==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-MAR-13 4JXY . COMPND 2 MOLECULE: TRANS-HEXAPRENYLTRANSTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOALTEROMONAS ATLANTICA; . AUTHOR Y.PATSKOVSKY,R.TORO,R.BHOSLE,B.HILLERICH,R.D.SEIDEL,E.WASHIN . 311 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14674.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 247 79.4 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 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 207 66.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.3 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 1 0 3 1 1 2 0 0 0 0 1 0 0 1 1 1 1 0 1 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 -6 A E 0 0 236 0, 0.0 2,-0.9 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 -49.2 1.6 29.1 -62.7 2 -5 A N > - 0 0 109 1,-0.2 3,-1.1 2,-0.1 0, 0.0 -0.555 360.0-173.1 -69.7 101.0 1.9 25.5 -61.2 3 -4 A L T 3 S+ 0 0 154 -2,-0.9 3,-0.3 1,-0.3 -1,-0.2 0.674 82.7 52.1 -68.5 -19.4 -1.3 23.8 -62.4 4 -3 A Y T 3 + 0 0 197 1,-0.2 -1,-0.3 4,-0.0 4,-0.1 -0.162 69.1 124.9-110.7 39.0 -0.6 20.7 -60.3 5 -2 A F < + 0 0 147 -3,-1.1 2,-0.2 2,-0.1 -1,-0.2 0.853 54.5 80.7 -67.4 -34.4 -0.1 22.5 -57.1 6 -1 A Q S S- 0 0 142 -3,-0.3 2,-0.1 1,-0.1 3,-0.1 -0.466 87.0-116.6 -75.8 139.6 -2.8 20.5 -55.2 7 0 A S - 0 0 54 -2,-0.2 2,-0.2 1,-0.1 293,-0.1 -0.415 45.6 -85.6 -70.5 154.9 -1.8 17.0 -54.0 8 1 A M - 0 0 40 291,-0.5 -1,-0.1 1,-0.1 2,-0.1 -0.413 47.7-134.4 -67.8 129.5 -3.7 14.1 -55.6 9 2 A D > - 0 0 81 -2,-0.2 4,-2.5 1,-0.1 3,-0.3 -0.306 23.2-101.5 -83.5 169.9 -7.0 13.4 -53.9 10 3 A L H > S+ 0 0 75 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.892 118.1 54.9 -60.6 -43.5 -8.4 10.1 -52.9 11 4 A D H > S+ 0 0 116 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.906 111.8 44.6 -57.5 -41.1 -10.8 9.7 -55.9 12 5 A H H > S+ 0 0 121 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.897 113.4 50.6 -70.9 -40.0 -8.0 10.3 -58.3 13 6 A I H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.935 113.4 45.0 -58.6 -50.8 -5.8 7.9 -56.4 14 7 A L H X S+ 0 0 73 -4,-3.1 4,-1.0 2,-0.2 -2,-0.2 0.910 113.7 49.7 -65.5 -39.1 -8.4 5.2 -56.4 15 8 A S H >< S+ 0 0 78 -4,-2.5 3,-0.5 -5,-0.3 -1,-0.2 0.923 111.4 49.4 -62.9 -44.6 -9.3 5.7 -60.1 16 9 A L H 3< S+ 0 0 45 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.890 118.3 39.1 -58.1 -44.1 -5.7 5.5 -61.1 17 10 A A H 3X S+ 0 0 0 -4,-2.0 4,-2.6 -5,-0.2 3,-0.3 0.515 88.6 98.5 -81.9 -12.7 -5.1 2.3 -59.1 18 11 A E H S+ 0 0 96 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.932 116.1 43.3 -55.4 -43.1 -7.4 -1.7 -62.7 20 13 A D H > S+ 0 0 10 -3,-0.3 4,-2.4 -4,-0.3 -2,-0.2 0.926 113.3 51.5 -63.9 -44.5 -4.5 -3.0 -60.5 21 14 A M H X S+ 0 0 13 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.880 109.0 49.7 -64.8 -40.1 -6.6 -3.3 -57.4 22 15 A L H X S+ 0 0 77 -4,-2.8 4,-2.2 -5,-0.2 -1,-0.2 0.897 110.5 51.5 -65.7 -37.0 -9.4 -5.3 -59.2 23 16 A A H X S+ 0 0 34 -4,-1.7 4,-2.0 -5,-0.3 -2,-0.2 0.888 110.0 49.2 -64.5 -40.5 -6.7 -7.6 -60.5 24 17 A V H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.915 109.6 51.9 -62.1 -41.7 -5.4 -8.1 -57.0 25 18 A N H X S+ 0 0 20 