==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 17-MAY-12 4F84 . COMPND 2 MOLECULE: GERANYL DIPHOSPHATE 2-C-METHYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES LASALIENSIS; . AUTHOR O.ARIYAWUTTHIPHAN,T.OSE,A.MINAMI,Y.G.GAO,M.YAO,H.OIKAWA,I.TA . 248 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11026.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 176 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 10.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 7.7 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 . 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 . 1 0.4 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 . 13 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 33.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 1 0 0 0 0 0 4 2 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 0 2 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 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 . 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 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 53 A G 0 0 77 0, 0.0 4,-0.1 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0-176.9 35.3 47.2 31.1 2 54 A L - 0 0 124 2,-0.2 3,-0.1 28,-0.1 28,-0.0 0.822 360.0 -15.8 -91.3 -38.4 33.6 46.2 34.4 3 55 A Y S S+ 0 0 32 1,-0.5 61,-0.4 3,-0.1 63,-0.3 0.468 129.3 50.2-128.4 -74.2 36.0 43.6 35.7 4 56 A H - 0 0 4 1,-0.1 -1,-0.5 62,-0.1 -2,-0.2 -0.483 62.5-158.8 -70.9 139.3 38.5 42.4 33.1 5 57 A H + 0 0 56 -2,-0.2 -1,-0.1 57,-0.1 58,-0.1 0.573 67.5 84.2 -94.1 -12.6 40.1 45.3 31.2 6 58 A H S S- 0 0 0 1,-0.1 2,-0.2 31,-0.1 -3,-0.1 -0.125 82.1-103.8 -81.8-178.5 41.0 43.1 28.3 7 59 A Y - 0 0 23 30,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.548 35.0-119.7-102.4 169.9 38.9 42.1 25.2 8 60 A G - 0 0 0 201,-0.2 2,-0.3 -2,-0.2 29,-0.3 -0.498 12.2-150.6-111.2 178.6 37.2 38.8 24.6 9 61 A I + 0 0 20 27,-1.6 200,-0.2 -2,-0.2 30,-0.1 -0.991 44.9 61.7-144.5 151.5 37.0 35.8 22.1 10 62 A G S S- 0 0 24 198,-2.3 202,-0.1 -2,-0.3 2,-0.1 -0.268 82.1 -51.9 115.8 156.8 34.4 33.4 21.0 11 63 A A - 0 0 82 -2,-0.1 2,-0.2 1,-0.1 -2,-0.1 -0.370 60.8-111.1 -64.7 138.5 31.0 33.3 19.2 12 64 A V - 0 0 20 1,-0.1 2,-1.4 -2,-0.1 3,-0.2 -0.468 18.3-128.5 -73.4 140.6 28.3 35.6 20.7 13 65 A D > + 0 0 67 1,-0.2 4,-0.9 -2,-0.2 3,-0.4 -0.680 34.1 172.5 -89.3 81.6 25.4 33.9 22.5 14 66 A H H > S+ 0 0 140 -2,-1.4 4,-1.1 1,-0.2 -1,-0.2 0.799 72.5 63.4 -62.0 -29.3 22.6 35.7 20.6 15 67 A A H >4 S+ 0 0 89 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.931 104.6 44.9 -61.2 -46.1 20.0 33.5 22.2 16 68 A A H 34 S+ 0 0 52 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.693 104.9 64.9 -71.5 -18.2 20.9 34.9 25.7 17 69 A L H 3< S+ 0 0 6 -4,-0.9 -1,-0.2 -3,-0.2 -2,-0.2 0.786 84.3 174.0 -73.9 -28.9 20.9 38.4 24.3 18 70 A G << - 0 0 41 -4,-1.1 -1,-0.1 -3,-0.7 -2,-0.1 -0.091 44.5 -1.4 58.9-151.8 17.2 38.2 23.5 19 71 A D > - 0 0 103 1,-0.1 3,-2.4 -4,-0.1 6,-0.1 -0.598 53.2-148.6 -78.0 120.3 15.1 41.1 22.2 20 72 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.456 98.4 68.9 -66.5 5.2 17.1 44.4 