==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-OCT-10 3P8R . COMPND 2 MOLECULE: GERANYLTRANSTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: VIBRIO CHOLERAE; . AUTHOR Y.PATSKOVSKY,R.TORO,M.DICKEY,J.M.SAUDER,S.K.BURLEY,C.D.POULT . 268 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12608.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 218 81.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 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 . 3 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 16.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 61.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 3 0 0 0 0 0 2 2 2 1 0 0 0 0 2 0 1 0 0 0 1 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 -2 A H 0 0 158 0, 0.0 2,-0.1 0, 0.0 267,-0.1 0.000 360.0 360.0 360.0 -19.9 19.2 49.0 90.1 2 -1 A H > - 0 0 58 258,-0.1 3,-1.4 1,-0.1 4,-0.2 -0.378 360.0-102.2 -89.5 170.8 15.7 48.0 91.1 3 0 A H T 3 S+ 0 0 171 1,-0.3 4,-0.3 2,-0.1 -1,-0.1 0.105 108.9 86.1 -76.6 22.4 12.4 50.1 91.2 4 1 A S T 3> + 0 0 0 2,-0.2 4,-1.2 256,-0.2 -1,-0.3 0.490 68.9 73.6-100.3 -9.4 13.1 50.2 95.0 5 2 A L T <4 S+ 0 0 99 -3,-1.4 -2,-0.1 1,-0.2 -1,-0.1 0.828 113.4 25.7 -68.0 -32.2 15.4 53.2 94.6 6 3 A E T > S+ 0 0 166 -4,-0.2 4,-0.5 2,-0.1 3,-0.2 0.444 112.6 65.7-114.0 -4.8 12.2 55.3 94.0 7 4 A A H >> S+ 0 0 26 -4,-0.3 3,-1.5 2,-0.2 4,-1.3 0.893 95.2 60.7 -75.1 -44.0 9.6 53.2 95.8 8 5 A L H 3X S+ 0 0 11 -4,-1.2 4,-0.6 1,-0.3 -1,-0.2 0.508 99.9 59.9 -56.9 -4.4 11.4 54.0 99.1 9 6 A S H 3> S+ 0 0 68 -3,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.761 95.9 58.1 -95.6 -32.4 10.5 57.6 98.1 10 7 A S H X S+ 0 0 30 -4,-1.3 4,-2.3 2,-0.2 3,-0.6 0.846 105.3 72.0 -70.3 -38.8 6.9 55.8 101.7 12 9 A Q H 3X S+ 0 0 20 -4,-0.6 4,-0.9 1,-0.3 -2,-0.2 0.833 99.1 52.6 -56.2 -31.8 9.7 58.0 102.8 13 10 A Q H >X S+ 0 0 129 -4,-1.1 4,-2.3 2,-0.2 3,-0.7 0.945 107.7 47.7 -66.1 -44.8 7.2 60.7 102.4 14 11 A R H < S+ 0 0 28 -4,-1.4 3,-0.8 2,-0.2 4,-0.5 0.916 111.1 44.6 -73.2 -44.0 3.9 62.9 116.6 23 20 A L H >< S+ 0 0 0 -4,-1.4 3,-1.2 1,-0.2 -2,-0.2 0.858 106.2 64.0 -66.1 -32.4 6.4 65.8 117.0 24 21 A N H 3< S+ 0 0 80 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.721 92.8 63.7 -62.4 -25.4 3.5 68.2 116.8 25 22 A R T << S+ 0 0 133 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.752 80.4 98.6 -69.7 -29.0 2.1 66.7 120.0 26 23 A I < - 0 0 45 -3,-1.2 3,-0.2 -4,-0.5 2,-0.1 -0.475 69.7-136.4 -70.3 130.7 5.0 67.8 122.1 27 24 A P S S+ 0 0 93 0, 0.0 7,-0.1 0, 0.0 -2,-0.1 -0.392 81.3 43.8 -77.8 163.8 4.5 71.0 124.1 28 25 A F > + 0 0 152 -2,-0.1 3,-1.6 2,-0.0 6,-0.3 0.885 62.3 164.6 64.9 44.5 7.2 73.6 124.4 29 26 A Q T 3 + 0 0 66 1,-0.3 -3,-0.0 -3,-0.2 -1,-0.0 0.860 68.8 65.8 -59.1 -37.5 8.1 73.5 120.7 30 27 A T T 3 S+ 0 0 135 5,-0.0 -1,-0.3 4,-0.0 5,-0.0 0.705 85.1 100.3 -60.6 -19.4 10.0 76.8 120.9 31 28 A L S < S- 0 0 67 -3,-1.6 0, 0.0 1,-0.1 0, 0.0 -0.359 81.0-127.3 -66.5 148.6 12.3 74.8 123.1 32 29 A P S >> S+ 0 0 83 0, 0.0 3,-2.4 0, 0.0 4,-2.2 0.866 100.9 58.1 -66.4 -42.9 15.5 73.6 121.5 33 30 A L H 3> S+ 0 0 40 1,-0.3 4,-2.6 2,-0.2 5,-0.3 0.965 102.5 55.3 -60.3 -47.4 15.4 69.9 122.3 34 31 A I H 34 S+ 0 0 11 -6,-0.3 4,-0.4 1,-0.2 -1,-0.3 0.576 110.4 51.7 -58.5 -3.6 12.1 69.6 120.5 35 32 A E H <> S+ 0 0 99 -3,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.849 105.3 48.1 -96.8 -52.7 14.1 71.1 117.7 36 33 A A H X S+ 0 0 28 -4,-2.2 4,-2.0 1,-0.2 5,-0.3 0.927 112.9 52.5 -51.8 -48.5 17.1 68.7 117.6 37 34 A M H X S+ 0 0 4 -4,-2.6 4,-0.7 1,-0.2 -1,-0.2 0.938 108.8 49.9 -48.7 -51.7 14.5 66.0 117.7 38 35 A R H > S+ 0 0 49 -4,-0.4 4,-1.4 -5,-0.3 -2,-0.2 0.836 120.2 34.7 -64.7 -36.7 12.7 67.6 114.7 39 36 A Y H >X S+ 0 0 48 -4,-2.6 4,-1.9 2,-0.2 3,-0.9 0.959 115.2 52.3 -75.1 -73.6 15.9 67.9 112.7 40 37 A G H 3< S+ 0 0 21 -4,-2.0 4,-0.2 1,-0.3 43,-0.2 0.552 120.1 40.1 -40.3 -8.4 17.8 64.7 113.8 41 38 A L H 3< S+ 0 0 1 -4,-0.7 -1,-0.3 -5,-0.3 -2,-0.2 0.725 113.5 46.4-114.8 -36.8 14.5 62.9 112.8 42 39 A L H << S+ 0 0 50 -4,-1.4 -2,-0.2 -3,-0.9 -3,-0.1 0.463 112.8 53.8 -90.7 -1.5 13.3 64.5 109.6 43 40 A L S < S+ 0 0 131 -4,-1.9 2,-0.3 1,-0.1 -3,-0.1 0.887 79.4 122.3 -82.5 -74.2 16.8 64.4 108.2 44 41 A G - 0 0 31 -5,-0.2 2,-0.2 -4,-0.2 -2,-0.1 -0.280 62.3-100.7 65.1-114.0 17.3 60.6 108.7 45 42 A G - 0 0 48 -2,-0.3 34,-0.0 -33,-0.1 0, 0.0 -0.788 63.4 -32.2-174.4-141.0 18.1 58.6 105.6 46 43 A K S S- 0 0 70 -2,-0.2 -34,-0.1 1,-0.0 5,-0.1 0.668 70.8-133.7 -78.5 -17.4 16.5 56.2 103.1 47 44 A R > + 0 0 8 1,-0.1 4,-1.8 3,-0.1 5,-0.2 0.928 41.4 165.5 63.8 48.9 14.1 54.9 105.8 48 45 A A H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.818 71.8 54.4 -62.7 -28.6 14.7 51.3 104.8 49 46 A R H > S+ 0 0 27 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.982 106.4 45.3 -73.9 -58.2 13.1 50.3 108.1 50 47 A P H > S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.894 115.0 52.7 -48.0 -42.7 9.8 52.1 107.8 51 48 A Y H X S+ 0 0 3 -4,-1.8 4,-2.6 1,-0.2 5,-0.4 0.930 105.9 51.7 -61.6 -47.6 9.7 50.8 104.3 52 49 A L H X S+ 0 0 1 