==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 15-DEC-01 1GRQ . COMPND 2 MOLECULE: CHLORAMPHENICOL 3-O PHOSPHOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES VENEZUELAE; . AUTHOR T.IZARD . 178 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8969.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 134 75.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 2.2 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 15 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 36.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 1 0 1 0 1 0 3 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 1 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 . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 M 0 0 171 0, 0.0 176,-0.2 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 -6.0 7.9 31.1 57.8 2 2 A T - 0 0 48 176,-0.1 111,-0.2 1,-0.1 2,-0.2 -0.500 360.0-105.4 -67.9 130.9 5.4 31.4 54.9 3 3 A T + 0 0 3 174,-2.3 111,-0.2 -2,-0.2 3,-0.1 -0.391 39.8 175.5 -63.7 125.0 6.7 33.8 52.3 4 4 A R + 0 0 86 109,-2.7 85,-1.9 1,-0.3 2,-0.4 0.787 64.7 21.4-100.4 -34.6 4.9 37.2 52.2 5 5 A M E -ab 89 114A 0 108,-1.8 110,-2.4 83,-0.2 2,-0.5 -0.992 57.7-155.5-144.0 130.6 6.8 39.2 49.6 6 6 A I E -ab 90 115A 0 83,-2.2 85,-2.4 -2,-0.4 2,-0.5 -0.908 15.4-165.9-103.2 127.6 9.1 38.3 46.7 7 7 A I E -ab 91 116A 1 108,-3.1 110,-1.8 -2,-0.5 2,-0.3 -0.892 2.8-169.8-123.4 107.5 11.6 41.1 45.7 8 8 A L E -ab 92 117A 0 83,-2.2 85,-2.6 -2,-0.5 2,-0.4 -0.712 1.4-171.4 -93.8 139.1 13.5 40.9 42.4 9 9 A N E +ab 93 118A 0 108,-1.4 110,-2.8 -2,-0.3 2,-0.3 -0.991 22.1 133.5-129.0 137.6 16.4 43.2 41.6 10 10 A G E - b 0 119A 0 83,-1.2 110,-0.1 -2,-0.4 3,-0.1 -0.965 51.0 -88.3-174.6 160.1 18.0 43.5 38.2 11 11 A G > - 0 0 1 108,-0.5 3,-1.4 -2,-0.3 5,-0.4 -0.112 63.9 -72.4 -69.1 174.6 19.2 45.8 35.5 12 12 A S T 3 S+ 0 0 17 1,-0.3 -1,-0.2 128,-0.2 118,-0.1 -0.448 120.7 12.5 -69.9 143.4 17.0 47.0 32.7 13 13 A S T 3 S+ 0 0 6 -2,-0.1 -1,-0.3 1,-0.1 116,-0.1 0.576 87.2 126.8 65.0 10.1 16.1 44.4 30.1 14 14 A A S < S- 0 0 4 -3,-1.4 146,-0.3 105,-0.1 -2,-0.1 0.659 87.7-102.8 -70.1 -14.1 17.5 41.8 32.5 15 15 A G S > S+ 0 0 17 -4,-0.2 4,-1.3 -5,-0.1 3,-0.2 0.490 77.0 138.0 106.7 6.0 14.1 40.0 32.1 16 16 A K H >> + 0 0 15 -5,-0.4 4,-2.4 1,-0.2 3,-0.6 0.890 67.9 53.0 -50.2 -54.0 12.4 40.9 35.3 17 17 A S H 3> S+ 0 0 40 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.909 108.9 49.8 -51.6 -48.4 8.9 41.7 34.0 18 18 A G H 3> S+ 0 0 23 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.775 110.0 