174.3 125.9 4.5 46.0 5.5 37 41 A V E -A 55 0A 37 -2,-0.3 16,-0.1 18,-0.2 15,-0.0 -0.792 33.9-110.5-134.2 175.6 4.4 43.2 2.9 38 42 A I E -A 54 0A 5 16,-2.0 16,-2.7 -2,-0.2 39,-0.1 -0.978 43.7-116.2-116.1 114.9 6.3 41.8 -0.0 39 43 A P - 0 0 57 0, 0.0 41,-0.2 0, 0.0 42,-0.2 -0.248 14.5-141.4 -50.3 133.6 4.4 42.4 -3.2 40 44 A T - 0 0 0 2,-0.2 37,-0.2 40,-0.1 36,-0.1 0.414 33.3-120.0 -80.7 1.4 3.4 39.0 -4.7 41 45 A G S S+ 0 0 26 35,-0.2 2,-0.3 1,-0.1 3,-0.1 0.644 93.3 95.5 69.5 10.3 4.0 40.4 -8.1 42 46 A S > - 0 0 0 1,-0.1 4,-3.1 2,-0.0 5,-0.2 -0.784 60.6-163.7-134.2 87.1 0.3 39.6 -8.9 43 47 A I H > S+ 0 0 51 -2,-0.3 4,-2.4 1,-0.2 5,-0.3 0.848 93.1 49.3 -37.8 -50.0 -1.7 42.8 -8.3 44 48 A S H >> S+ 0 0 16 1,-0.2 4,-3.4 2,-0.2 3,-0.6 0.984 112.9 44.7 -54.5 -64.4 -4.9 40.7 -8.3 45 49 A L H 3> S+ 0 0 0 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.821 110.1 59.1 -48.5 -36.8 -3.4 38.2 -5.8 46 50 A D H >X>S+ 0 0 22 -4,-3.1 6,-1.3 2,-0.2 5,-0.9 0.938 110.9 38.0 -59.4 -51.5 -2.1 41.2 -3.8 47 51 A V H X<5S+ 0 0 65 -4,-2.4 3,-1.6 -3,-0.6 -2,-0.2 0.911 110.7 64.2 -64.1 -40.4 -5.6 42.7 -3.3 48 52 A A H 3<5S+ 0 0 8 -4,-3.4 198,-0.3 -5,-0.3 -2,-0.2 0.784 101.9 48.7 -52.6 -30.0 -6.6 39.0 -2.9 49 53 A L H <<5S- 0 0 0 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.666 104.2-136.0 -84.5 -19.2 -4.4 39.0 0.2 50 54 A G T <<5S+ 0 0 21 -3,-1.6 -19,-0.2 -4,-0.7 -3,-0.2 0.669 93.7 63.3 72.5 18.1 -6.0 42.2 1.5 51 55 A I S -A 37 0A 3 0, 0.0 3,-0.6 0, 0.0 2,-0.3 -0.268 31.5-115.3 -61.5 153.2 2.9 39.7 5.2 56 60 A R T 3 S+ 0 0 81 -20,-1.3 129,-0.2 1,-0.2 130,-0.1 -0.702 90.7 23.7 -95.9 147.8 6.4 40.0 6.7 57 61 A G T 3 S+ 0 0 4 80,-0.3 2,-0.3 1,-0.3 -1,-0.2 0.565 99.9 113.1 81.2 10.8 7.7 37.9 9.6 58 62 A R S < S- 0 0 87 -3,-0.6 129,-1.7 126,-0.1 2,-0.7 -0.813 73.2-113.3-116.9 155.5 5.1 35.2 8.9 59 63 A V E -b 187 0B 3 149,-0.5 151,-1.9 -2,-0.3 152,-1.2 -0.775 37.8-171.6 -86.9 116.7 5.3 31.6 7.7 60 64 A I E -bc 188 211B 0 127,-3.9 129,-2.8 -2,-0.7 2,-0.4 -0.821 8.5-160.5-107.7 148.0 3.7 31.5 4.3 61 65 A E E -bc 189 212B 2 150,-2.0 152,-2.1 -2,-0.3 2,-0.7 -0.995 3.9-168.1-129.0 127.3 3.0 28.2 2.4 62 66 A I E +bc 190 213B 0 127,-2.3 129,-2.2 -2,-0.4 152,-0.2 -0.942 22.1 171.1-114.8 107.3 2.4 28.2 -1.3 63 67 A Y E +bc 191 214B 32 150,-2.3 152,-2.3 -2,-0.7 129,-0.2 -0.516 11.1 105.8-109.6 178.3 1.0 24.8 -2.3 64 68 A G E -b 