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.865 109.2 51.4 -57.2 -37.3 10.2 47.3 105.5 53 50 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.982 113.1 45.5 -61.2 -56.1 7.3 47.7 107.9 54 51 A Y H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.944 116.2 41.2 -51.4 -62.6 5.0 49.0 105.2 55 52 A I H X S+ 0 0 4 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.871 114.9 52.0 -60.9 -38.0 5.7 46.4 102.5 56 53 A T H < S+ 0 0 0 -4,-1.6 4,-0.3 -5,-0.4 -1,-0.2 0.901 112.7 44.9 -66.3 -39.0 5.8 43.5 104.9 57 54 A G H ><>S+ 0 0 0 -4,-2.2 3,-2.2 -5,-0.2 5,-1.5 0.964 113.2 49.6 -69.4 -52.1 2.4 44.4 106.4 58 55 A Q H ><5S+ 0 0 74 -4,-2.9 3,-3.3 1,-0.3 -2,-0.2 0.939 102.8 59.9 -49.9 -54.6 0.8 45.0 103.0 59 56 A M T 3<5S+ 0 0 24 -4,-2.7 195,-0.4 1,-0.3 -1,-0.3 0.720 110.2 47.4 -43.8 -20.5 2.1 41.7 101.8 60 57 A L T < 5S- 0 0 2 -3,-2.2 -1,-0.3 -4,-0.3 -2,-0.2 0.364 129.0 -93.4-111.3 2.9 -0.0 40.5 104.7 61 58 A G T < 5S+ 0 0 59 -3,-3.3 -3,-0.2 1,-0.3 2,-0.2 0.513 74.3 142.7 106.3 8.2 -3.2 42.4 104.0 62 59 A C < - 0 0 13 -5,-1.5 -1,-0.3 -8,-0.1 2,-0.2 -0.494 47.2-128.3 -84.8 148.7 -2.7 45.5 106.1 63 60 A E > - 0 0 123 -2,-0.2 3,-0.7 1,-0.1 56,-0.1 -0.538 28.1-114.5 -81.2 160.4 -3.8 49.0 105.2 64 61 A L G >> S+ 0 0 39 1,-0.2 3,-2.0 2,-0.2 4,-1.1 0.841 118.7 62.5 -63.9 -31.6 -1.1 51.7 105.4 65 62 A S G 34 S+ 0 0 76 1,-0.3 4,-0.3 2,-0.2 -1,-0.2 0.805 99.2 55.3 -61.4 -30.9 -3.2 53.2 108.2 66 63 A D G <4 S+ 0 0 39 -3,-0.7 53,-0.3 1,-0.2 -1,-0.3 0.382 113.2 42.6 -79.3 2.8 -2.6 50.0 110.1 67 64 A L T <> S+ 0 0 0 -3,-2.0 4,-2.7 2,-0.1 5,-0.2 0.510 80.3 90.3-130.7 -13.5 1.1 50.4 109.8 68 65 A D H X S+ 0 0 9 -4,-1.1 4,-3.0 -3,-0.2 5,-0.3 0.819 87.3 60.0 -61.0 -29.1 2.1 54.0 110.4 69 66 A T H > S+ 0 0 6 48,-0.4 4,-2.8 -4,-0.3 5,-0.2 0.992 112.1 33.0 -64.8 -63.2 2.5 53.2 114.1 70 67 A P H > S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.923 119.8 55.6 -58.7 -39.4 5.2 50.6 113.8 71 68 A A H X S+ 0 0 0 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.960 113.2 38.9 -58.2 -54.1 6.6 52.4 110.8 72 69 A S H X S+ 0 0 0 -4,-3.0 4,-1.5 -5,-0.2 -1,-0.2 0.902 115.2 54.7 -62.3 -42.5 7.0 55.7 112.7 73 70 A A H X S+ 0 0 0 -4,-2.8 4,-1.2 -5,-0.3 3,-0.3 0.917 106.6 49.2 -57.3 -47.7 8.1 53.9 115.9 74 71 A V H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.3 -1,-0.2 0.849 106.3 55.4 -69.1 -34.6 11.0 52.1 114.3 75 72 A E H X S+ 0 0 0 -4,-1.5 4,-3.1 -5,-0.3 -1,-0.3 0.853 101.0 60.6 -64.9 -33.7 12.4 55.1 112.6 76 73 A C H X S+ 0 0 0 -4,-1.5 4,-2.4 -3,-0.3 -1,-0.2 