50.2 -63.7 -29.7 8.6 38.4 32.1 19 19 A I H - 0 0 6 -2,-0.2 4,-0.8 56,-0.2 58,-0.2 -0.202 49.4 -97.6 -87.4-174.2 7.3 47.1 40.0 36 36 A V H > S+ 0 0 26 56,-1.7 4,-2.2 1,-0.2 5,-0.1 0.723 122.7 62.2 -73.2 -21.9 9.1 50.4 39.9 37 37 A D H > S+ 0 0 96 55,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.910 100.1 51.0 -69.8 -42.1 7.5 50.9 36.5 38 38 A S H > S+ 0 0 47 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.779 109.6 52.5 -66.4 -24.5 4.0 50.9 38.0 39 39 A L H >X S+ 0 0 9 -4,-0.8 3,-0.9 2,-0.2 4,-0.9 0.956 105.5 52.3 -72.7 -52.8 5.2 53.5 40.5 40 40 A I H >< S+ 0 0 27 -4,-2.2 3,-0.6 1,-0.3 -2,-0.2 0.857 110.1 52.2 -48.7 -38.1 6.5 55.8 37.8 41 41 A E H 3< S+ 0 0 164 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.815 103.2 55.3 -70.9 -32.2 3.1 55.4 36.2 42 42 A A H << S+ 0 0 86 -4,-1.0 -1,-0.2 -3,-0.9 -2,-0.2 0.589 96.4 85.6 -78.9 -8.0 1.3 56.4 39.3 43 43 A M S << S- 0 0 19 -4,-0.9 5,-0.1 -3,-0.6 25,-0.0 -0.586 94.2 -91.6 -91.9 155.1 3.3 59.6 39.5 44 44 A P > - 0 0 64 0, 0.0 3,-0.7 0, 0.0 4,-0.2 -0.342 32.8-121.6 -63.6 144.9 2.3 62.9 37.6 45 45 A L G > S+ 0 0 138 1,-0.3 3,-1.9 2,-0.2 -2,-0.0 0.845 113.1 57.2 -56.1 -37.0 3.9 63.2 34.2 46 46 A K G >> S+ 0 0 165 1,-0.3 4,-1.8 2,-0.2 3,-1.7 0.858 92.6 67.9 -61.6 -36.0 5.6 66.4 35.2 47 47 A M G <4 S+ 0 0 23 -3,-0.7 -1,-0.3 1,-0.3 -2,-0.2 0.631 88.5 76.0 -56.8 -11.6 7.2 64.6 38.0 48 48 A Q G <4 S- 0 0 76 -3,-1.9 8,-0.3 -4,-0.2 -1,-0.3 0.388 116.8 -2.8 -89.5 3.7 9.1 62.9 35.1 49 49 A S T <4 S+ 0 0 81 -3,-1.7 2,-0.8 1,-0.2 -2,-0.2 0.305 99.7 102.9-159.5 -34.4 11.6 65.6 34.1 50 50 A A S >< S- 0 0 60 -4,-1.8 3,-1.5 1,-0.1 -1,-0.2 -0.541 90.7-101.9 -60.2 106.4 11.0 68.5 36.2 51 51 A E T 3 S+ 0 0 113 -2,-0.8 3,-0.1 1,-0.3 -1,-0.1 0.140 108.6 55.2 -36.5 144.3 13.9 68.0 38.6 52 52 A G T 3 S+ 0 0 13 1,-0.2 16,-2.6 -3,-0.1 17,-0.3 -0.272 105.5 66.7 114.4 -36.4 13.2 66.6 41.9 53 53 A G S < S- 0 0 1 -3,-1.5 -1,-0.2 14,-0.2 10,-0.1 -0.888 106.9 -59.7-116.3 147.4 11.6 63.6 40.1 54 54 A I - 0 0 11 -2,-0.3 2,-0.3 11,-0.2 10,-0.2 0.343 50.0-167.9 -24.8 139.1 13.4 61.0 37.9 55 55 A E E -E 63 0B 68 8,-1.7 8,-1.2 -3,-0.1 2,-0.7 -0.962 12.0-145.6-142.6 122.2 15.3 62.1 34.7 56 56 A F E -E 62 0B 68 -2,-0.3 6,-0.2 -8,-0.3 4,-0.1 -0.746 14.5-143.6 -92.3 113.5 16.8 60.0 31.9 57 57 A D E >> -E 61 0B 63 4,-2.1 3,-1.4 -2,-0.7 4,-0.5 -0.351 27.6-112.3 -68.3 152.9 20.1 61.1 30.3 58 58 A A T 34 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.2 80,-0.1 0.640 115.3 64.4 -61.4 -13.6 20.4 60.6 26.5 59 59 A D T 34 S- 0 0 93 80,-0.1 -1,-0.3 