==== 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 16-OCT-09 3K9T . COMPND 2 MOLECULE: PUTATIVE PEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM ACETOBUTYLICUM; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 422 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17873.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 299 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 55 13.0 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 35 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 111 26.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.2 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 2 1 1 0 1 1 2 0 1 1 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 1 1 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 PARALLEL BRIDGES PER LADDER . 2 2 3 0 1 2 0 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 2 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 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 0 A G > 0 0 82 0, 0.0 3,-1.2 0, 0.0 214,-0.2 0.000 360.0 360.0 360.0 -77.1 30.2 -23.0 55.5 2 1 A X G > + 0 0 15 1,-0.2 3,-2.3 2,-0.2 4,-0.3 0.540 360.0 85.9 -69.6 -11.7 29.4 -19.7 57.1 3 2 A E G > + 0 0 47 1,-0.3 3,-1.9 2,-0.2 4,-0.3 0.765 69.7 77.9 -57.7 -22.1 29.0 -22.1 60.0 4 3 A E G X> S+ 0 0 96 -3,-1.2 3,-0.6 1,-0.3 4,-0.5 0.702 78.2 68.9 -60.0 -20.0 32.7 -21.5 60.3 5 4 A I H X> S+ 0 0 0 -3,-2.3 4,-2.0 1,-0.2 3,-0.7 0.745 81.1 78.8 -66.6 -23.8 31.9 -18.2 61.9 6 5 A N H <> S+ 0 0 30 -3,-1.9 4,-2.8 -4,-0.3 -1,-0.2 0.859 87.7 53.5 -57.3 -36.7 30.6 -20.2 64.9 7 6 A K H <> S+ 0 0 99 -3,-0.6 4,-1.1 -4,-0.3 -1,-0.3 0.851 108.1 51.2 -69.5 -33.3 34.1 -20.9 66.3 8 7 A Y H << S+ 0 0 52 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.895 111.4 46.6 -68.0 -42.0 34.9 -17.1 66.2 9 8 A I H >< S+ 0 0 21 -4,-2.0 3,-1.6 1,-0.2 -2,-0.2 0.944 111.9 52.6 -64.2 -43.6 31.6 -16.3 68.1 10 9 A Q H 3< S+ 0 0 154 -4,-2.8 3,-0.3 1,-0.3 -1,-0.2 0.739 111.5 45.8 -65.7 -22.5 32.5 -19.1 70.6 11 10 A N T 3X S+ 0 0 65 -4,-1.1 4,-2.1 -3,-0.2 3,-0.4 0.153 77.0 117.4-103.7 21.9 36.0 -17.7 71.2 12 11 A S H <> + 0 0 14 -3,-1.6 4,-2.8 1,-0.3 5,-0.2 0.778 65.6 62.6 -66.0 -29.3 34.8 -14.1 71.6 13 12 A S H > S+ 0 0 86 -3,-0.3 4,-1.3 2,-0.2 -1,-0.3 0.958 107.8 42.7 -57.7 -53.6 35.9 -13.8 75.2 14 13 A E H > S+ 0 0 114 -3,-0.4 4,-1.5 1,-0.2 3,-0.3 0.920 114.3 51.7 -58.6 -43.9 39.5 -14.3 74.2 15 14 A T H X S+ 0 0 8 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.866 101.3 61.2 -63.7 -34.8 39.0 -12.0 71.2 16 15 A G H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.894 105.0 50.3 -56.7 -37.9 37.6 -9.3 73.4 17 16 A G H X S+ 0 0 15 -4,-1.3 4,-1.9 -3,-0.3 -1,-0.2 0.909 110.0 47.5 -64.1 -43.3 40.9 -9.3 75.2 18 17 A E H X S+ 0 0 81 -4,-1.5 4,-1.5 2,-0.2 -2,-0.2 0.832 110.3 53.2 -66.9 -35.9 42.8 -9.0 71.9 19 18 A I H X S+ 0 0 0 -4,-2.7 4,-1.8 2,-0.2 3,-0.2 0.929 108.7 50.6 -65.5 -42.0 40.5 -6.1 70.8 20 19 A Y H X S+ 0 0 34 -4,-2.2 4,-3.1 1,-0.2 -2,-0.2 0.915 106.4 54.1 -59.2 -46.5 41.4 -4.4 74.2 21 20 A N H X S+ 0 0 89 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.822 107.1 50.9 -59.6 -36.3 45.1 -4.8 73.6 22 21 A L H X S+ 0 0 2 -4,-1.5 4,-2.5 -3,-0.2 -1,-0.2 0.887 110.3 50.1 -65.8 -42.5 44.8 -3.1 70.2 23 22 A I H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.956 110.5 49.8 -60.0 -48.8 42.9 -0.2 71.9 24 23 A E H < S+ 0 0 93 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.917 111.3 48.4 -59.3 -44.7 45.7 0.0 74.5 25 24 A E H < S+ 0 0 82 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.886 116.9 42.8 -60.0 -40.8 48.4 0.1 71.8 26 25 A L H >< S+ 0 0 0 -4,-2.5 3,-1.4 1,-0.2 -1,-0.2 0.747 93.6 88.0 -76.5 -20.7 46.5 2.8 69.9 27 26 A F T 3< S+ 0 0 40 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.841 83.4 49.0 -54.0 -49.4 45.5 4.9 73.0 28 27 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.635 86.2 104.7 -66.7 -19.2 48.6 7.2 73.4 29 28 A I S < S- 0 0 29 -3,-1.4 2,-1.3 -4,-0.2 8,-0.0 -0.446 72.3-128.3 -73.6 136.8 48.7 8.3 69.8 30 29 A C - 0 0 30 -2,-0.2 7,-0.4 161,-0.1 8,-0.2 -0.639 34.1-179.9 -88.0 84.4 47.4 11.8 68.9 31 30 A R + 0 0 2 -2,-1.3 2,-0.2 6,-0.3 158,-0.1 -0.437 8.4 162.4 -74.3 155.5 44.9 11.4 66.1 32 31 A S - 0 0 1 2,-0.3 158,-0.1 156,-0.2 98,-0.0 -0.806 62.4 -73.6-148.1-166.8 43.0 14.3 64.5 33 32 A I S S+ 0 0 3 -2,-0.2 2,-0.3 156,-0.1 135,-0.1 0.648 120.5 10.0 -70.1 -15.5 41.1 14.6 61.2 34 33 A T S S+ 0 0 3 133,-0.1 -2,-0.3 155,-0.1 3,-0.2 -0.880 91.8 77.4-144.2 172.3 44.5 14.6 59.5 35 34 A G S >> S- 0 0 2 131,-0.6 4,-1.7 -2,-0.3 3,-0.6 -0.279 83.3 -60.1 117.4 170.9 48.1 14.0 60.5 36 35 A N