0.886 106.0 46.4 -60.2 -41.0 12.5 56.9 116.0 77 74 A I H X S+ 0 0 0 -4,-1.2 4,-2.6 2,-0.2 -2,-0.2 0.950 112.5 50.0 -65.2 -49.2 14.9 54.2 117.3 78 75 A H H X S+ 0 0 30 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.965 112.7 47.3 -50.8 -56.6 17.0 54.4 114.2 79 76 A A H X S+ 0 0 1 -4,-3.1 4,-2.1 1,-0.2 3,-0.4 0.909 110.1 50.8 -54.2 -52.2 17.3 58.2 114.4 80 77 A Y H X S+ 0 0 19 -4,-2.4 4,-2.0 1,-0.2 5,-0.3 0.946 107.8 55.7 -49.3 -49.4 18.2 58.2 118.1 81 78 A S H X S+ 0 0 17 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.827 107.1 48.0 -57.7 -38.5 20.9 55.6 117.4 82 79 A L H >X S+ 0 0 62 -4,-1.6 4,-1.8 -3,-0.4 3,-1.0 0.989 108.3 54.0 -64.0 -57.5 22.6 57.8 114.8 83 80 A I H 3< S+ 0 0 29 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.824 111.7 44.7 -45.4 -44.6 22.6 60.9 117.0 84 81 A H H >< S+ 0 0 40 -4,-2.0 3,-1.2 -5,-0.2 6,-0.3 0.809 108.4 60.2 -68.9 -32.2 24.3 59.1 119.7 85 82 A D H << S+ 0 0 37 -4,-1.3 -2,-0.2 -3,-1.0 -1,-0.2 0.871 98.7 56.1 -62.8 -37.0 26.7 57.6 117.2 86 83 A D T 3< S+ 0 0 117 -4,-1.8 -1,-0.2 4,-0.1 -2,-0.1 0.208 81.6 130.0 -83.8 11.6 28.0 61.0 116.1 87 84 A L <> - 0 0 16 -3,-1.2 4,-2.8 1,-0.1 5,-0.4 -0.529 67.6-127.6 -72.7 135.7 29.0 62.0 119.6 88 85 A P H > S+ 0 0 59 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 0.916 113.9 54.9 -36.4 -54.2 32.4 63.4 120.4 89 86 A A H 4 S+ 0 0 82 1,-0.2 -4,-0.1 2,-0.1 -3,-0.0 0.954 116.8 35.1 -50.1 -55.9 32.6 60.7 123.0 90 87 A M H 4 S+ 0 0 84 -6,-0.3 -1,-0.2 1,-0.2 -4,-0.1 0.931 121.5 39.4 -67.7 -50.6 31.9 58.0 120.5 91 88 A D H < 0 0 118 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.1 0.858 360.0 360.0 -70.2 -39.7 33.6 59.1 117.2 92 89 A D < 0 0 166 -4,-1.7 -1,-0.2 -5,-0.4 -2,-0.1 0.700 360.0 360.0 -31.2 360.0 36.8 60.6 118.5 93 ! 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 94 104 A D 0 0 160 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 26.1 24.4 71.5 122.4 95 105 A E >> + 0 0 88 2,-0.1 4,-2.5 3,-0.1 3,-1.3 0.569 360.0 47.4-108.4 -52.2 26.3 68.3 122.6 96 106 A A H 3> S+ 0 0 65 1,-0.3 4,-2.6 2,-0.2 5,-0.1 0.843 109.1 56.6 -52.4 -30.9 24.4 67.7 125.8 97 107 A T H 3> S+ 0 0 39 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.809 104.0 51.4 -69.5 -31.4 21.5 68.6 123.6 98 108 A A H <> S+ 0 0 24 -3,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.904 109.8 50.3 -68.8 -42.7 22.5 65.9 121.2 99 109 A I H >X S+ 0 0 60 -4,-2.5 4,-2.3 2,-0.2 3,-0.5 0.975 113.5 44.2 -56.2 -56.0 22.5 63.4 124.1 100 110 A L H 3X S+ 0 0 97 