78,-0.1 -2,-0.1 0.033 129.5 -90.3 -99.6 27.2 23.1 58.0 27.3 60 60 A G T <4 S+ 0 0 2 -3,-1.4 2,-0.2 1,-0.2 -2,-0.2 0.708 81.6 148.4 74.6 20.0 20.7 55.7 29.1 61 61 A G E < -E 57 0B 4 -4,-0.5 -4,-2.1 82,-0.0 2,-0.4 -0.602 30.9-160.2 -90.8 150.0 21.5 57.4 32.5 62 62 A V E -E 56 0B 38 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.993 8.1-178.0-132.6 134.0 19.0 57.7 35.4 63 63 A S E -E 55 0B 55 -8,-1.2 -8,-1.7 -2,-0.4 2,-0.5 -0.996 12.4-151.2-133.0 137.1 19.1 60.1 38.3 64 64 A I - 0 0 54 -2,-0.4 -11,-0.1 -10,-0.2 -13,-0.0 -0.925 9.5-159.4-113.3 123.3 16.6 60.3 41.3 65 65 A G > - 0 0 18 -2,-0.5 4,-1.9 -13,-0.1 -11,-0.2 -0.236 34.3-100.8 -88.0-178.2 15.8 63.5 43.2 66 66 A P H > S+ 0 0 81 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.839 117.8 61.2 -72.6 -35.9 14.3 63.9 46.7 67 67 A E H > S+ 0 0 120 -15,-0.3 4,-1.6 1,-0.2 -14,-0.2 0.970 111.4 41.7 -52.8 -52.8 10.8 64.7 45.5 68 68 A F H > S+ 0 0 4 -16,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.914 111.2 55.1 -59.5 -48.6 10.8 61.2 43.9 69 69 A R H X S+ 0 0 108 -4,-1.9 4,-1.8 -17,-0.3 -1,-0.2 0.860 106.2 52.2 -57.0 -37.5 12.5 59.6 46.9 70 70 A A H X S+ 0 0 71 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.925 111.6 45.1 -65.6 -45.3 9.8 60.8 49.3 71 71 A L H X S+ 0 0 80 -4,-1.6 4,-2.3 -5,-0.2 -2,-0.2 0.922 110.6 54.9 -63.8 -44.3 7.0 59.4 47.1 72 72 A E H X S+ 0 0 34 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.861 105.1 54.3 -57.8 -37.5 8.8 56.2 46.7 73 73 A G H X S+ 0 0 6 -4,-1.8 4,-2.2 -5,-0.2 -1,-0.2 0.946 108.2 46.8 -63.1 -48.5 9.1 55.8 50.4 74 74 A A H X S+ 0 0 65 -4,-1.7 4,-1.3 1,-0.2 -2,-0.2 0.898 113.1 50.6 -60.1 -40.7 5.4 56.2 51.0 75 75 A W H X S+ 0 0 48 -4,-2.3 4,-2.1 2,-0.2 3,-0.5 0.930 106.3 54.8 -62.2 -47.6 4.7 53.7 48.2 76 76 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.3 5,-0.2 0.932 108.3 48.8 -51.6 -50.7 7.1 51.2 49.7 77 77 A E H X S+ 0 0 120 -4,-2.2 4,-1.8 1,-0.2 -1,-0.3 0.789 108.4 56.3 -61.7 -28.5 5.3 51.3 53.0 78 78 A G H X S+ 0 0 31 -4,-1.3 4,-1.0 -3,-0.5 -1,-0.2 0.911 107.9 44.3 -71.3 -44.0 2.0 50.8 51.2 79 79 A V H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 3,-0.3 0.891 113.2 51.8 -68.4 -38.3 3.0 47.6 49.5 80 80 A V H X S+ 0 0 7 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.923 108.3 52.5 -61.4 -42.7 4.5 46.3 52.7 81 81 A A H X S+ 0 0 56 -4,-1.8 4,-1.2 1,-0.2 -1,-0.2 0.756 105.2 55.7 -62.7 -27.7 1.2 47.1 54.4 82 82 A M H <>S+ 0 0 68 -4,-1.0 5,-2.6 -3,-0.3 -1,-0.2 0.899 109.4 45.5 -71.5 -42.0 -0.6 45.1 51.7 83 83 A A H ><5S+ 0 0 0 -4,-1.9 3,-2.9 