192 0B 0 127,-0.8 129,-1.3 150,-0.2 152,-0.2 -0.567 61.8 -44.2 135.6 161.6 -0.4 23.2 -5.4 65 69 A P S > S- 0 0 55 0, 0.0 3,-1.7 0, 0.0 5,-0.3 -0.168 76.0 -74.6 -57.9 149.1 0.0 20.8 -8.4 66 70 A E T 3 S+ 0 0 168 127,-0.3 151,-0.1 1,-0.3 128,-0.0 -0.099 116.4 10.0 -49.7 134.0 3.3 20.8 -10.4 67 71 A S T 3 S+ 0 0 73 -3,-0.1 -1,-0.3 1,-0.1 149,-0.1 0.637 86.9 126.8 71.3 13.3 3.8 23.8 -12.8 68 72 A S S < S- 0 0 1 -3,-1.7 148,-0.2 147,-0.1 -2,-0.1 0.924 86.6 -97.5 -66.8 -42.9 0.8 25.6 -11.3 69 73 A G S > S+ 0 0 10 -4,-0.3 4,-1.4 146,-0.1 5,-0.2 0.506 81.4 130.3 134.7 17.7 2.9 28.6 -10.7 70 74 A K H >> S+ 0 0 14 -5,-0.3 4,-2.4 2,-0.2 3,-0.7 0.993 75.1 45.2 -60.5 -66.9 4.1 28.4 -7.0 71 75 A T H 3> S+ 0 0 46 1,-0.2 4,-3.9 2,-0.2 5,-0.3 0.904 107.8 57.4 -40.5 -63.8 7.8 29.0 -7.5 72 76 A T H 3> S+ 0 0 18 1,-0.3 4,-3.4 2,-0.2 -1,-0.2 0.848 110.6 44.5 -38.0 -50.4 7.4 31.9 -9.9 73 77 A V H X S+ 0 0 53 -4,-2.7 4,-2.1 1,-0.2 3,-1.1 0.980 110.6 52.9 -58.8 -56.8 10.5 42.5 -5.0 81 85 A A H 3<>S+ 0 0 3 -4,-3.0 5,-2.4 1,-0.3 -1,-0.2 0.848 109.9 50.0 -47.6 -40.0 11.9 42.1 -1.6 82 86 A Q H ><5S+ 0 0 25 -4,-2.6 3,-1.5 -5,-0.3 -1,-0.3 0.817 104.1 56.2 -70.6 -31.4 15.4 42.7 -3.0 83 87 A A H <<5S+ 0 0 91 -4,-1.7 -2,-0.2 -3,-1.1 -1,-0.2 0.912 101.8 57.9 -66.0 -38.4 14.4 45.8 -4.9 84 88 A A T 3<5S- 0 0 83 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.366 133.5-102.2 -71.1 10.6 13.3 47.1 -1.5 85 89 A G T < 5S+ 0 0 62 -3,-1.5 -3,-0.2 1,-0.2 2,-0.2 0.754 75.0 148.8 75.6 24.6 16.9 46.4 -0.7 86 90 A G < - 0 0 6 -5,-2.4 2,-0.4 -6,-0.2 -1,-0.2 -0.636 45.7-126.2 -93.2 151.3 16.2 43.1 1.1 87 91 A I E -d 136 0B 73 48,-0.6 50,-2.2 -2,-0.2 51,-1.1 -0.775 26.9-154.6 -93.9 139.4 18.5 40.1 1.2 88 92 A A E -d 138 0B 0 23,-0.4 25,-2.3 -2,-0.4 2,-0.4 -0.940 10.5-163.1-124.1 140.3 17.1 36.8 0.1 89 93 A A E -de 139 113B 2 49,-1.7 51,-1.7 -2,-0.4 2,-0.7 -0.955 4.4-160.1-120.1 131.3 17.9 33.1 0.9 90 94 A F E -de 140 114B 2 23,-4.5 25,-2.0 -2,-0.4 2,-1.9 -0.883 4.1-160.8-110.4 101.0 16.8 30.1 -1.1 91 95 A I E -de 141 115B 2 49,-2.6 51,-1.7 -2,-0.7 25,-0.2 -0.560 23.4-166.4 -81.2 80.4 17.0 26.8 0.9 92 96 A D + 0 0 2 -2,-1.9 51,-0.1 23,-1.5 49,-0.0 -0.431 30.7 154.6 -72.9 140.1 17.0 24.6 -2.2 93 97 A A S S+ 0 0 22 23,-0.2 -1,-0.1 -2,-0.1 23,-0.1 0.196 72.0 53.8-146.3 9.4 16.4 20.9 -1.7 94 98 A E S S- 0 0 92 0, 0.0 -2,-0.1 0, 0.0 22,-0.1 0.538 