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.919 109.9 55.2 -56.0 -48.0 19.1 64.5 125.2 101 111 A T H 3X S+ 0 0 0 -4,-2.3 4,-0.9 2,-0.2 -1,-0.2 0.798 108.9 49.2 -59.5 -30.6 17.6 64.5 121.7 102 112 A G H XX S+ 0 0 0 -4,-1.6 4,-2.0 -3,-0.5 3,-1.3 0.985 111.8 47.6 -66.4 -61.3 18.8 60.9 121.4 103 113 A D H 3X S+ 0 0 74 -4,-2.3 4,-2.1 1,-0.3 -2,-0.2 0.857 111.4 51.2 -45.3 -45.9 17.3 59.9 124.7 104 114 A A H 3X S+ 0 0 25 -4,-3.0 4,-2.2 1,-0.2 -1,-0.3 0.745 107.1 53.6 -69.7 -25.7 14.0 61.6 123.9 105 115 A L H X S+ 0 0 59 -4,-2.0 4,-1.2 2,-0.2 3,-0.6 0.980 114.3 45.9 -55.3 -54.1 14.1 56.4 122.0 107 117 A T H >X S+ 0 0 88 -4,-2.1 4,-2.4 1,-0.2 3,-0.7 0.918 109.3 55.6 -52.7 -46.6 11.3 57.3 124.5 108 118 A L H 3X S+ 0 0 12 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.833 100.2 60.9 -55.1 -34.3 9.3 58.8 121.6 109 119 A A H - 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0 0 27 -2,-0.9 4,-2.4 1,-0.1 3,-0.5 -0.852 53.2-118.0-115.6 151.2 36.3 45.0 106.5 224 248 A Y H > S+ 0 0 0 -2,-0.3 4,-0.6 1,-0.3 5,-0.2 0.866 118.1 50.3 -51.0 -40.2 34.4 42.2 104.7 225 249 A P H > S+ 0 0 9 0, 0.0 4,-3.1 0, 0.0 3,-0.3 0.852 109.1 50.9 -68.4 -35.8 36.7 42.7 101.7 226 250 A A H 4 S+ 0 0 71 -3,-0.5 -2,-0.2 1,-0.2 -4,-0.1 0.893 113.2 44.3 -68.9 -41.5 39.8 42.6 103.9 227 251 A L H < S+ 0 0 68 -4,-2.4 -1,-0.2 1,-0.2 -3,-0.1 0.555 136.5 14.2 -78.3 -8.5 38.8 39.3 105.5 228 252 A L H X S- 0 0 62 -4,-0.6 4,-0.5 -3,-0.3 -2,-0.2 0.417 104.9-116.9-143.1 -11.9 37.7 37.7 102.2 229 253 A G H X - 0 0 32 -4,-3.1 4,-2.2 -5,-0.2 5,-0.2 0.208 43.1 -71.3 75.5 156.0 39.1 39.9 99.4 230 254 A L H > S+ 0 0 65 1,-0.3 4,-2.2 2,-0.2 3,-0.3 0.898 137.1 38.2 -47.0 -54.2 36.9 41.8 97.0 231 255 A E H > S+ 0 0 158 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.824 113.2 57.6 -70.5 -31.1 35.8 38.8 95.1 232 256 A G H X S+ 0 0 30 -4,-0.5 4,-0.8 2,-0.2 -1,-0.2 0.808 109.8 45.5 -67.6 -30.3 35.5 36.8 98.3 233 257 A A H >X S+ 0 0 0 -4,-2.2 4,-2.5 -3,-0.3 3,-0.7 0.928 108.6 53.1 -78.1 -50.3 33.1 39.3 99.7 234 258 A Q H 3X S+ 0 0 72 -4,-2.2 4,-2.2 1,-0.3 -2,-0.2 0.845 106.6 55.4 -55.1 -33.2 30.9 39.7 96.6 235 259 A Q H 3X S+ 0 0 119 -4,-1.6 4,-1.7 2,-0.2 -1,-0.3 0.881 108.2 48.9 -66.6 -35.2 30.6 35.9 96.7 236 260 A K H X S+ 0 0 2 -4,-2.6 4,-1.9 2,-0.2 3,-1.6 0.995 113.5 45.6 -60.6 -66.2 17.1 35.6 101.6 245 269 A L H 3X S+ 0 0 24 -4,-2.1 4,-1.0 1,-0.3 -1,-0.2 0.840 110.4 55.5 -46.9 -39.6 15.2 34.6 98.5 246 270 A L H 3< S+ 0 0 119 -4,-1.9 -1,-0.3 1,-0.2 4,-0.2 0.855 108.2 49.6 -64.3 -32.1 15.3 31.0 99.7 247 271 