1,-0.2 -2,-0.2 0.968 112.1 50.9 -62.2 -53.8 1.5 42.1 52.5 84 84 A R H 3<5S+ 0 0 108 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.794 105.6 57.8 -54.4 -30.4 0.9 42.6 56.2 85 85 A A T 3<5S- 0 0 87 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.485 131.2 -94.2 -80.0 -4.3 -2.8 42.8 55.4 86 86 A G T < 5S+ 0 0 49 -3,-2.9 -3,-0.2 1,-0.4 2,-0.2 0.456 82.9 128.4 108.6 -1.5 -2.5 39.3 53.9 87 87 A A < - 0 0 35 -5,-2.6 2,-0.6 -6,-0.1 -1,-0.4 -0.576 59.2-121.6 -86.3 154.1 -1.9 39.9 50.2 88 88 A R E - c 0 31A 53 -58,-0.5 -56,-3.2 -2,-0.2 2,-0.5 -0.859 33.3-159.4 -96.0 122.5 1.0 38.2 48.4 89 89 A I E -ac 5 32A 0 -85,-1.9 -83,-2.2 -2,-0.6 2,-0.4 -0.891 17.4-172.1-116.6 122.7 3.3 40.8 46.9 90 90 A I E -ac 6 33A 0 -58,-3.5 -56,-1.9 -2,-0.5 2,-0.4 -0.854 13.8-174.4-101.6 140.3 5.9 40.5 44.1 91 91 A I E -a 7 0A 0 -85,-2.4 -83,-2.2 -2,-0.4 2,-0.6 -0.966 12.5-167.9-141.1 121.5 8.1 43.5 43.5 92 92 A D E +a 8 0A 11 -2,-0.4 -56,-1.7 -85,-0.2 -55,-0.3 -0.941 23.2 159.6-109.6 122.4 10.6 44.1 40.8 93 93 A D E -a 9 0A 18 -85,-2.6 -83,-1.2 -2,-0.6 2,-0.4 -0.703 40.7-121.2-129.8 179.4 12.9 47.1 41.3 94 94 A V - 0 0 28 -2,-0.2 2,-2.6 -85,-0.2 3,-0.2 -0.843 20.0-148.1-129.3 92.8 16.3 48.3 40.0 95 95 A F > + 0 0 1 -2,-0.4 3,-2.1 1,-0.2 6,-0.1 -0.320 26.1 169.7 -63.0 75.2 18.7 48.8 43.0 96 96 A L T 3 S+ 0 0 77 -2,-2.6 -1,-0.2 1,-0.3 3,-0.1 0.830 78.4 50.7 -57.3 -31.5 20.7 51.6 41.4 97 97 A G T > S- 0 0 45 1,-0.3 3,-1.7 -3,-0.2 4,-0.4 0.067 97.4-148.3 -95.9 26.1 22.3 52.1 44.8 98 98 A G T X> S+ 0 0 6 -3,-2.1 4,-1.4 1,-0.3 3,-0.7 -0.154 77.4 1.3 47.3-128.4 23.4 48.5 45.2 99 99 A A H 3> S+ 0 0 34 51,-1.4 4,-2.7 1,-0.2 -1,-0.3 0.832 129.2 64.8 -57.0 -36.1 23.4 47.5 48.9 100 100 A A H <> S+ 0 0 67 -3,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.910 103.0 47.9 -53.3 -45.7 22.2 51.0 49.9 101 101 A A H <> S+ 0 0 19 -3,-0.7 4,-1.9 -4,-0.4 -1,-0.2 0.873 110.8 50.8 -63.7 -40.1 18.9 50.4 48.1 102 102 A Q H X S+ 0 0 1 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.872 109.3 50.4 -66.8 -37.9 18.5 47.0 49.7 103 103 A E H X S+ 0 0 105 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.928 108.0 53.8 -63.6 -43.7 19.1 48.5 53.2 104 104 A R H X S+ 0 0 76 -4,-2.3 4,-0.7 1,-0.2 -2,-0.2 0.877 111.5 45.4 -57.3 -40.9 16.4 51.1 52.3 105 105 A W H >X S+ 0 0 5 -4,-1.9 4,-2.7 1,-0.2 3,-0.7 0.873 108.1 56.5 -71.6 -38.0 14.0 48.2 51.4 106 106 A R H 3X S+ 0 0 82 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.879 100.7 58.8 -60.9 -38.1 14.9 46.3 54.6 107 107 A S H 3< S+ 0 0 86 