H 3> S+ 0 0 96 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.702 121.9 64.6 -66.4 -17.4 50.9 11.6 61.4 37 36 A G H 3> S+ 0 0 14 -7,-0.4 4,-1.7 2,-0.2 -6,-0.3 0.902 102.6 47.9 -72.0 -39.2 48.8 10.2 64.3 38 37 A V H <> S+ 0 0 2 -3,-0.6 4,-2.2 -8,-0.2 -2,-0.2 0.925 112.5 50.3 -64.4 -42.4 46.3 9.0 61.8 39 38 A R H X S+ 0 0 49 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.910 108.8 50.0 -63.4 -40.0 49.2 7.5 59.9 40 39 A K H X S+ 0 0 50 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.861 110.6 52.7 -65.3 -31.2 50.7 5.8 63.0 41 40 A T H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.890 107.2 49.6 -71.4 -41.3 47.2 4.4 63.6 42 41 A X H X S+ 0 0 1 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.819 108.0 55.9 -64.8 -34.4 47.0 3.0 60.0 43 42 A D H < S+ 0 0 86 -4,-2.0 4,-0.3 2,-0.2 -2,-0.2 0.938 109.5 45.1 -62.0 -44.4 50.4 1.3 60.6 44 43 A I H >< S+ 0 0 15 -4,-1.8 3,-1.8 1,-0.2 4,-0.3 0.928 110.7 53.0 -67.8 -43.0 49.1 -0.4 63.7 45 44 A I H >X S+ 0 0 0 -4,-2.4 3,-2.3 1,-0.3 4,-2.2 0.883 102.7 59.8 -56.7 -37.9 45.9 -1.5 62.0 46 45 A R T 3< S+ 0 0 103 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.506 89.5 70.2 -76.2 -3.7 48.0 -3.0 59.2 47 46 A K T <4 S+ 0 0 136 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.605 113.6 29.3 -77.1 -12.4 49.7 -5.3 61.7 48 47 A H T <4 S+ 0 0 54 -3,-2.3 -2,-0.2 1,-0.4 -3,-0.1 0.750 131.7 10.0-112.4 -42.5 46.3 -7.0 61.8 49 48 A I S < S- 0 0 6 -4,-2.2 -1,-0.4 163,-0.0 2,-0.1 -0.960 77.9-101.9-137.2 156.9 44.6 -6.5 58.4 50 49 A P - 0 0 78 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 -0.514 42.1-177.1 -72.6 150.5 45.7 -5.3 55.0 51 50 A L - 0 0 21 -2,-0.1 2,-0.6 -5,-0.1 121,-0.2 -0.987 29.0-136.2-141.0 149.0 44.6 -1.8 54.1 52 51 A E E -A 171 0A 119 119,-3.1 119,-1.8 -2,-0.3 2,-0.4 -0.925 29.6-148.8 -94.4 123.5 44.9 0.5 51.1 53 52 A I E -A 170 0A 44 -2,-0.6 2,-0.4 117,-0.2 117,-0.2 -0.819 11.2-161.9 -96.8 130.1 45.9 3.9 52.5 54 53 A H E -A 169 0A 30 115,-3.4 115,-1.8 -2,-0.4 2,-0.4 -0.880 8.2-163.1-112.6 145.4 44.7 7.0 50.6 55 54 A E E -A 168 0A 77 -2,-0.4 2,-0.5 113,-0.2 113,-0.2 -0.955 6.4-165.9-130.3 110.5 46.0 10.6 50.9 56 55 A V E -A 167 0A 4 111,-2.4 111,-2.7 -2,-0.4 109,-0.1 -0.883 28.1-113.7-101.5 124.3 43.7 13.3 49.5 57 56 A K E > -A 166 0A 111 -2,-0.5 3,-2.0 