A A H X< S+ 0 0 12 -3,-1.6 3,-1.7 -4,-1.4 4,-0.2 0.907 104.8 55.9 -72.0 -44.3 13.6 32.1 102.9 248 272 A L H >< S+ 0 0 6 -4,-1.9 3,-1.2 1,-0.3 5,-0.3 0.685 93.1 72.3 -60.0 -23.1 10.8 34.1 101.1 249 273 A E T 3< S+ 0 0 158 -4,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.715 89.5 59.5 -68.9 -19.8 9.9 30.9 99.2 250 274 A A T < S+ 0 0 52 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.622 87.6 92.7 -81.0 -11.6 8.5 29.5 102.4 251 275 A I < - 0 0 10 -3,-1.2 2,-0.7 -4,-0.2 4,-0.2 -0.736 68.4-149.8 -92.0 117.1 6.0 32.4 102.7 252 276 A P S S+ 0 0 102 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.052 70.2 77.8 -75.3 30.3 2.6 31.8 101.1 253 277 A Y S S- 0 0 83 -2,-0.7 2,-1.5 -5,-0.3 -193,-0.1 -0.765 102.3 -64.1-131.7 175.4 2.1 35.4 100.1 254 278 A N > + 0 0 96 -195,-0.4 3,-0.5 -2,-0.2 4,-0.2 -0.437 50.2 175.3 -66.2 90.4 3.2 37.9 97.5 255 279 A T T 3> + 0 0 19 -2,-1.5 4,-2.4 -4,-0.2 5,-0.3 0.226 44.2 112.3 -79.5 13.4 6.9 38.0 98.3 256 280 A E H 3> S+ 0 0 90 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.896 75.0 41.1 -57.7 -50.7 7.6 40.3 95.3 257 281 A H H <> S+ 0 0 73 -3,-0.5 4,-1.1 2,-0.2 -1,-0.2 0.771 116.5 49.5 -76.7 -25.9 8.5 43.5 97.1 258 282 A L H > S+ 0 0 2 2,-0.2 4,-2.2 -4,-0.2 3,-0.5 0.963 112.9 44.7 -73.4 -58.6 10.7 41.8 99.8 259 283 A E H X S+ 0 0 67 -4,-2.4 4,-2.1 1,-0.3 -2,-0.2 0.911 113.9 53.1 -49.4 -45.1 12.7 39.7 97.3 260 284 A E H X S+ 0 0 20 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.3 0.848 106.4 52.1 -59.1 -35.8 13.0 42.8 95.2 261 285 A F H X S+ 0 0 1 -4,-1.1 4,-1.6 -3,-0.5 -1,-0.2 0.858 105.7 55.3 -71.3 -34.8 14.3 44.7 98.3 262 286 A A H >X S+ 0 0 3 -4,-2.2 4,-1.3 2,-0.2 3,-0.8 0.984 107.1 48.5 -59.4 -58.4 16.9 42.0 98.8 263 287 A R H >X S+ 0 0 81 -4,-2.1 4,-2.8 1,-0.3 3,-0.7 0.932 108.2 55.9 -45.6 -51.9 18.3 42.4 95.3 264 288 A Y H 3X S+ 0 0 3 -4,-2.1 4,-0.9 1,-0.2 -1,-0.3 0.863 100.2 60.2 -52.6 -37.0 18.4 46.2 95.8 265 289 A V H << S+ 0 0 1 -4,-1.6 -1,-0.2 -3,-0.8 -2,-0.2 0.918 118.4 26.6 -57.7 -43.6 20.6 45.7 98.8 266 290 A V H << S+ 0 0 27 -4,-1.3 -2,-0.2 -3,-0.7 -1,-0.2 0.687 120.7 53.7 -95.6 -20.8 23.3 44.0 96.9 267 291 A E H < S+ 0 0 68 -4,-2.8 -2,-0.2 -5,-0.3 -3,-0.2 0.448 82.0 123.7 -92.0 -0.7 22.8 45.4 93.4 268 292 A R < - 0 0 2 -4,-0.9 -3,-0.0 -5,-0.3 -4,-0.0 -0.355 48.6-164.8 -71.8 139.0 22.9 49.0 94.6 269 293 A K 0 0 171 -2,-0.1 -1,-0.2 1,-0.0 -3,-0.0 0.462 360.0 360.0 -88.7 -8.8 25.4 51.6 93.2 270 294 A N 0 0 130 0, 0.0 -2,-0.1 0, 0.0 -56,-0.1 0.215 360.0 360.0 -22.3 360.0 24.5 53.6 96.3