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.801 113.1 39.0 -62.3 -29.0 14.0 49.3 56.7 108 108 A F H << S+ 0 0 45 -4,-0.7 -2,-0.2 -3,-0.7 -1,-0.2 0.870 112.3 53.7 -87.4 -42.8 10.4 49.2 55.2 109 109 A V H >< S+ 0 0 4 -4,-2.7 3,-1.3 1,-0.2 2,-0.4 0.843 80.8 176.8 -61.9 -35.3 10.0 45.4 55.1 110 110 A G T 3< - 0 0 54 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.1 -0.519 66.7 -19.3 70.4-121.8 10.8 45.1 58.8 111 111 A D T 3 S+ 0 0 141 -2,-0.4 -1,-0.2 2,-0.1 2,-0.1 0.023 97.8 134.9-108.8 22.7 10.4 41.5 60.0 112 112 A L < - 0 0 19 -3,-1.3 2,-0.9 1,-0.1 -109,-0.1 -0.456 68.3-103.2 -74.3 146.5 8.2 40.4 57.1 113 113 A D + 0 0 55 -111,-0.2 -109,-2.7 -2,-0.1 -108,-1.8 -0.609 54.1 177.0 -74.8 106.1 9.1 37.1 55.4 114 114 A V E -b 5 0A 17 -2,-0.9 2,-0.6 -110,-0.2 -108,-0.2 -0.844 30.2-147.7-116.9 147.3 10.8 38.1 52.2 115 115 A L E -b 6 0A 9 -110,-2.4 -108,-3.1 -2,-0.3 2,-1.0 -0.950 16.4-152.5-111.0 112.9 12.5 36.3 49.3 116 116 A W E -b 7 0A 18 -2,-0.6 39,-3.4 -110,-0.2 40,-1.6 -0.761 18.0-172.9 -90.9 103.1 15.4 38.3 47.9 117 117 A V E -bd 8 156A 0 -110,-1.8 -108,-1.4 -2,-1.0 2,-0.5 -0.729 11.4-155.2 -96.7 143.6 15.7 37.3 44.2 118 118 A G E -bd 9 157A 0 38,-1.3 40,-2.8 -2,-0.3 2,-0.7 -0.976 3.0-161.2-119.7 123.0 18.6 38.5 42.0 119 119 A V E -bd 10 158A 0 -110,-2.8 -108,-0.5 -2,-0.5 2,-0.3 -0.896 15.3-175.6-108.4 109.0 18.0 38.6 38.2 120 120 A R E + d 0 159A 76 38,-2.7 40,-3.0 -2,-0.7 41,-0.3 -0.707 9.0 168.0-103.5 153.6 21.3 38.6 36.3 121 121 A C - 0 0 7 24,-0.4 -110,-0.1 -2,-0.3 2,-0.1 -0.950 44.0 -90.6-161.6 142.9 21.9 39.0 32.6 122 122 A D > - 0 0 65 -2,-0.3 4,-3.8 1,-0.1 5,-0.3 -0.353 34.0-132.2 -58.5 128.1 24.9 39.7 30.4 123 123 A G H > S+ 0 0 4 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.869 107.2 42.9 -48.6 -47.2 25.3 43.4 29.8 124 124 A A H > S+ 0 0 69 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.895 116.5 48.2 -68.7 -40.5 25.8 43.0 26.0 125 125 A V H > S+ 0 0 52 1,-0.2 4,-1.5 2,-0.2 3,-0.3 0.902 111.0 50.7 -66.6 -40.1 23.0 40.4 25.8 126 126 A A H X S+ 0 0 2 -4,-3.8 4,-1.9 1,-0.2 -1,-0.2 0.851 107.6 54.0 -65.8 -34.2 20.6 42.7 27.8 127 127 A E H X S+ 0 0 88 -4,-1.7 4,-1.3 -5,-0.3 -1,-0.2 0.777 104.8 54.0 -70.7 -26.9 21.4 45.6 25.5 128 128 A G H X S+ 0 0 42 -4,-1.1 4,-1.7 -3,-0.3 -1,-0.2 0.880 109.4 47.9 -73.8 -36.6 20.4 43.5 22.5 129 129 A R H X S+ 0 0 91 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.859 104.2 60.1 -69.9 -35.8 17.1 42.8 24.1 130 130 A E H X>S+ 0 0 4 -4,-1.9 5,-1.6 1,-0.2 4,-0.6 0.901 108.4 46.5 -57.3 -39.3 16.7 46.4 24.9 131 131 A