87.7-138.5-120.6 -21.7 15.0 19.9 -5.1 95 99 A H S S+ 0 0 126 1,-0.1 21,-0.0 47,-0.1 -3,-0.0 0.971 70.5 109.2 58.4 57.1 17.7 21.2 -7.5 96 100 A A + 0 0 74 2,-0.0 -1,-0.1 0, 0.0 -4,-0.0 0.582 34.0 126.1-127.4 -34.6 15.3 22.7 -10.1 97 101 A L - 0 0 37 1,-0.1 3,-0.1 2,-0.1 -5,-0.0 0.074 48.3-151.6 -32.4 124.4 15.7 26.4 -9.6 98 102 A D > - 0 0 86 1,-0.2 4,-2.6 2,-0.0 5,-0.2 -0.851 8.0-169.1-104.9 95.5 16.6 28.0 -12.9 99 103 A P H > S+ 0 0 69 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.912 84.4 59.9 -51.2 -43.3 18.6 31.1 -11.9 100 104 A E H >> S+ 0 0 141 2,-0.2 4,-1.6 1,-0.2 3,-0.7 0.939 108.0 41.2 -49.9 -58.4 18.4 32.3 -15.5 101 105 A Y H >> S+ 0 0 51 1,-0.2 4,-1.4 2,-0.2 3,-0.8 0.955 111.1 61.1 -53.7 -49.0 14.6 32.5 -15.5 102 106 A A H 3<>S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.3 -1,-0.2 0.799 101.8 50.4 -47.2 -38.7 14.8 33.9 -12.0 103 107 A K H X<5S+ 0 0 42 -4,-2.0 3,-1.9 -3,-0.7 -1,-0.3 0.880 104.7 58.1 -70.8 -35.6 16.8 36.9 -13.2 104 108 A K H <<5S+ 0 0 142 -4,-1.6 -2,-0.2 -3,-0.8 -1,-0.2 0.803 101.5 55.5 -64.4 -25.4 14.1 37.4 -15.9 105 109 A L T 3<5S- 0 0 16 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.518 130.4 -99.3 -82.3 -3.7 11.6 37.7 -13.0 106 110 A G T < 5S+ 0 0 50 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.2 0.439 74.5 147.8 102.1 0.4 13.8 40.5 -11.6 107 111 A V < - 0 0 7 -5,-2.4 2,-1.1 -6,-0.2 -1,-0.3 -0.412 49.0-135.2 -69.5 143.0 15.6 38.4 -9.0 108 112 A D >> + 0 0 72 1,-0.2 3,-2.7 -2,-0.1 4,-0.6 -0.602 27.9 178.6 -99.7 71.8 19.2 39.4 -8.3 109 113 A T G >4 S+ 0 0 38 -2,-1.1 3,-2.8 1,-0.3 -1,-0.2 0.842 73.6 63.6 -38.9 -52.3 20.7 35.8 -8.4 110 114 A D G 34 S+ 0 0 153 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.756 111.1 37.5 -50.4 -27.6 24.2 37.0 -7.7 111 115 A S G <4 S+ 0 0 65 -3,-2.7 2,-0.7 2,-0.1 -23,-0.4 0.380 94.3 109.9-105.1 4.9 23.1 38.3 -4.4 112 116 A L << - 0 0 20 -3,-2.8 2,-0.3 -4,-0.6 -23,-0.2 -0.701 66.1-135.7 -85.7 113.6 20.7 35.4 -3.7 113 117 A L E -e 89 0B 76 -25,-2.3 -23,-4.5 -2,-0.7 2,-0.4 -0.489 25.3-171.4 -69.5 129.0 21.9 33.0 -1.0 114 118 A V E +e 90 0B 75 -2,-0.3 2,-0.3 -25,-0.2 -23,-0.2 -0.969 8.8 178.3-125.2 138.5 21.4 29.4 -2.0 115 119 A S E -e 91 0B 28 -25,-2.0 -23,-1.5 -2,-0.4 12,-0.0 -0.981 15.3-164.0-137.8 145.1 21.8 26.4 0.2 116 120 A Q - 0 0 112 -2,-0.3 -23,-0.2 -25,-0.2 -25,-0.1 -0.711 24.9-151.2-134.1 80.0 