21.8 21 73 A G T 3 S+ 0 0 61 4,-0.1 -3,-0.1 3,-0.0 -2,-0.0 0.632 77.1 97.8 -95.5 -19.2 13.7 45.9 22.6 22 74 A D S X S- 0 0 87 -3,-2.4 3,-0.6 1,-0.1 4,-0.3 -0.261 77.9-131.6 -64.2 157.7 13.8 44.7 26.2 23 75 A G T > S+ 0 0 79 1,-0.2 3,-0.7 2,-0.1 4,-0.3 0.893 108.0 58.4 -76.6 -38.3 14.9 47.2 28.8 24 76 A G T 3> S+ 0 0 34 1,-0.2 4,-2.5 2,-0.1 -1,-0.2 0.312 80.1 92.4 -72.9 7.6 17.3 44.6 30.2 25 77 A Y H <> S+ 0 0 27 -3,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.967 81.1 52.6 -65.9 -54.4 19.0 44.1 26.8 26 78 A E H <> S+ 0 0 56 -3,-0.7 4,-1.1 -4,-0.3 -1,-0.2 0.733 114.2 46.8 -55.1 -20.3 21.8 46.7 27.5 27 79 A A H > S+ 0 0 63 -4,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.905 108.2 52.3 -85.5 -47.9 22.4 44.7 30.7 28 80 A R H X S+ 0 0 69 -4,-2.5 4,-1.1 1,-0.2 -2,-0.2 0.714 107.5 56.5 -59.8 -21.4 22.3 41.3 29.1 29 81 A L H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 3,-0.2 0.936 103.2 50.6 -76.6 -47.9 24.9 42.7 26.7 30 82 A I H X S+ 0 0 51 -4,-1.1 4,-2.3 1,-0.2 -2,-0.2 0.898 109.7 52.4 -55.5 -40.6 27.4 43.7 29.5 31 83 A A H X S+ 0 0 63 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.881 110.2 48.3 -63.4 -37.5 27.0 40.2 30.9 32 84 A E H X S+ 0 0 10 -4,-1.1 4,-2.2 -3,-0.2 -2,-0.2 0.909 108.5 52.5 -68.0 -45.6 27.8 38.7 27.4 33 85 A L H X S+ 0 0 23 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.922 110.0 50.3 -55.9 -45.4 30.9 41.0 27.0 34 86 A H H X S+ 0 0 73 -4,-2.3 4,-3.0 -5,-0.2 5,-0.3 0.926 107.1 53.7 -59.6 -46.5 32.1 39.7 30.4 35 87 A R H X S+ 0 0 101 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.896 110.3 46.7 -55.2 -44.5 31.6 36.1 29.3 36 88 A L H X S+ 0 0 1 -4,-2.2 -27,-1.6 2,-0.2 4,-1.5 0.857 112.9 49.9 -67.5 -35.7 33.7 36.6 26.2 37 89 A E H X S+ 0 0 9 -4,-2.1 4,-2.1 -29,-0.3 -2,-0.2 0.914 109.9 49.3 -70.2 -42.7 36.4 38.4 28.2 38 90 A S H X S+ 0 0 24 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.909 108.6 56.4 -61.4 -39.9 36.5 35.6 30.9 39 91 A A H X S+ 0 0 39 -4,-2.0 4,-1.6 -5,-0.3 -1,-0.2 0.857 107.1 46.6 -61.8 -37.1 36.8 33.2 28.0 40 92 A Q H X S+ 0 0 3 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.903 111.7 50.3 -75.2 -35.0 39.9 34.8 26.6 41 93 A A H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.873 109.7 51.9 -66.2 -34.4 41.6 35.1 30.0 42 94 A E H X S+ 0 0 78 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.877 109.1 51.7 -66.7 -36.7 40.8 31.4 30.4 43 95 A F H < S+ 0 0 58 -4,-1.6 4,-0.5 2,-0.2 -2,-0.2 0.856 105.8 52.5 -68.4 -36.9 42.4 30.9 27.0 44 96 A L H >< S+ 0 0 1 -4,-2.1 3,-1.1 1,-0.2 -1,-0.2 0.883 107.3 54.1 -66.6 -36.5 45.6 32.7 28.1 45 97 A L H >< S+ 0 0 1 -4,-1.8 3,-2.4 1,-0.3 4,-0.3 0.887 95.2 66.4 -63.9 -39.8 45.8 30.5 31.1 46 98 A D T 3< S+ 0 0 90 -4,-1.6 3,-0.4 1,-0.3 -1,-0.3 0.739 100.9 53.8 -53.6 -21.5 45.6 27.4 28.9 47 99 A H T < S+ 0 0 28 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.274 81.3 85.4 -99.9 11.7 49.1 28.5 27.6 48 100 A L S < S- 0 0 6 -3,-2.4 -1,-0.2 1,-0.3 -2,-0.1 0.485 89.2-135.0 -89.1 -1.2 50.9 28.9 31.0 49 101 A G - 0 0 29 -3,-0.4 2,-1.4 -4,-0.3 -1,-0.3 -0.367 55.5 -28.3 77.9-164.6 51.9 25.2 30.9 