109,-0.2 109,-0.3 -0.181 32.0-101.9 -57.5 137.7 45.4 16.7 49.0 58 57 A S T 3 S+ 0 0 17 107,-2.3 11,-0.1 1,-0.2 -1,-0.1 -0.370 110.9 35.4 -54.0 139.6 44.4 19.7 51.1 59 58 A G T 3 S+ 0 0 53 8,-3.2 -1,-0.2 1,-0.4 2,-0.2 0.256 81.3 140.7 94.9 -10.4 42.2 21.9 49.1 60 59 A T < - 0 0 52 -3,-2.0 7,-3.3 8,-0.1 2,-0.6 -0.494 54.2-125.9 -67.6 131.8 40.5 19.0 47.2 61 60 A K E -H 66 0B 105 5,-0.2 2,-0.6 -2,-0.2 5,-0.2 -0.726 26.4-175.0 -83.6 118.3 36.8 19.7 46.8 62 61 A V E > -H 65 0B 0 3,-2.8 3,-2.4 -2,-0.6 171,-0.1 -0.902 63.7 -63.3-118.9 98.7 34.8 16.8 48.1 63 62 A F T 3 S- 0 0 89 -2,-0.6 -1,-0.1 1,-0.3 170,-0.0 -0.384 119.7 -16.5 47.6-127.2 31.2 17.6 47.3 64 63 A D T 3 S+ 0 0 148 -3,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.593 127.3 84.0 -77.7 -9.4 30.4 20.8 49.2 65 64 A W E < -H 62 0B 87 -3,-2.4 -3,-2.8 164,-0.1 2,-0.4 -0.511 67.3-141.3 -97.1 162.3 33.4 20.3 51.5 66 65 A T E -H 61 0B 73 -5,-0.2 -5,-0.2 -2,-0.2 -6,-0.1 -0.990 28.1-113.8-119.9 129.4 37.1 21.2 51.1 67 66 A V - 0 0 2 -7,-3.3 -8,-3.2 -2,-0.4 -7,-0.1 -0.420 44.3-129.3 -61.8 119.5 39.8 18.9 52.3 68 67 A P - 0 0 15 0, 0.0 97,-0.3 0, 0.0 -8,-0.1 -0.003 24.3 -82.6 -65.3 172.4 41.5 20.9 55.2 69 68 A K - 0 0 92 -11,-0.1 2,-0.4 95,-0.1 95,-0.3 -0.325 53.6-101.8 -63.6 156.9 45.1 21.7 55.8 70 69 A E E -I 163 0C 24 93,-3.0 93,-2.2 -3,-0.1 2,-0.4 -0.724 35.1-153.9 -89.0 137.8 47.1 19.0 57.6 71 70 A W E +I 162 0C 5 -2,-0.4 2,-0.3 91,-0.2 91,-0.2 -0.895 16.4 171.4-114.3 140.1 47.7 19.4 61.3 72 71 A N E -I 161 0C 29 89,-2.0 89,-2.2 -2,-0.4 2,-0.3 -0.967 12.0-160.2-142.7 157.2 50.6 17.9 63.3 73 72 A I E +I 160 0C 32 -2,-0.3 87,-0.2 87,-0.2 -43,-0.1 -0.990 17.9 173.4-147.0 131.3 52.0 18.3 66.8 74 73 A K E S- 0 0 142 85,-2.8 2,-0.3 1,-0.4 86,-0.1 0.762 73.2 -18.8 -97.2 -46.2 55.3 17.5 68.5 75 74 A D E -I 159 0C 36 84,-1.1 84,-2.8 14,-0.0 -1,-0.4 -0.985 51.1-171.7-160.1 160.6 54.8 19.0 71.9 76 75 A A E +I 158 0C 0 -2,-0.3 13,-2.1 82,-0.2 14,-0.4 -0.939 17.9 151.6-157.3 142.2 52.7 21.4 73.9 77 76 A Y E -IJ 157 88C 35 80,-3.3 80,-3.2 -2,-0.3 2,-0.5 -0.963 37.4-139.5-167.8 154.3 53.0 22.8 77.5 78 77 A V E -IJ 156 87C 1 9,-1.8 9,-1.7 -2,-0.3 8,-1.2 -0.997 33.6-169.7-113.6 121.7 52.2 25.6 79.9 79 78 A R E -IJ 155 85C 67 76,-3.3 76,-2.5 -2,-0.5 6,-0.2 -0.926 11.4-139.6-119.0 139.1 55.3 