21.3 22.7 -0.7 117 121 A P - 0 0 19 0, 0.0 3,-0.1 0, 0.0 4,-0.0 0.108 16.7-136.8 -48.0 157.4 21.1 20.8 2.6 118 122 A D S S+ 0 0 117 1,-0.1 2,-0.3 2,-0.0 3,-0.1 0.661 86.0 13.3 -92.0 -20.5 22.1 17.1 3.1 119 123 A T S > S- 0 0 23 1,-0.1 4,-2.7 34,-0.0 5,-0.2 -0.921 77.9-106.0-147.4 171.3 19.0 16.4 5.1 120 124 A G H > S+ 0 0 0 28,-2.1 4,-2.8 -2,-0.3 5,-0.3 0.971 120.8 51.9 -64.2 -50.1 15.6 17.7 6.2 121 125 A E H > S+ 0 0 53 27,-0.3 4,-3.0 1,-0.2 5,-0.2 0.951 112.9 43.9 -47.6 -60.6 17.0 18.6 9.6 122 126 A Q H > S+ 0 0 64 1,-0.2 4,-3.7 2,-0.2 5,-0.4 0.948 110.9 55.5 -50.1 -56.1 19.9 20.5 8.1 123 127 A A H X S+ 0 0 2 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.890 113.9 39.2 -45.5 -52.0 17.7 22.2 5.6 124 128 A L H X S+ 0 0 6 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.913 117.6 49.9 -69.2 -40.7 15.4 23.6 8.2 125 129 A E H >X S+ 0 0 128 -4,-3.0 4,-2.7 -5,-0.3 3,-0.9 0.979 108.4 51.1 -60.5 -59.0 18.3 24.3 10.6 126 130 A I H 3X S+ 0 0 42 -4,-3.7 4,-1.8 1,-0.3 -1,-0.2 0.861 111.7 49.8 -45.5 -40.8 20.4 26.2 8.1 127 131 A A H 3X S+ 0 0 0 -4,-1.5 4,-2.9 -5,-0.4 -1,-0.3 0.856 109.7 51.2 -69.2 -33.9 17.3 28.2 7.3 128 132 A D H X S+ 0 0 45 -4,-1.8 3,-1.9 -5,-0.3 4,-0.5 0.948 110.2 53.9 -68.9 -49.8 19.9 32.5 8.6 131 135 A V H >< S+ 0 0 0 -4,-2.9 3,-2.3 1,-0.3 5,-0.4 0.956 108.1 47.7 -49.6 -62.0 16.5 33.7 9.7 132 136 A R T 3< S+ 0 0 130 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.405 92.0 79.4 -65.8 6.4 17.6 34.7 13.2 133 137 A S T <4 S- 0 0 74 -3,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.738 93.4-141.2 -80.6 -23.2 20.6 36.6 11.9 134 138 A G S << S+ 0 0 44 -3,-2.3 -2,-0.1 -4,-0.5 -3,-0.1 0.333 74.3 106.5 82.3 -6.5 18.1 39.3 11.0 135 139 A A + 0 0 51 -5,-0.4 -48,-0.6 -49,-0.1 2,-0.2 0.530 61.0 89.4 -83.1 -2.6 19.7 40.2 7.8 136 140 A L E -d 87 0B 7 -5,-0.4 -48,-0.2 -6,-0.3 3,-0.1 -0.592 44.3-178.3 -98.7 157.4 17.0 38.6 5.7 137 141 A D E S+ 0 0 25 -50,-2.2 49,-3.4 1,-0.4 2,-0.4 0.676 81.7 10.1-111.3 -48.5 13.7 39.9 4.3 138 142 A I E -df 88 186B 0 -51,-1.1 -49,-1.7 47,-0.3 2,-0.4 -0.998 57.5-171.5-139.3 139.3 12.5 36.7 2.7 139 143 A I E -df 89 187B 0 47,-2.6 49,-1.2 -2,-0.4 2,-0.4 -0.946 12.5-163.3-132.2 112.0 13.7 33.1 2.9 140 144 A V E -df 90 188B 1 -51,-1.7 -49,-2.6 -2,-0.4 2,-0.4 -0.771 4.0-156.7 -98.5 140.0 12.1 30.6 0.5 141 145 A I E -df 91 189B 2 47,-2.5 49,-2.1 -2,-0.4 2,-0.6 -0.913 14.8-137.0-109.6 136.2 12.3 26.8 1.0 142 146 A D S S- 0 0 15 -51,-1.7 49,-0.1 -2,-0.4 4,-0.1 -0.872 70.8 -7.3-101.6 132.4 11.8 24.6 -2.1 143 147 A S > - 0 0 5 -2,-0.6 3,-3.7 2,-0.1 4,-0.5 0.923 46.5-157.0 50.2 77.8 9.6 21.5 -1.5 144 148 A V G > S+ 0 0 0 46,-2.5 3,-1.8 1,-0.3 47,-0.1 0.824 97.8 64.7 -35.7 -39.5 8.4 20.6 1.9 145 149 A A G 3 S+ 0 0 44 1,-0.3 -1,-0.3 45,-0.2 -2,-0.1 0.789 97.2 54.8 -58.4 -31.1 8.0 17.1 0.5 146 150 A A G < S+ 0 0 26 -3,-3.7 2,-1.4 1,-0.2 -1,-0.3 0.436 74.7 100.5 -85.2 -1.1 11.8 16.9 0.1 147 151 A L < + 0 0 2 -3,-1.8 -1,-0.2 -4,-0.5 -27,-0.1 -0.099 59.0 173.4 -76.2 40.9 12.5 17.8 3.8 148 152 A V - 0 0 37 -2,-1.4 -28,-2.1 -28,-0.1 -27,-0.3 -0.226 34.9-109.2 -55.2 131.1 13.1 14.0 4.3 149 153 A P > - 0 0 1 0, 0.0 4,-1.3 0, 0.0 16,-0.1 -0.008 25.3-115.7 -53.5 169.1 14.4 13.1 7.8 150 154 A R H >> S+ 0 0 109 2,-0.2 4,-3.0 1,-0.2 3,-0.6 0.969 111.6 58.7 -74.8 -58.3 18.0 12.0 8.1 151 155 A A H 34 S+ 0 0 25 1,-0.3 -1,-0.2 2,-0.2 5,-0.1 0.801 113.4 44.2 -43.2 -27.6 17.4 8.4 9.3 152 156 A E H 34 S+ 0 0 127 3,-0.1 4,-0.3 1,-0.1 -1,-0.3 0.848 109.9 52.6 -87.4 -35.4 15.4 8.1 6.1 153 157 A I H << S+ 0 0 75 -4,-1.3 -2,-0.2 -3,-0.6 -3,-0.2 0.978 112.0 52.1 -61.5 -53.1 18.0 9.8 3.9 154 158 A E S < S- 0 0 95 -4,-3.0 2,-1.0 1,-0.1 0, 0.0 -0.345 121.4 -80.9 -74.2 166.0 20.6 7.5 5.2 155 159 A G + 0 0 82 -2,-0.0 2,-0.4 0, 0.0 -3,-0.1 -0.570 63.0 164.6 -72.6 103.4 19.6 3.9 5.0 156 160 A E - 0 0 125 -2,-1.0 4,-0.0 -4,-0.3 0, 0.0 -0.992 35.5-116.6-125.6 136.3 17.3 3.2 8.0 157 161 A M - 0 0 92 -2,-0.4 2,-1.6 1,-0.1 -1,-0.0 0.028 36.7 -92.8 -54.4 167.1 15.1 0.0 8.1 158 162 A G S S+ 0 0 77 3,-0.1 2,-0.4 2,-0.0 3,-0.3 -0.415 98.2 98.2 -88.1 59.7 11.2 0.1 8.1 159 163 A D S S+ 0 0 74 -2,-1.6 3,-0.1 1,-0.2 0, 0.0 -0.953 83.9 30.4-145.7 136.7 11.2 0.1 12.0 160 164 A S S S+ 0 0 85 -2,-0.4 2,-1.2 1,-0.2 -1,-0.2 0.902 82.0 160.5 63.8 38.0 10.7 3.4 13.6 161 165 A H + 0 0 77 -3,-0.3 -1,-0.2 2,-0.1 -3,-0.1 -0.524 28.3 157.3 -91.5 53.1 8.9 3.7 10.3 162 166 A V - 0 0 85 -2,-1.2 3,-0.2 -3,-0.1 -3,-0.0 0.223 65.3 -93.6 -70.9-171.0 7.3 6.5 12.2 163 167 A G S > S+ 0 0 56 1,-0.2 4,-1.0 2,-0.1 -1,-0.1 -0.398 74.9 143.9-105.9 46.2 5.4 9.7 11.2 164 168 A L H > + 0 0 48 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.759 50.0 59.9 -61.3 -37.2 8.9 11.3 11.4 165 169 A Q H > S+ 0 0 21 -3,-0.2 4,-2.4 1,-0.2 