50 102 A P - 0 0 136 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.558 69.4-176.0 -89.4 78.6 51.5 23.1 34.0 51 103 A V - 0 0 13 -2,-1.4 26,-0.1 2,-0.0 -2,-0.1 -0.569 13.9-146.5 -75.2 130.7 52.0 25.6 36.9 52 104 A G > - 0 0 23 -2,-0.3 3,-2.3 24,-0.1 23,-0.1 -0.502 27.3 -98.7 -95.4 166.4 51.9 24.0 40.3 53 105 A P T 3 S+ 0 0 97 0, 0.0 25,-0.1 0, 0.0 -1,-0.1 0.714 121.7 54.3 -52.7 -26.3 50.7 25.1 43.7 54 106 A G T 3 S+ 0 0 77 23,-0.1 2,-0.1 2,-0.1 22,-0.1 0.487 88.8 102.5 -90.2 -3.2 54.2 26.1 44.7 55 107 A D < - 0 0 30 -3,-2.3 23,-2.3 20,-0.1 2,-0.5 -0.355 64.7-136.1 -78.9 159.6 54.8 28.4 41.7 56 108 A T E -a 78 0A 30 65,-0.3 67,-2.1 21,-0.2 68,-0.9 -0.982 20.3-162.9-118.6 121.1 54.8 32.2 41.7 57 109 A L E -ab 79 124A 0 21,-3.0 23,-3.1 -2,-0.5 2,-0.4 -0.782 2.1-153.2-104.0 147.5 53.0 33.8 38.7 58 110 A V E -ab 80 125A 2 66,-1.9 68,-1.5 -2,-0.3 2,-0.5 -0.966 7.0-162.8-125.5 140.2 53.3 37.4 37.6 59 111 A D E -ab 81 126A 0 21,-2.0 23,-1.8 -2,-0.4 2,-0.6 -0.946 12.3-154.3-120.6 106.0 50.9 39.6 35.8 60 112 A A E S+a 82 0A 3 66,-2.4 68,-0.5 -2,-0.5 70,-0.1 -0.739 85.1 9.2 -84.2 118.4 52.5 42.7 34.2 61 113 A G S S- 0 0 13 21,-1.7 67,-0.4 -2,-0.6 -1,-0.3 0.972 82.2-179.7 73.3 70.1 49.8 45.4 33.9 62 114 A C > - 0 0 1 20,-2.1 3,-2.1 -3,-0.4 5,-0.4 0.494 8.3-165.3 -85.5 -6.8 47.2 43.5 35.9 63 115 A G T 3 S- 0 0 4 1,-0.3 29,-0.3 19,-0.2 -1,-0.2 -0.353 72.5 -13.9 59.1-123.3 44.3 45.9 35.8 64 116 A R T 3 S- 0 0 72 -61,-0.4 -1,-0.3 -2,-0.2 31,-0.1 0.308 97.2-104.1 -97.0 11.3 41.8 44.8 38.4 65 117 A G S <> S+ 0 0 0 -3,-2.1 4,-2.9 3,-0.1 5,-0.3 0.501 78.0 133.8 84.7 4.2 43.2 41.4 39.0 66 118 A G H > S+ 0 0 2 -63,-0.3 4,-1.7 -4,-0.3 5,-0.1 0.876 77.3 45.5 -53.7 -42.0 40.6 39.4 37.1 67 119 A S H > S+ 0 0 4 -5,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.829 112.6 51.8 -71.5 -33.0 43.3 37.3 35.4 68 120 A M H > S+ 0 0 0 -6,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.939 109.2 48.1 -69.1 -48.6 45.2 36.8 38.7 69 121 A V H X S+ 0 0 8 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.908 113.6 49.2 -58.6 -41.0 42.1 35.6 40.6 70 122 A M H X S+ 0 0 22 -4,-1.7 4,-1.2 -5,-0.3 -1,-0.2 0.864 108.3 52.8 -66.3 -37.6 41.4 33.2 37.7 71 123 A A H X S+ 0 0 0 -4,-1.8 4,-2.8 1,-0.2 5,-0.4 0.915 112.0 46.2 -64.2 -43.1 45.0 31.9 37.7 72 124 A H H X S+ 0 0 22 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.882 108.6 52.4 -69.3 -40.3 44.8 31.1 41.4 73 125 A Q H < S+ 0 0 126 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.781 118.3 40.9 -67.3 -23.1 41.4 29.4 41.4 74 126 A R H < S+ 0 0 95 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.894 129.9 20.8 -90.1 -45.7 42.7 27.2 38.6 75 127 A F H < S- 0 0 34 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.743 84.5-134.1 -98.8 -27.8 46.3 26.4 39.7 76 128 A G < + 0 0 29 -4,-1.8 -4,-0.1 -5,-0.4 -3,-0.1 0.392 62.4 129.6 88.1 -4.2 46.4 27.0 43.4 77 129 A C - 0 0 0 -6,-0.3 2,-0.3 -26,-0.1 -1,-0.2 -0.022 66.7 -90.0 -76.2-178.7 49.7 29.0 43.1 78 130 A K E -a 56 0A 76 -23,-2.3 -21,-3.0 -25,-0.1 2,-0.4 -0.743 40.2-161.6 -92.7 138.9 50.8 32.4 44.3 79 131 A V E -ac 57 105A 