T H <5S+ 0 0 108 -4,-1.3 3,-0.4 1,-0.2 -1,-0.2 0.866 111.4 49.4 -71.1 -38.4 16.9 47.0 21.2 132 132 A A H <5S+ 0 0 90 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.747 107.4 55.8 -74.6 -23.2 14.5 44.2 20.3 133 133 A R H <5S- 0 0 137 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.658 109.6-121.2 -83.6 -15.5 11.9 45.4 22.8 134 134 A G T <5 + 0 0 59 -4,-0.6 -3,-0.2 -3,-0.4 -2,-0.1 0.712 45.9 175.1 83.8 19.0 11.8 48.9 21.3 135 135 A D < - 0 0 44 -5,-1.6 -1,-0.2 -6,-0.2 3,-0.2 -0.237 24.6-146.5 -56.1 148.6 12.9 50.7 24.5 136 136 A R S S+ 0 0 241 1,-0.2 2,-2.0 2,-0.0 -1,-0.1 0.954 84.2 60.9 -84.2 -61.0 13.4 54.4 24.0 137 137 A V S > S- 0 0 45 2,-0.1 3,-1.0 -77,-0.0 -1,-0.2 -0.483 77.6-166.8 -72.3 84.5 16.3 55.2 26.4 138 138 A A T 3 + 0 0 59 -2,-2.0 -11,-0.0 1,-0.2 -2,-0.0 -0.436 63.4 50.8 -70.6 145.2 18.9 53.0 24.9 139 139 A G T 3> S+ 0 0 16 -79,-0.1 4,-1.9 -2,-0.1 -1,-0.2 0.085 79.2 94.6 115.8 -24.9 22.0 52.5 27.0 140 140 A M H <> S+ 0 0 17 -3,-1.0 4,-2.7 2,-0.2 5,-0.4 0.951 76.1 60.6 -64.7 -53.1 20.4 51.5 30.3 141 141 A A H > S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.898 112.9 38.5 -40.3 -55.7 20.6 47.8 29.9 142 142 A A H 4 S+ 0 0 40 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.921 114.6 53.9 -65.5 -44.6 24.4 47.9 29.7 143 143 A K H < S+ 0 0 96 -4,-1.9 4,-0.3 1,-0.2 -1,-0.2 0.804 119.0 33.4 -61.6 -30.3 24.8 50.6 32.3 144 144 A Q H X S+ 0 0 16 -4,-2.7 4,-1.1 -3,-0.1 -1,-0.2 0.608 86.5 100.6-103.1 -13.1 22.8 48.7 35.0 145 145 A A T < S+ 0 0 6 -4,-1.6 -24,-0.4 -5,-0.4 -134,-0.3 0.736 102.0 9.3 -44.3 -34.9 23.7 45.1 34.2 146 146 A Y T >> S+ 0 0 129 -4,-0.4 3,-1.6 -3,-0.2 4,-0.5 0.779 116.7 63.3-118.8 -42.0 26.3 44.7 36.9 147 147 A V G >4 S+ 0 0 65 -4,-0.3 3,-1.4 1,-0.3 -2,-0.1 0.852 91.1 68.3 -55.8 -40.4 26.4 47.7 39.4 148 148 A V G 3< S+ 0 0 0 -4,-1.1 -1,-0.3 1,-0.3 -53,-0.2 0.638 102.1 48.9 -56.9 -14.5 22.8 47.2 40.7 149 149 A H G X4 S+ 0 0 7 -3,-1.6 3,-2.7 -5,-0.2 -1,-0.3 0.607 76.4 127.0-100.5 -16.8 24.0 43.9 42.3 150 150 A E T << S- 0 0 128 -3,-1.4 -51,-1.4 -4,-0.5 3,-0.1 -0.234 90.4 -7.9 -51.8 111.9 27.1 45.2 44.1 151 151 A G T 3 S+ 0 0 60 1,-0.3 2,-0.4 -53,-0.2 -1,-0.3 0.555 99.3 136.9 78.4 9.8 26.9 44.3 47.8 152 152 A V < - 0 0 16 -3,-2.7 2,-0.5 -57,-0.0 -1,-0.3 -0.773 46.0-143.3 -93.3 131.5 23.4 43.0 47.5 153 153 A E - 0 0 119 -2,-0.4 2,-0.2 -3,-0.1 -3,-0.0 -0.840 18.9-169.5 -98.5 123.0 22.5 39.8 49.2 154 154 A Y - 0 0 31 -2,-0.5 -37,-0.2 1,-0.1 3,-0.1 -0.701 29.4-154.4-110.3 161.7 20.1 37.4 47.6 155 155 A D S S+ 0 0 93 -39,-3.4 2,-0.3 