26.1 82.2 80 79 A N > - 0 0 22 4,-2.3 3,-2.1 -2,-0.4 74,-0.1 -0.398 33.3 -99.8 -90.5 173.2 55.5 28.2 85.3 81 80 A S T 3 S+ 0 0 81 72,-0.3 -1,-0.1 1,-0.3 73,-0.1 0.787 123.7 62.7 -62.9 -30.7 58.5 30.4 86.4 82 81 A K T 3 S- 0 0 99 2,-0.1 -1,-0.3 1,-0.1 -2,-0.0 0.471 122.9-110.7 -69.9 -3.5 59.6 27.7 88.8 83 82 A G S < S+ 0 0 41 -3,-2.1 2,-0.4 1,-0.2 -2,-0.1 0.326 70.8 140.9 91.3 -5.8 60.1 25.7 85.5 84 83 A E - 0 0 123 1,-0.1 -4,-2.3 -5,-0.1 2,-1.4 -0.594 55.2-130.3 -81.1 124.8 57.2 23.2 86.1 85 84 A K E -J 79 0C 69 -2,-0.4 -6,-0.3 -6,-0.2 -1,-0.1 -0.560 26.6-178.6 -68.7 91.0 55.0 22.1 83.2 86 85 A V E S+ 0 0 38 -2,-1.4 2,-0.4 -8,-1.2 -1,-0.2 0.706 78.7 32.0 -71.3 -21.1 51.7 22.8 84.9 87 86 A I E S-J 78 0C 3 -9,-1.7 -9,-1.8 -3,-0.1 2,-0.4 -0.990 78.3-177.1-131.0 133.2 50.0 21.5 81.6 88 87 A D E >> -J 77 0C 22 -2,-0.4 3,-1.8 -11,-0.2 4,-1.1 -0.925 23.8-161.8-141.3 110.0 51.8 18.8 79.6 89 88 A F T 34 S+ 0 0 28 -13,-2.1 3,-0.2 -2,-0.4 6,-0.2 0.816 93.8 65.3 -51.7 -40.0 50.7 17.2 76.3 90 89 A K T 34 S+ 0 0 112 -14,-0.4 -1,-0.3 1,-0.2 3,-0.2 0.721 101.2 50.8 -60.4 -24.1 53.0 14.3 76.9 91 90 A E T <4 S- 0 0 147 -3,-1.8 2,-0.3 1,-0.3 -1,-0.2 0.819 133.8 -5.5 -81.1 -35.1 50.8 13.3 79.9 92 91 A N >< - 0 0 36 -4,-1.1 3,-1.6 -3,-0.2 -1,-0.3 -0.859 54.6-148.7-159.9 123.8 47.5 13.5 78.0 93 92 A N G > S+ 0 0 10 -2,-0.3 3,-1.1 1,-0.3 -4,-0.1 0.599 95.0 76.2 -75.8 -5.3 46.9 14.6 74.4 94 93 A L G 3 S+ 0 0 0 1,-0.2 35,-0.3 98,-0.1 -1,-0.3 0.706 75.8 80.1 -73.3 -17.1 43.5 15.8 75.4 95 94 A H G < S+ 0 0 17 -3,-1.6 45,-1.8 -6,-0.2 2,-0.4 0.629 88.0 63.4 -60.1 -19.0 45.4 18.8 77.0 96 95 A V B < S-L 139 0D 5 -3,-1.1 2,-0.3 43,-0.2 43,-0.2 -0.945 89.1-120.2-115.1 135.3 45.6 20.5 73.5 97 96 A X > - 0 0 10 41,-2.2 3,-1.7 -2,-0.4 41,-0.3 -0.553 43.8-105.8 -68.8 124.7 42.7 21.6 71.4 98 97 A S B 3 S+n 130 0E 5 31,-2.6 33,-2.0 -2,-0.3 -1,-0.1 -0.317 105.0 21.2 -62.1 137.2 42.9 19.6 68.2 99 98 A Y T 3 S+ 0 0 4 1,-0.2 37,-0.5 31,-0.2 -1,-0.3 0.575 85.6 172.9 77.4 18.6 44.1 21.8 65.2 100 99 A S < - 0 0 0 -3,-1.7 37,-0.3 38,-0.1 -1,-0.2 -0.343 33.4-122.9 -59.9 126.1 45.7 24.3 67.6 101 100 A V - 0 0 29 35,-2.9 2,-0.1 1,-0.1 37,-0.1 -0.291 41.6 -89.1 -59.9 149.4 47.8 26.9 65.7 102 101 A P - 0 0 76 0, 0.0 2,-0.3 0, 0.0 57,-0.2 -0.455 52.8-179.3 -67.1 142.9 51.4 27.0 66.9 103 