0 25,-3.0 27,-2.1 -2,-0.3 2,-0.5 -0.957 7.2-166.7-132.6 119.5 50.1 35.3 42.0 80 132 A E E -ac 58 106A 4 -23,-3.1 -21,-2.0 -2,-0.4 2,-0.3 -0.860 11.1-162.9-102.7 130.1 51.8 38.7 42.1 81 133 A G E -ac 59 107A 0 25,-3.4 27,-0.7 -2,-0.5 2,-0.3 -0.779 3.4-162.8-111.7 159.5 50.3 41.5 40.1 82 134 A V E +ac 60 108A 2 -23,-1.8 -20,-2.1 -2,-0.3 -21,-1.7 -0.998 18.5 146.5-143.6 135.2 51.7 44.9 39.0 83 135 A T E - c 0 109A 8 25,-1.9 27,-2.4 -2,-0.3 -2,-0.0 -0.968 48.3-124.3-156.5 170.4 50.2 48.2 37.8 84 136 A L S S+ 0 0 125 -2,-0.3 2,-0.6 25,-0.2 25,-0.1 0.679 85.8 90.4 -93.2 -20.1 50.6 51.9 37.8 85 137 A S > - 0 0 35 1,-0.2 4,-1.9 25,-0.1 5,-0.1 -0.675 53.6-168.3 -86.7 116.7 47.1 52.5 39.2 86 138 A A H > S+ 0 0 47 -2,-0.6 4,-2.6 1,-0.2 5,-0.3 0.914 92.7 55.2 -64.7 -42.2 46.8 52.7 43.0 87 139 A A H > S+ 0 0 69 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.861 109.0 48.6 -60.0 -34.8 43.0 52.6 42.7 88 140 A Q H > S+ 0 0 65 2,-0.2 4,-2.5 3,-0.1 -1,-0.2 0.856 110.1 49.9 -74.0 -36.6 43.3 49.3 40.7 89 141 A A H X S+ 0 0 7 -4,-1.9 4,-2.5 2,-0.2 5,-0.3 0.987 110.8 49.3 -63.6 -57.1 45.7 47.7 43.1 90 142 A E H X S+ 0 0 117 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.856 111.8 51.5 -48.6 -40.8 43.4 48.5 46.1 91 143 A F H X S+ 0 0 77 -4,-1.5 4,-2.4 -5,-0.3 -1,-0.2 0.955 109.0 47.6 -64.6 -51.8 40.6 47.0 44.1 92 144 A G H X S+ 0 0 3 -4,-2.5 4,-1.2 -29,-0.3 -2,-0.2 0.883 115.6 45.3 -57.2 -40.7 42.3 43.8 43.2 93 145 A N H X S+ 0 0 28 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.895 109.2 54.4 -70.1 -42.5 43.4 43.2 46.8 94 146 A R H X S+ 0 0 154 -4,-2.3 4,-2.3 -5,-0.3 -2,-0.2 0.933 109.7 49.2 -56.0 -45.9 40.0 44.1 48.3 95 147 A R H X S+ 0 0 87 -4,-2.4 4,-1.6 1,-0.2 -1,-0.3 0.816 110.5 51.3 -63.3 -33.2 38.5 41.5 46.0 96 148 A A H X>S+ 0 0 0 -4,-1.2 5,-2.4 2,-0.2 4,-0.8 0.927 107.3 50.8 -71.5 -46.0 41.2 39.0 47.2 97 149 A R H ><5S+ 0 0 129 -4,-2.9 3,-1.2 1,-0.2 -2,-0.2 0.936 111.2 50.5 -55.7 -46.8 40.5 39.6 50.9 98 150 A E H 3<5S+ 0 0 151 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.868 110.0 48.7 -60.3 -38.2 36.8 39.0 50.2 99 151 A L H 3<5S- 0 0 75 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.548 112.8-121.9 -79.0 -6.7 37.5 35.8 48.3 100 152 A G T <<5S+ 0 0 51 -3,-1.2 -3,-0.2 -4,-0.8 -2,-0.1 0.813 88.8 101.9 70.6 28.5 39.7 34.7 51.2 101 153 A I >>< + 0 0 24 -5,-2.4 4,-2.3 -6,-0.1 3,-1.6 0.118 30.3 113.8-129.0 20.2 42.7 34.3 48.9 102 154 A D T 34 + 0 0 84 -6,-0.6 -5,-0.1 1,-0.3 -1,-0.1 0.466 69.8 72.8 -71.8 3.3 44.7 37.5 49.6 103 155 A D T 34 S+ 0 0 114 -7,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.244 113.7 22.6 -96.4 8.6 47.3 35.1 51.1 104 156 A H T <4 S+ 0 0 62 -3,-1.6 -25,-3.0 1,-0.3 2,-0.5 0.475 119.9 58.3-139.1 -38.7 48.1 34.1 47.5 105 157 A V E < +c 79 0A 3 -4,-2.3 2,-0.3 -27,-0.2 -1,-0.3 -0.896 58.5 158.8-109.6 125.6 47.0 36.9 45.3 106 158 A R E -c 80 0A 108 -27,-2.1 -25,-3.4 -2,-0.5 2,-0.3 -0.998 21.8-158.5-147.5 142.1 48.2 40.5 45.6 107 159 A S E -c 81 0A 4 -2,-0.3 2,-0.3 -18,-0.2 -25,-0.2 -0.876 16.7-178.7-115.3 149.0 48.4 43.6 43.4 108 160 A R E -c 82 0A 71 -27,-0.7 -25,-1.9 -2,-0.3 2,-0.8 -0.988 36.3-103.4-147.4 155.2 50.9 46.5 43.9 109 161 A V E +c 83 0A 83 -2,-0.3 2,-0.3 -27,-0.2 -25,-0.2 -0.722 67.1 128.2 -81.4 112.4 51.7 49.8 42.4 110 162 A C - 0 0 26 -27,-2.4 2,-0.4 -2,-0.8 -2,-0.1 -0.932 61.3-109.1-164.6 140.3 54.9 49.2 40.4 111 163 A N > - 0 0 71 3,-0.3 3,-1.7 -2,-0.3 -28,-0.1 -0.614 24.7-134.8 -76.8 129.0 56.2 49.8 36.9 112 164 A M T 3 S+ 0 0 18 -2,-0.4 3,-0.4 1,-0.3 -1,-0.1 0.595 103.2 62.3 -59.3 -10.7 56.5 46.5 34.9 113 165 A L T 3 S+ 0 0 57 1,-0.2 2,-0.3 29,-0.1 -1,-0.3 0.770 111.0 35.2 -86.3 -26.0 59.9 47.6 33.7 114 166 A D S < S+ 0 0 127 -3,-1.7 -3,-0.3 28,-0.0 -1,-0.2 -0.672 83.3 172.5-129.7 76.9 61.4 47.8 37.2 115 167 A T - 0 0 11 -3,-0.4 -3,-0.1 -2,-0.3 -33,-0.0 -0.458 36.5-135.4 -87.2 156.1 59.9 44.9 39.2 116 168 A P + 0 0 73 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 0.483 66.3 117.4 -87.2 -4.8 60.9 43.7 42.7 117 169 A F - 0 0 19 1,-0.1 3,-0.1 3,-0.0 2,-0.1 -0.411 68.5-113.0 -68.5 137.7 60.9 40.0 41.8 118 170 A E > - 0 0 150 1,-0.1 3,-1.6 -2,-0.1 4,-0.3 -0.364 41.0 -82.7 -73.3 149.4 64.2 38.2 42.2 119 171 A K T 3 S- 0 0 157 1,-0.3 27,-0.3 2,-0.1 -1,-0.1 -0.189 109.4 -0.1 -50.9 130.3 66.0 36.8 39.2 120 172 A G T 3 S+ 0 0 36 25,-2.2 -1,-0.3 27,-0.2 27,-0.2 0.687 97.6 109.8 62.5 26.9 64.7 33.4 38.1 121 173 A T < + 0 0 68 -3,-1.6 2,-0.4 25,-0.6 -65,-0.3 0.579 52.6 86.5-107.4 -11.1 62.0 33.0 40.7 122 174 A V E - 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0 0 88 -2,-0.3 4,-1.6 1,-0.1 5,-0.2 -0.373 40.4-141.9 -56.7 132.2 58.9 49.5 25.1 136 188 A L H > S+ 0 0 7 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.884 94.7 54.2 -69.2 -41.9 58.9 45.8 24.1 137 189 A H H > S+ 0 0 84 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.921 112.1 46.0 -60.3 -42.6 62.6 45.1 24.5 138 190 A D H > S+ 0 0 77 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.844 112.5 47.2 -71.6 -35.6 62.6 46.5 28.1 139 191 A V H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.897 115.3 46.2 -74.5 -35.0 59.5 44.7 29.3 140 192 A F H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.814 109.2 54.6 -74.2 -29.8 60.6 41.4 27.8 141 193 A A H X S+ 0 0 34 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.2 0.878 110.3 48.7 -68.3 -36.3 64.1 41.8 29.2 142 194 A E H X S+ 0 0 19 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.902 111.3 46.9 -69.3 -43.7 62.4 42.3 32.6 143 195 A H H X S+ 0 0 2 -4,-2.0 4,-1.0 1,-0.2 -2,-0.2 0.902 112.0 52.9 -62.5 -41.7 60.2 39.2 32.3 144 196 A S H < S+ 0 0 10 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.869 108.0 51.7 -62.9 -37.8 63.3 37.2 31.2 145 197 A R H < S+ 0 0 82 -4,-1.8 -25,-2.2 1,-0.2 -2,-0.2 0.988 116.9 35.1 -65.0 -59.3 65.2 38.3 34.2 146 198 A F H < S+ 0 0 4 -4,-2.2 -24,-2.7 -27,-0.3 -25,-0.6 0.545 100.9 99.7 -76.2 -1.0 62.7 37.3 36.9 147 199 A L E < S-d 122 0A 1 -4,-1.0 -27,-0.2 -27,-0.2 -24,-0.2 -0.673 76.6-121.3 -89.1 134.9 61.6 34.3 34.9 148 200 A R E > - 0 0 105 -26,-3.0 3,-2.9 -2,-0.4 2,-0.3 -0.395 39.8 -92.7 -68.7 148.4 63.0 30.9 35.8 149 201 A V E 3 S+ 0 0 102 1,-0.3 99,-0.2 -29,-0.2 -1,-0.1 -0.497 121.8 24.3 -63.4 122.7 64.9 29.1 33.1 150 202 A G E 3 S+ 0 0 54 97,-3.1 -1,-0.3 -2,-0.3 98,-0.1 0.337 97.5 139.1 99.3 -5.4 62.2 26.9 31.4 151 203 A G E < - 0 0 1 -3,-2.9 96,-2.0 96,-0.4 2,-0.4 -0.057 49.9-119.3 -64.0 174.0 59.6 29.3 32.6 152 204 A R E -dE 124 246A 45 -29,-2.0 -27,-1.8 94,-0.2 2,-0.4 -0.974 21.3-169.3-128.5 130.7 56.6 30.4 30.4 153 205 A Y E -dE 125 245A 0 92,-2.9 92,-3.4 -2,-0.4 2,-0.4 -0.922 7.1-175.3-114.6 140.6 55.6 33.8 29.2 154 206 A V E -dE 126 244A 0 -29,-1.7 -27,-1.6 -2,-0.4 2,-0.4 -0.993 4.6-177.0-135.5 142.3 52.4 34.6 27.5 155 207 A T E -dE 127 243A 0 88,-1.6 88,-2.2 -2,-0.4 2,-0.5 -0.985 9.5-168.5-140.7 131.0 51.1 37.8 25.9 156 208 A V E +dE 128 242A 2 -29,-1.9 -27,-2.6 -2,-0.4 2,-0.3 -0.985 36.1 142.5-114.4 122.7 47.7 38.5 24.3 157 209 A T E - E 0 241A 0 84,-2.4 84,-2.6 -2,-0.5 2,-0.4 -0.995 53.7-106.6-159.4 163.0 47.8 41.8 22.5 158 210 A G E + E 0 240A 1 -2,-0.3 25,-0.4 82,-0.2 2,-0.3 -0.797 42.3 173.8 -91.2 133.3 46.8 43.9 19.5 159 211 A C E - E 0 239A 0 80,-2.8 80,-1.7 -2,-0.4 25,-0.2 -0.999 33.2-114.8-141.3 142.0 49.6 44.5 17.0 160 212 A W E -fE 184 238A 30 23,-2.1 25,-1.7 -2,-0.3 26,-0.3 -0.548 36.1-117.0 -76.5 140.5 49.8 46.2 13.6 161 213 A N > - 0 0 17 76,-2.4 3,-1.4 -2,-0.2 -1,-0.1 -0.699 17.1-161.0 -83.9 117.6 50.6 43.8 10.8 162 214 A P G > S+ 0 0 42 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 0.590 82.8 82.8 -70.4 -12.1 53.9 44.6 9.1 163 215 A R G 3 S+ 0 0 171 1,-0.3 3,-0.1 73,-0.1 74,-0.1 0.749 95.5 45.4 -63.8 -22.4 52.7 42.6 6.1 164 216 A Y G < S- 0 0 114 -3,-1.4 -1,-0.3 1,-0.4 -3,-0.1 -0.010 113.8-122.1-110.8 28.0 50.9 45.7 5.1 165 217 A G < + 0 0 36 -3,-1.9 -1,-0.4 3,-0.0 3,-0.1 -0.189 69.6 16.2 65.9-159.5 53.7 48.2 5.7 166 218 A Q S S- 0 0 155 1,-0.1 -5,-0.1 -3,-0.1 2,-0.1 0.246 98.4 -71.9 -41.3 161.2 53.4 51.1 8.1 167 219 A P - 0 0 46 0, 0.0 -1,-0.1 0, 0.0 71,-0.1 -0.372 52.4-125.2 -60.4 131.4 50.7 51.5 10.8 168 220 A S > - 0 0 28 69,-0.2 4,-1.6 -3,-0.1 3,-0.3 -0.285 25.5-105.3 -73.2 164.4 47.3 52.2 9.3 169 221 A K H > S+ 0 0 135 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.886 119.9 63.5 -58.5 -37.1 45.3 55.2 10.4 170 222 A W H > S+ 0 0 34 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.936 102.1 48.1 -51.1 -53.7 43.0 52.9 12.4 171 223 A V H > S+ 0 0 0 -3,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.879 112.1 50.8 -54.3 -42.4 46.0 51.7 14.6 172 224 A S H X S+ 0 0 59 -4,-1.6 4,-2.7 2,-0.2 -1,-0.2 0.879 106.9 53.3 -65.9 -38.5 46.9 55.4 15.1 173 225 A Q H X S+ 0 0 77 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.924 110.7 46.9 -63.4 -42.1 43.3 56.3 16.1 174 226 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.2 5,-0.3 0.949 110.5 52.6 -63.3 -47.5 43.4 53.6 18.7 175 227 A N H X>S+ 0 0 25 -4,-2.7 5,-1.6 1,-0.2 4,-1.3 0.934 111.7 46.2 -53.0 -47.8 46.8 54.7 20.0 176 228 A A H <5S+ 0 0 83 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.885 110.0 54.9 -62.6 -38.2 45.5 58.3 20.4 177 229 A H H <5S+ 0 0 83 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.912 123.1 24.8 -61.9 -45.7 42.3 57.0 22.1 178 230 A F H <5S- 0 0 49 