1,-0.3 -38,-0.2 0.558 92.9 16.3-101.2 -19.1 18.3 34.2 48.7 156 156 A V E -d 117 0A 14 -40,-1.6 -38,-1.3 2,-0.0 2,-0.4 -0.975 67.0-161.4-150.2 152.7 18.1 33.1 45.1 157 157 A E E -d 118 0A 111 -2,-0.3 2,-0.3 -40,-0.2 -38,-0.2 -0.975 7.4-178.1-143.2 124.9 19.9 34.1 41.9 158 158 A V E -d 119 0A 8 -40,-2.8 -38,-2.7 -2,-0.4 2,-0.5 -0.863 14.2-151.2-118.5 154.6 18.8 33.4 38.4 159 159 A D E >> -d 120 0A 75 -2,-0.3 4,-0.6 -40,-0.2 3,-0.5 -0.983 4.6-167.5-128.7 116.5 20.6 34.4 35.2 160 160 A T T 34 + 0 0 3 -40,-3.0 -39,-0.2 -2,-0.5 5,-0.1 0.291 67.1 95.9 -87.2 9.8 18.5 35.0 32.1 161 161 A T T 34 S+ 0 0 21 -41,-0.3 -1,-0.2 1,-0.2 -40,-0.1 0.921 110.2 2.7 -65.4 -43.1 21.4 35.0 29.8 162 162 A H T <4 S+ 0 0 178 -3,-0.5 2,-0.4 2,-0.1 -1,-0.2 0.379 120.4 79.0-124.1 0.7 20.9 31.3 28.9 163 163 A K S < S- 0 0 94 -4,-0.6 -5,-0.0 1,-0.0 5,-0.0 -0.908 75.9-121.1-113.5 142.4 17.8 30.4 30.8 164 164 A E > - 0 0 132 -2,-0.4 4,-2.0 1,-0.1 5,-0.2 -0.221 24.6-112.1 -71.9 165.5 14.2 31.2 29.7 165 165 A S H > S+ 0 0 39 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.951 117.4 53.7 -64.0 -50.9 11.8 33.3 31.9 166 166 A I H > S+ 0 0 64 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.815 111.0 49.9 -54.9 -29.6 9.4 30.4 32.6 167 167 A E H > S+ 0 0 73 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.886 108.5 48.2 -77.8 -41.4 12.5 28.5 33.8 168 168 A C H X S+ 0 0 0 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.800 108.7 58.0 -68.0 -26.0 13.8 31.2 36.1 169 169 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.880 105.2 49.6 -69.3 -38.1 10.3 31.4 37.4 170 170 A W H X S+ 0 0 142 -4,-1.1 4,-1.7 2,-0.2 -2,-0.2 0.896 109.0 50.6 -67.7 -42.1 10.4 27.7 38.3 171 171 A A H < S+ 0 0 32 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.858 115.8 44.1 -64.1 -33.8 13.7 28.0 40.2 172 172 A I H >< S+ 0 0 0 -4,-1.5 3,-1.9 -5,-0.2 -2,-0.2 0.893 107.6 55.9 -77.7 -43.0 12.3 31.0 42.1 173 173 A A H >< S+ 0 0 20 -4,-2.7 3,-2.4 1,-0.3 -2,-0.2 0.885 97.3 66.1 -58.0 -38.2 8.9 29.4 42.9 174 174 A A T 3< S+ 0 0 85 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.585 98.9 53.0 -60.8 -11.0 10.7 26.4 44.5 175 175 A H T < S+ 0 0 98 -3,-1.9 2,-0.7 -4,-0.1 -1,-0.3 0.288 83.8 106.3-106.9 9.4 12.0 28.8 47.2 176 176 A V < - 0 0 23 -3,-2.4 -174,-0.1 -4,-0.1 -170,-0.0 -0.807 61.6-148.6 -94.3 112.6 8.5 30.1 48.1 177 177 A V 0 0 43 -2,-0.7 -174,-2.3 -176,-0.2 -2,-0.1 -0.700 360.0 360.0 -81.2 117.5 7.2 28.8 51.5 178 178 A P 0 0 133 0, 0.0 -1,-0.2 0, 0.0 -176,-0.1 0.913 360.0 360.0 -67.1 360.0 3.4 28.5 51.2