102 A V E +K 158 0C 14 55,-1.7 55,-2.9 -2,-0.1 2,-0.3 -0.997 20.9 177.3-144.5 142.7 52.1 29.4 69.8 104 103 A H E +K 157 0C 136 -2,-0.3 2,-0.3 53,-0.2 53,-0.2 -0.830 34.3 133.5-146.3 102.4 55.2 30.4 71.8 105 104 A K E -K 156 0C 103 51,-2.4 51,-3.4 -2,-0.3 2,-0.5 -0.936 52.0-128.2-147.0 159.6 54.5 33.1 74.4 106 105 A T E +K 155 0C 93 -2,-0.3 2,-0.3 49,-0.2 49,-0.2 -0.988 41.8 166.2-108.8 128.6 54.9 34.3 77.9 107 106 A X E -K 154 0C 10 47,-2.4 47,-3.5 -2,-0.5 2,-0.1 -0.979 35.1-118.3-140.4 153.8 51.6 35.3 79.4 108 107 A T E >> -K 153 0C 47 -2,-0.3 4,-2.2 45,-0.2 3,-0.8 -0.461 41.6-101.2 -81.0 163.6 50.2 36.0 82.9 109 108 A L H 3> S+ 0 0 8 43,-1.0 4,-3.1 1,-0.3 42,-0.1 0.900 123.3 53.6 -52.9 -44.5 47.5 33.8 84.3 110 109 A D H 34 S+ 0 0 96 1,-0.2 -1,-0.3 2,-0.2 41,-0.0 0.775 110.6 45.3 -63.8 -29.4 44.8 36.4 83.4 111 110 A E H <4 S+ 0 0 105 -3,-0.8 4,-0.2 2,-0.1 -1,-0.2 0.811 116.8 46.2 -83.0 -31.9 46.0 36.5 79.7 112 111 A L H >< S+ 0 0 2 -4,-2.2 3,-2.7 1,-0.2 4,-0.4 0.895 94.1 79.2 -72.3 -42.2 46.2 32.6 79.6 113 112 A K G >< S+ 0 0 87 -4,-3.1 3,-1.8 1,-0.3 -1,-0.2 0.753 84.8 58.6 -41.5 -43.6 42.8 32.0 81.3 114 113 A P G 3 S+ 0 0 90 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.808 107.7 47.8 -64.0 -24.5 40.6 32.7 78.2 115 114 A Y G < S+ 0 0 79 -3,-2.7 24,-2.5 -4,-0.2 2,-0.3 0.347 95.7 93.4 -91.8 3.1 42.5 29.9 76.3 116 115 A L E < -m 139 0D 15 -3,-1.8 2,-0.4 -4,-0.4 24,-0.2 -0.767 58.1-163.1 -97.8 143.0 42.1 27.4 79.2 117 116 A H E +m 140 0D 57 22,-1.9 24,-2.4 -2,-0.3 2,-0.2 -0.995 15.0 161.2-134.1 128.4 39.2 24.9 79.3 118 117 A T - 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0 0 15 -7,-2.4 2,-1.1 -5,-0.1 -43,-0.3 -0.446 51.3-105.1 -91.0 165.4 22.1 4.1 51.5 310 309 A S + 0 0 22 -65,-0.3 -62,-1.8 -64,-0.2 2,-0.5 -0.765 57.1 153.8 -95.9 91.4 20.8 1.9 54.4 311 310 A V E +e 248 0A 1 -2,-1.1 -62,-0.2 -64,-0.2 -45,-0.2 -0.974 13.3 171.5-123.9 121.8 23.3 2.4 57.1 312 311 A G E -e 249 0A 0 -64,-2.2 -62,-2.4 -2,-0.5 2,-0.3 -0.388 27.2-121.1-107.2-164.2 22.6 2.0 60.9 313 312 A S E -eG 250 263A 0 -50,-1.9 -50,-3.0 -64,-0.3 2,-0.6 -0.958 12.4-161.6-150.2 117.6 24.9 2.1 63.9 314 313 A L E + G 0 262A 3 -64,-0.6 -62,-0.5 -2,-0.3 -52,-0.2 -0.932 31.8 151.5-109.0 115.4 25.3 -0.7 66.4 315 314 A X E - G 0 261A 6 -54,-3.1 -54,-2.2 -2,-0.6 -61,-0.2 -0.601 43.5-135.2-129.1 177.2 26.8 0.6 69.6 316 315 A R S S+ 0 0 17 -63,-2.7 2,-0.8 -64,-0.3 -1,-0.2 0.279 93.6 4.2-103.5-114.5 26.9 0.0 73.3 317 316 A S S S- 0 0 29 -59,-0.1 -1,-0.3 -2,-0.1 4,-0.2 -0.582 93.9-129.3 -73.8 110.0 26.6 3.2 75.4 318 317 A C > - 0 0 37 -2,-0.8 3,-1.3 -3,-0.1 -65,-0.1 -0.170 32.7 -76.9 -58.1 148.3 25.9 5.7 72.6 319 318 A Y T 3 S+ 0 0 39 1,-0.3 -1,-0.1 -124,-0.1 3,-0.1 -0.203 119.1 58.8 -44.7 136.2 27.9 9.0 72.3 320 319 A G T 3 S+ 0 0 54 1,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.099 77.4 141.7 112.1 -16.6 26.5 11.4 74.9 321 320 A F X - 0 0 21 -3,-1.3 3,-2.6 -4,-0.2 -1,-0.3 -0.098 67.9 -79.3 -53.8 153.7 27.4 9.0 77.7 322 321 A D T 3 S+ 0 0 121 1,-0.3 -1,-0.2 -3,-0.1 3,-0.1 -0.428 120.8 17.9 -63.3 119.2 28.8 10.3 80.9 323 322 A G T > S+ 0 0 5 1,-0.3 3,-1.1 -2,-0.3 6,-0.7 0.279 87.1 145.3 101.0 -6.3 32.4 11.2 80.5 324 323 A Y T < + 0 0 84 -3,-2.6 -1,-0.3 1,-0.3 -196,-0.1 -0.275 68.6 21.9 -65.6 150.7 32.3 11.2 76.7 325 324 A H T 3 S+ 0 0 63 1,-0.2 -197,-2.7 -129,-0.2 2,-0.3 0.774 114.6 90.1 56.6 30.4 34.6 13.8 75.1 326 325 A T B X S-O 127 0F 11 -3,-1.1 3,-1.8 -199,-0.2 -1,-0.2 -0.940 95.6 -98.5-142.8 169.6 36.7 13.8 78.3 327 326 A S T 3 S+ 0 0 23 -201,-1.3 -3,-0.1 -2,-0.3 -2,-0.0 0.530 111.3 79.2 -65.1 -8.9 39.6 12.0 79.9 328 327 A A T 3 S+ 0 0 31 -5,-0.4 2,-2.4 1,-0.2 -1,-0.3 0.786 73.7 79.7 -69.1 -29.3 37.1 9.8 81.8 329 328 A D S < S+ 0 0 1 -3,-1.8 -135,-2.2 -6,-0.7 -1,-0.2 -0.454 77.5 133.8 -76.7 69.3 36.7 7.8 78.5 330 329 A N S >> S- 0 0 62 -2,-2.4 3,-1.7 -137,-0.2 4,-0.7 -0.393 74.0 -76.3-113.6-172.8 39.9 6.0 79.3 331 330 A L G >4 S+ 0 0 38 1,-0.3 3,-1.3 2,-0.2 -307,-0.1 0.880 125.8 55.8 -58.3 -41.8 41.3 2.4 79.3 332 331 A C G 34 S+ 0 0 128 1,-0.3 -1,-0.3 3,-0.0 -3,-0.1 0.656 98.8 64.1 -67.6 -12.6 39.5 1.4 82.5 333 332 A Y G <4 S+ 0 0 61 -3,-1.7 -76,-0.4 -5,-0.1 -1,-0.3 0.739 85.3 88.6 -81.5 -25.1 36.3 2.5 80.9 334 333 A X << - 0 0 16 -3,-1.3 2,-0.4 -4,-0.7 -78,-0.2 -0.510 67.3-158.4 -66.8 139.0 36.7 -0.3 78.3 335 334 A N > - 0 0 53 -80,-2.9 4,-2.5 -2,-0.2 3,-0.3 -0.994 13.2-145.6-124.8 125.8 35.2 -3.6 79.5 336 335 A K H > S+ 0 0 110 -2,-0.4 4,-3.2 1,-0.2 5,-0.1 0.871 101.6 49.5 -62.6 -37.2 36.5 -6.9 77.9 337 336 A D H > S+ 0 0 115 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.800 