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.389 101.7-123.8-100.5 1.3 44.2 55.1 24.8 179 231 A E T <5S+ 0 0 178 -4,-1.3 -3,-0.2 -5,-0.3 2,-0.2 0.941 70.2 131.5 52.9 46.9 47.4 57.1 24.7 180 232 A C < - 0 0 16 -5,-1.6 -47,-0.2 -6,-0.2 -1,-0.2 -0.595 61.1-125.7-117.9-178.9 49.3 53.8 24.0 181 233 A N - 0 0 100 -49,-3.1 -47,-0.1 -2,-0.2 -9,-0.1 -0.576 23.1-152.0-135.5 72.1 51.9 52.8 21.4 182 234 A I - 0 0 2 -11,-0.2 2,-0.1 -2,-0.2 -23,-0.1 -0.128 16.5-145.9 -45.6 127.2 50.7 49.7 19.5 183 235 A H - 0 0 4 -25,-0.4 -23,-2.1 1,-0.1 2,-0.3 -0.457 13.3-106.0 -95.1 169.3 53.7 47.7 18.2 184 236 A S B > -f 160 0A 3 -25,-0.2 4,-2.1 -2,-0.1 3,-0.3 -0.657 25.7-118.2 -94.7 151.9 54.2 45.6 15.1 185 237 A R H > S+ 0 0 79 -25,-1.7 4,-2.4 1,-0.3 5,-0.2 0.846 118.6 59.2 -56.7 -31.4 54.1 41.8 15.1 186 238 A R H > S+ 0 0 189 -26,-0.3 4,-2.6 1,-0.2 -1,-0.3 0.945 104.6 47.5 -61.3 -48.4 57.7 42.1 13.8 187 239 A E H > S+ 0 0 86 -3,-0.3 4,-2.5 2,-0.2 5,-0.3 0.864 110.7 53.1 -61.5 -37.8 58.7 44.1 16.9 188 240 A Y H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.977 114.4 39.7 -61.7 -56.1 57.0 41.5 19.2 189 241 A L H X S+ 0 0 58 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.837 116.5 52.6 -62.4 -34.4 58.9 38.5 17.7 190 242 A R H X S+ 0 0 147 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.959 109.6 46.3 -67.4 -52.1 62.1 40.5 17.4 191 243 A A H X S+ 0 0 7 -4,-2.5 4,-0.7 1,-0.2 -2,-0.2 0.907 110.3 54.4 -59.0 -43.2 62.2 41.6 21.1 192 244 A M H ><>S+ 0 0 0 -4,-2.1 5,-2.5 -5,-0.3 3,-1.1 0.931 108.9 48.2 -58.5 -45.7 61.4 38.1 22.2 193 245 A A H ><5S+ 0 0 63 -4,-1.9 3,-1.0 1,-0.3 -1,-0.2 0.876 109.9 51.6 -64.0 -36.7 64.3 36.7 20.3 194 246 A D H 3<5S+ 0 0 75 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.550 112.0 49.6 -77.0 -4.7 66.7 39.3 21.7 195 247 A N T <<5S- 0 0 17 -3,-1.1 -1,-0.2 -4,-0.7 -2,-0.2 0.014 117.3-101.7-124.7 30.1 65.6 38.5 25.2 196 248 A R T < 5S+ 0 0 152 -3,-1.0 52,-1.7 1,-0.2 2,-0.6 0.765 78.9 133.5 57.3 30.4 65.8 34.7 25.4 197 249 A L E < -G 247 0A 0 -5,-2.5 50,-0.2 50,-0.2 -2,-0.2 -0.954 37.3-166.3-111.1 117.2 62.1 34.2 24.9 198 250 A V E -G 246 0A 75 48,-3.0 48,-2.5 -2,-0.6 -9,-0.0 -0.891 20.8-124.5-112.1 108.7 61.3 31.5 22.3 199 251 A P E +G 245 0A 44 0, 0.0 46,-0.3 0, 0.0 3,-0.1 -0.172 29.0 174.7 -50.4 128.5 57.7 31.3 21.0 200 252 A Q E S+ 0 0 118 44,-3.8 2,-0.4 1,-0.4 45,-0.2 0.666 75.7 22.8-104.8 -31.6 56.1 27.9 21.4 201 253 A T E +G 244 0A 43 43,-1.9 43,-2.5 -154,-0.1 2,-0.4 -0.996 59.5 176.4-141.3 130.3 52.7 29.0 20.2 202 254 A V E +G 243 0A 77 -2,-0.4 2,-0.4 41,-0.2 41,-0.2 -0.986 15.5 169.8-133.1 119.7 51.7 31.9 17.9 203 255 A V E -G 242 0A 47 39,-2.1 39,-1.9 -2,-0.4 2,-0.5 -0.982 32.2-135.3-140.1 127.2 48.1 32.2 17.0 204 256 A D E +G 241 0A 72 -2,-0.4 37,-0.3 37,-0.2 4,-0.1 -0.685 22.4 179.6 -78.0 122.7 46.1 35.0 15.3 205 257 A L >> + 0 0 7 35,-3.5 4,-1.5 -2,-0.5 3,-0.9 0.322 45.1 113.6-106.8 6.4 42.9 35.4 17.2 206 258 A T H 3> S+ 0 0 12 34,-0.8 4,-1.1 1,-0.3 3,-0.2 0.832 76.8 51.7 -49.2 -39.1 41.4 38.2 15.2 207 259 A P H 34 S+ 0 0 86 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.890 