5,-0.2 0.988 106.7 45.5 -62.1 -57.5 8.9 13.8 8.6 166 170 A A H > S+ 0 0 25 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.829 110.6 57.3 -54.9 -30.5 6.0 15.9 9.8 167 171 A R H >X S+ 0 0 107 -4,-1.0 3,-2.6 2,-0.2 4,-2.1 0.999 105.9 47.8 -61.0 -62.6 7.5 15.7 13.3 168 172 A L H 3X S+ 0 0 13 -4,-2.3 4,-2.4 1,-0.3 -2,-0.2 0.873 111.4 53.3 -37.6 -50.4 10.7 17.3 12.0 169 173 A M H 3X S+ 0 0 2 -4,-2.4 4,-0.7 2,-0.2 -1,-0.3 0.650 110.1 46.4 -64.1 -23.2 8.5 19.9 10.3 170 174 A S H S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 5,-1.0 0.883 108.1 48.2 -53.7 -38.3 10.7 35.1 12.0 181 185 A N H <5S+ 0 0 90 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.975 115.1 41.9 -65.5 -55.1 8.5 37.4 14.0 182 186 A N H <5S+ 0 0 134 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.927 123.0 42.6 -56.1 -43.7 11.4 39.0 15.8 183 187 A S H <5S- 0 0 25 -4,-4.9 -1,-0.2 -5,-0.1 -2,-0.2 0.708 96.6-143.5 -76.5 -23.5 13.3 39.0 12.5 184 188 A G T <5 + 0 0 22 -4,-2.1 2,-0.4 -5,-0.4 -127,-0.3 0.797 48.8 145.9 64.4 23.6 10.4 40.1 10.5 185 189 A T < - 0 0 0 -5,-1.0 2,-0.6 -129,-0.2 -47,-0.3 -0.775 47.8-128.4 -95.4 141.7 11.6 37.9 7.6 186 190 A T E - f 0 138B 0 -49,-3.4 -47,-2.6 -2,-0.4 2,-0.7 -0.796 16.4-156.5 -95.3 122.7 9.0 36.2 5.4 187 191 A A E -bf 59 139B 0 -129,-1.7 -127,-3.9 -2,-0.6 2,-0.7 -0.863 4.2-166.2-100.4 115.0 9.3 32.5 5.0 188 192 A I E -bf 60 140B 0 -49,-1.2 -47,-2.5 -2,-0.7 2,-0.7 -0.914 6.0-163.6-100.6 117.0 7.7 31.1 1.8 189 193 A F E -bf 61 141B 0 -129,-2.8 -127,-2.3 -2,-0.7 2,-0.5 -0.899 8.3-149.9-102.7 110.2 7.4 27.3 2.1 190 194 A I E +b 62 0B 2 -49,-2.1 -46,-2.5 -2,-0.7 2,-0.5 -0.703 19.5 179.7 -80.9 125.1 6.8 25.8 -1.3 191 195 A N E -b 63 0B 7 -129,-2.2 -127,-0.8 -2,-0.5 2,-0.3 -0.967 11.0-155.4-127.2 114.8 4.7 22.6 -0.7 192 196 A A E -b 64 0B 38 -2,-0.5 -129,-0.1 -129,-0.2 -47,-0.1 -0.725 13.7-116.3-101.7 145.5 3.8 20.6 -3.8 193 197 A L - 0 0 89 -129,-1.3 -127,-0.3 -2,-0.3 -1,-0.1 -0.224 40.3-135.9 -72.1 157.4 0.9 18.2 -4.4 194 198 A R - 0 0 103 1,-0.1 -1,-0.1 -129,-0.1 -128,-0.1 0.077 0.6 -74.9-104.7-157.0 1.3 14.4 -5.2 195 199 A E 0 0 180 1,-0.1 -1,-0.1 0, 0.0 0, 0.0 0.356 360.0 360.0 -71.6-169.3 1.0 10.9 -6.7 196 200 A K 0 0 150 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.804 360.0 360.0 93.1 360.0 -1.4 8.0 -6.6 197 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 198 210 A