110.2 52.7 -70.8 -30.0 33.1 -8.6 78.0 338 337 A G H > S+ 0 0 3 -3,-0.3 4,-2.8 -83,-0.3 -2,-0.2 0.931 112.4 42.9 -68.6 -49.8 31.6 -5.6 76.4 339 338 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 -84,-0.5 -2,-0.2 0.946 115.4 50.6 -60.6 -46.7 34.0 -5.7 73.6 340 339 A A H X S+ 0 0 6 -4,-3.2 4,-2.5 -5,-0.2 -2,-0.2 0.915 112.9 46.6 -54.8 -45.6 33.6 -9.4 73.4 341 340 A D H X S+ 0 0 26 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.885 110.4 50.4 -70.5 -41.9 29.8 -9.0 73.3 342 341 A S H X S+ 0 0 4 -4,-2.8 4,-2.3 -88,-0.3 -1,-0.2 0.914 113.1 47.7 -60.0 -40.2 29.8 -6.3 70.7 343 342 A Y H X S+ 0 0 4 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.940 111.3 49.5 -66.9 -47.2 32.1 -8.4 68.5 344 343 A K H X S+ 0 0 75 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.903 111.9 50.1 -54.1 -43.0 29.9 -11.5 68.9 345 344 A T H X S+ 0 0 5 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.928 109.4 49.2 -68.6 -43.6 26.8 -9.4 68.0 346 345 A Y H X S+ 0 0 2 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.923 111.6 50.1 -59.8 -44.8 28.4 -8.0 64.9 347 346 A L H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 -1,-0.2 0.881 110.4 50.0 -62.1 -37.1 29.4 -11.5 63.8 348 347 A E H X S+ 0 0 32 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.869 109.3 51.8 -68.9 -38.5 25.8 -12.8 64.5 349 348 A V H X S+ 0 0 1 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.949 112.1 46.2 -57.4 -47.9 24.5 -9.9 62.4 350 349 A I H X S+ 0 0 4 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.902 109.7 53.2 -66.8 -44.0 26.9 -10.9 59.6 351 350 A Y H X S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.901 111.7 47.5 -53.5 -41.9 25.9 -14.6 59.9 352 351 A T H X S+ 0 0 1 -4,-2.2 4,-0.7 2,-0.2 -2,-0.2 0.928 110.3 50.9 -68.6 -44.2 22.3 -13.5 59.5 353 352 A I H >< S+ 0 0 3 -4,-2.6 3,-0.7 1,-0.2 -2,-0.2 0.931 114.3 44.9 -55.2 -47.4 23.0 -11.3 56.5 354 353 A E H 3< S+ 0 0 2 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.863 117.6 41.3 -69.2 -39.9 24.8 -14.1 54.8 355 354 A N H 3< S+ 0 0 14 -4,-2.1 2,-2.1 -5,-0.2 -1,-0.2 0.242 76.8 115.2 -95.7 11.5 22.3 -16.9 55.6 356 355 A N << + 0 0 18 -4,-0.7 -1,-0.1 -3,-0.7 -4,-0.1 -0.441 48.2 163.7 -80.4 70.1 19.0 -14.9 54.9 357 356 A R - 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