110.6 48.6 -68.1 -33.4 38.6 36.1 13.9 208 260 A E H <4 S+ 0 0 96 -3,-0.9 -198,-2.3 1,-0.2 4,-0.3 0.710 114.2 45.5 -76.8 -21.5 37.6 35.0 17.5 209 261 A T H X S+ 0 0 0 -4,-1.5 4,-1.8 -200,-0.2 -1,-0.2 0.581 92.8 80.7 -96.6 -12.5 37.7 38.6 18.8 210 262 A L H X S+ 0 0 20 -4,-1.1 4,-2.3 -5,-0.3 5,-0.2 0.919 89.4 51.9 -61.4 -45.6 35.7 40.1 15.9 211 263 A P H > S+ 0 0 32 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.900 106.1 58.5 -57.8 -38.4 32.3 39.0 17.2 212 264 A Y H > S+ 0 0 1 -4,-0.3 4,-1.7 1,-0.2 -2,-0.2 0.953 110.9 39.2 -54.0 -55.6 33.3 40.6 20.5 213 265 A W H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.789 112.6 55.1 -69.4 -29.5 33.8 44.1 19.0 214 266 A E H < S+ 0 0 75 -4,-2.3 4,-0.3 2,-0.2 -1,-0.2 0.922 110.9 46.0 -69.5 -40.1 30.8 43.9 16.6 215 267 A L H >< S+ 0 0 12 -4,-2.5 3,-1.0 -5,-0.2 -2,-0.2 0.869 112.3 52.1 -67.4 -36.3 28.5 43.2 19.5 216 268 A R H >< S+ 0 0 43 -4,-1.7 3,-1.3 -5,-0.3 -1,-0.2 0.853 99.4 62.2 -68.7 -35.0 30.2 46.0 21.5 217 269 A A T 3< S+ 0 0 41 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.597 96.8 62.6 -67.6 -9.6 29.7 48.5 18.6 218 270 A T T < S+ 0 0 82 -3,-1.0 -1,-0.3 -4,-0.3 2,-0.2 0.038 90.6 92.7-103.6 25.1 26.0 48.1 19.1 219 271 A S S < S- 0 0 18 -3,-1.3 3,-0.2 1,-0.1 -3,-0.0 -0.585 77.9-121.5-115.6 178.7 25.8 49.4 22.6 220 272 A S S S+ 0 0 73 -2,-0.2 -1,-0.1 1,-0.2 -4,-0.0 0.898 109.2 61.1 -79.4 -47.5 25.1 52.6 24.5 221 273 A L S S+ 0 0 124 -195,-0.1 -1,-0.2 2,-0.0 -4,-0.1 0.521 75.8 137.6 -58.9 -8.6 28.5 52.5 26.3 222 274 A V - 0 0 60 -3,-0.2 -5,-0.1 -6,-0.2 -6,-0.0 -0.044 40.5-163.1 -40.8 139.7 30.2 52.7 22.9 223 275 A T - 0 0 78 0, 0.0 -1,-0.1 0, 0.0 -6,-0.0 0.430 42.5-107.4-109.4 -2.8 33.1 55.1 23.0 224 276 A G S S+ 0 0 51 -7,-0.0 3,-0.4 3,-0.0 4,-0.4 0.270 102.1 93.6 94.7 -11.1 33.6 55.6 19.2 225 277 A I > + 0 0 9 1,-0.2 4,-1.6 2,-0.2 3,-0.3 0.653 60.4 82.5 -88.3 -15.7 36.7 53.6 19.1 226 278 A E H > S+ 0 0 4 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.771 85.0 61.3 -61.5 -23.3 35.0 50.3 18.2 227 279 A E H > S+ 0 0 114 -3,-0.4 4,-2.6 2,-0.2 5,-0.3 0.958 102.0 50.6 -65.6 -49.2 34.9 51.5 14.5 228 280 A A H > S+ 0 0 0 -4,-0.4 4,-2.1 -3,-0.3 5,-0.3 0.897 112.1 48.1 -54.5 -44.1 38.8 51.6 14.4 229 281 A F H X S+ 0 0 3 -4,-1.6 4,-2.2 2,-0.2 5,-0.2 0.954 112.9 46.0 -63.0 -52.0 39.0 48.1 15.8 230 282 A I H X S+ 0 0 16 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.908 116.3 43.6 -60.8 -45.1 36.5 46.5 13.5 231 283 A E H X S+ 0 0 72 -4,-2.6 4,-3.3 2,-0.2 5,-0.3 0.942 115.4 46.5 -67.7 -48.4 37.8 48.1 10.3 232 284 A S H X>S+ 0 0 0 -4,-2.1 6,-1.7 -5,-0.3 4,-0.9 0.861 112.2 51.5 -63.7 -35.3 41.5 47.5 11.0 233 285 A Y H <5S+ 0 0 13 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.829 114.7 45.5 -69.5 -31.3 40.8 43.9 12.0 234 286 A R H <5S+ 0 0 143 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.912 113.9 43.4 -79.4 -45.2 38.9 43.5 8.7 235 287 A D H <5S- 0 0 76 -4,-3.3 -2,-0.2 -5,-0.1 -1,-0.2 0.635 111.4-122.3 -78.0 -5.5 41.4 45.1 6.3 236 288 A G T <5S+ 0 0 17 -4,-0.9 -75,-0.2 -5,-0.3 -3,-0.2 0.503 80.7 116.3 84.0 6.1 44.1 43.3 8.2 237 289 A S S