T > 0 0 124 0, 0.0 4,-0.7 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0-123.5 -0.5 15.7 3.6 199 211 A T T 4 - 0 0 34 1,-0.2 -7,-0.1 2,-0.1 -6,-0.0 0.357 360.0 -98.4 86.2 2.4 2.9 15.8 2.0 200 212 A T T 4 S+ 0 0 52 1,-0.1 -1,-0.2 -35,-0.1 -31,-0.1 0.976 118.7 45.8 47.3 71.9 3.9 14.6 5.4 201 213 A G T > S+ 0 0 0 -3,-0.2 4,-1.0 -35,-0.1 -2,-0.1 0.246 86.3 82.3 149.7 -6.7 4.9 18.0 6.7 202 214 A G H X S+ 0 0 7 -4,-0.7 4,-2.5 2,-0.2 5,-0.2 0.555 78.3 74.8 -94.4 -13.6 2.1 20.2 5.6 203 215 A K H > S+ 0 0 59 2,-0.2 4,-0.6 1,-0.2 -1,-0.1 0.907 103.6 37.3 -63.4 -42.1 0.2 19.0 8.6 204 216 A A H >> S+ 0 0 7 2,-0.2 4,-1.2 1,-0.1 3,-1.0 0.942 115.7 53.1 -72.2 -52.5 2.4 21.3 10.8 205 217 A L H >X S+ 0 0 0 -4,-1.0 3,-2.5 1,-0.3 4,-2.2 0.948 97.7 64.1 -46.3 -63.0 2.6 24.1 8.3 206 218 A K H 3< S+ 0 0 108 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.784 112.1 38.1 -32.3 -43.0 -1.2 24.4 7.9 207 219 A F H << S+ 0 0 165 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.662 119.1 46.4 -87.9 -18.7 -1.3 25.4 11.6 208 220 A Y H << S+ 0 0 86 -3,-2.5 -149,-0.5 -4,-1.2 2,-0.4 0.496 91.1 97.5-100.5 -6.3 1.9 27.5 11.6 209 221 A A < - 0 0 2 -4,-2.2 -149,-0.2 -5,-0.2 3,-0.1 -0.695 51.8-165.3 -90.4 134.2 1.3 29.5 8.5 210 222 A S S S+ 0 0 21 -151,-1.9 30,-2.2 -2,-0.4 2,-0.4 0.763 86.7 28.3 -83.1 -28.1 -0.2 33.0 8.6 211 223 A V E -cG 60 239B 0 -152,-1.2 -150,-2.0 28,-0.2 2,-0.5 -0.999 65.2-175.2-136.8 133.6 -1.0 32.8 4.9 212 224 A R E -cG 61 238B 35 26,-2.2 26,-1.2 -2,-0.4 25,-0.7 -0.902 8.5-165.8-130.1 103.8 -1.6 29.7 2.8 213 225 A L E -cG 62 236B 0 -152,-2.1 -150,-2.3 -2,-0.5 2,-0.8 -0.743 10.6-151.3 -92.6 136.9 -2.0 30.2 -0.9 214 226 A D E -cG 63 235B 23 21,-3.1 21,-2.3 -2,-0.4 2,-0.3 -0.861 18.5-159.8-105.3 96.2 -3.5 27.4 -3.0 215 227 A V E + G 0 234B 0 -152,-2.3 2,-0.3 -2,-0.8 19,-0.2 -0.629 14.8 177.6 -81.6 138.7 -1.9 27.8 -6.4 216 228 A R E - G 0 233B 108 17,-2.0 17,-2.6 -2,-0.3 2,-0.3 -0.985 29.4-132.4-143.0 145.9 -3.7 26.2 -9.3 217 229 A R E + G 0 232B 95 -2,-0.3 15,-0.2 15,-0.2 -149,-0.1 -0.691 32.0 161.8 -90.1 152.5 -3.4 25.9 -13.1 218 230 A I E + 0 0 53 13,-1.9 2,-0.3 1,-0.4 14,-0.2 0.483 52.4 12.8-146.9 -15.9 -6.7 26.6 -14.9 219 231 A E E - G 0 231B 40 12,-1.3 12,-2.3 2,-0.0 2,-0.7 -0.983 55.1-125.6-165.9 154.2 -6.1 27.3 -18.6 220 232 A T E - G 0 230B 88 -2,-0.3 2,-2.3 10,-0.3 10,-0.3 -0.918 32.7-129.9-104.6 115.1 -3.7 27.3 -21.5 221 233 A L + 0 0 20 8,-2.3 7,-1.4 -2,-0.7 8,-0.4 -0.405 38.7 166.9 -66.1 82.5 -3.5 30.8 -23.0 222 234 A K > + 0 0 44 -2,-2.3 4,-2.6 1,-0.2 2,-0.3 0.894 12.0 161.6 -66.1 -39.8 -4.0 29.6 -26.5 223 235 A D T 4 S+ 0 0 57 1,-0.3 2,-1.8 -3,-0.2 -1,-0.2 -0.368 75.2 21.7 58.6-114.2 -4.6 33.2 -27.6 224 236 A G T 4 S- 0 0 63 2,-0.4 -1,-0.3 -2,-0.3 3,-0.1 -0.125 130.1 -86.2 -77.1 44.7 -4.1 33.1 -31.4 225 237 A T T 4 S+ 0 0 94 -2,-1.8 2,-0.3 1,-0.1 -2,-0.2 0.743 110.9 94.1 56.5 29.2 -4.9 29.4 -31.1 226 238 A D S < S- 0 0 98 -4,-2.6 -2,-0.4 -5,-0.1 -1,-0.1 -0.963 87.3 -92.9-150.3 125.3 -1.2 28.7 -30.4 227 239 A A + 0 0 80 -2,-0.3 -5,-0.2 1,-0.1 3,-0.1 -0.064 48.0 154.7 -46.0 132.8 0.3 28.5 -26.9 228 240 A V - 0 0 42 -7,-1.4 26,-1.0 1,-0.6 2,-0.2 0.535 66.9 -42.9-115.6 -81.0 1.8 31.5 -25.2 229 241 A G E - H 0 253B 1 -8,-0.4 -8,-2.3 24,-0.3 -1,-0.6 -0.567 60.8 -89.6-135.5-163.5 1.5 30.8 -21.5 230 242 A N E -GH 220 252B 41 22,-1.9 22,-1.0 -10,-0.3 2,-0.3 -0.961 28.6-127.0-123.4 139.2 -0.9 29.4 -18.8 231 243 A R E -GH 219 251B 34 -12,-2.3 -13,-1.9 -2,-0.4 -12,-1.3 -0.650 28.4-157.5 -83.7 137.1 -3.5 31.1 -16.7 232 244 A T E -GH 217 250B 0 18,-2.2 18,-2.1 -2,-0.3 2,-0.4 -0.830 11.6-159.2-118.0 154.7 -3.3 30.6 -13.0 233 245 A R E -GH 216 249B 86 -17,-2.6 -17,-2.0 -2,-0.3 2,-0.5 -0.999 7.6-166.2-130.8 130.3 -5.7 30.9 -10.1 234 246 A V E -GH 215 248B 0 14,-3.3 14,-2.0 -2,-0.4 2,-0.5 -0.968 4.1-159.1-120.4 126.6 -4.7 31.3 -6.5 235 247 A K E -GH 214 247B 76 -21,-2.3 -21,-3.1 -2,-0.5 2,-1.5 -0.875 13.9-143.6-103.9 134.3 -7.1 30.8 -3.6 236 248 A V E +G 213 0B 0 10,-2.4 9,-3.1 -2,-0.5 10,-0.4 -0.636 29.2 170.2 -94.3 77.7 -6.2 32.4 -0.3 237 249 A V E + 0 0 25 -2,-1.5 2,-0.4 -25,-0.7 -1,-0.2 0.818 66.7 28.0 -57.4 -33.9 -7.5 29.6 1.8 238 250 A K E +G 212 0B 45 -26,-1.2 -26,-2.2 -3,-0.2 2,-0.3 -0.987 61.6 160.3-137.2 130.7 -6.0 30.9 5.0 239 251 A N E -G 211 0B 5 -2,-0.4 3,-0.4 -28,-0.2 -28,-0.2 -0.906 12.9-180.0-149.0 115.6 -5.2 34.5 5.9 240 252 A K S S+ 0 0 81 -30,-2.2 -29,-0.1 -2,-0.3 -216,-0.1 0.071 85.8 52.2-103.4 24.9 -4.7 35.6 9.5 241 253 A V S S+ 0 0 37 1,-0.4 -1,-0.2 -31,-0.2 -219,-0.1 0.229 120.7 13.5-137.1 5.8 -4.0 39.2 8.6 242 254 A S S S- 0 0 2 -3,-0.4 -1,-0.4 -220,-0.1 -3,-0.1 -0.959 104.8 -59.6-171.1 163.6 -7.0 39.8 6.4 243 255 A P - 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