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.928 109.2 49.6 -66.3 -39.5 -8.9 -8.8 -55.7 26 19 A Q H X S+ 0 0 148 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.919 111.0 49.6 -62.6 -42.5 -9.4 -11.4 -58.3 27 20 A L H X S+ 0 0 36 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.904 108.5 53.2 -64.1 -41.6 -6.1 -13.1 -57.5 28 21 A I H X S+ 0 0 0 -4,-2.7 4,-1.5 2,-0.2 -1,-0.2 0.912 108.8 49.9 -58.8 -42.0 -7.0 -13.1 -53.8 29 22 A Q H < S+ 0 0 51 -4,-2.2 4,-0.3 1,-0.2 3,-0.2 0.923 113.5 44.9 -62.0 -45.0 -10.3 -14.8 -54.6 30 23 A K H < S+ 0 0 158 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.725 117.2 46.2 -71.2 -22.6 -8.5 -17.5 -56.7 31 24 A Q H < S+ 0 0 44 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.563 98.0 67.6 -98.6 -15.4 -5.8 -17.9 -54.0 32 25 A V S < S+ 0 0 13 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.618 84.8 116.4 -72.2 -12.0 -8.2 -18.1 -51.1 33 26 A N + 0 0 89 -4,-0.3 2,-0.3 -5,-0.1 -3,-0.0 -0.299 29.7 143.8 -78.9 144.3 -9.2 -21.3 -52.5 34 27 A S - 0 0 19 2,-0.1 6,-0.1 -2,-0.1 -2,-0.0 -0.916 58.0-106.3-154.0 171.8 -8.9 -24.8 -51.1 35 28 A D S S+ 0 0 169 -2,-0.3 2,-0.8 1,-0.0 -2,-0.0 0.643 92.5 98.6 -78.5 -12.8 -10.9 -28.0 -51.1 36 29 A V >> - 0 0 83 1,-0.2 4,-1.6 2,-0.0 3,-1.1 -0.642 65.1-153.6 -87.7 108.9 -11.9 -27.4 -47.5 37 30 A S H 3> S+ 0 0 81 -2,-0.8 4,-2.2 1,-0.3 5,-0.2 0.837 91.1 54.2 -47.3 -48.7 -15.4 -25.8 -47.2 38 31 A L H 3> S+ 0 0 83 1,-0.2 4,-2.6 2,-0.2 5,-0.4 0.838 106.5 53.0 -61.2 -33.8 -14.8 -24.0 -43.9 39 32 A I H <> S+ 0 0 29 -3,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.915 110.0 48.9 -64.8 -41.5 -11.7 -22.3 -45.3 40 33 A N H X S+ 0 0 39 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.870 114.7 44.4 -68.4 -33.8 -13.7 -21.1 -48.2 41 34 A Q H X S+ 0 0 110 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.937 118.6 39.6 -77.4 -49.7 -16.5 -19.7 -46.0 42 35 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 5,-0.2 0.904 116.8 54.7 -63.5 -38.1 -14.4 -18.0 -43.4 43 36 A G H X S+ 0 0 0 -4,-2.2 4,-2.8 -5,-0.4 5,-0.3 0.928 107.9 47.3 -59.6 -50.3 -12.2 -16.9 -46.2 44 37 A F H X S+ 0 0 121 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.942 110.9 53.1 -55.3 -49.7 -15.1 -15.3 -48.1 45 38 A Y H < S+ 0 0 123 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.858 122.1 27.5 -55.9 -40.4 -16.2 -13.6 -44.9 46 39 A I H < S+ 0 0 20 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.697 133.0 23.7-101.1 -19.4 -12.8 -12.0 -44.2 47 40 A V H >< S+ 0 0 0 -4,-2.8 3,-1.9 -5,-0.2 4,-0.3 0.269 76.0 111.9-135.4 12.3 -11.1 -11.5 -47.6 48 41 A N T 3< S+ 0 0 67 -4,-1.5 3,-0.2 -5,-0.3 -19,-0.1 0.807 99.1 28.4 -62.1 -29.2 -13.6 -11.4 -50.4 49 42 A S T > S+ 0 0 53 -5,-0.2 3,-1.9 1,-0.1 -1,-0.3 0.008 85.7 125.5-114.5 28.0 -12.8 -7.7 -51.0 50 43 A G G X + 0 0 0 -3,-1.9 3,-0.7 1,-0.3 -2,-0.1 0.747 68.0 58.0 -60.2 -28.3 -9.2 -8.0 -49.7 51 44 A G G 3 S+ 0 0 0 -4,-0.3 -1,-0.3 1,-0.2 -26,-0.2 0.620 95.3 66.4 -78.8 -10.4 -7.7 -6.6 -52.9 52 45 A K G < S+ 0 0 122 -3,-1.9 -1,-0.2 -28,-0.1 2,-0.2 -0.055 87.3 102.9 -98.5 30.9 -9.7 -3.3 -52.4 53 46 A R S <> S- 0 0 70 -3,-0.7 4,-1.9 -32,-0.1 5,-0.1 -0.641 83.2 -98.7-119.3 171.6 -7.8 -2.3 -49.2 54 47 A L H > S+ 0 0 51 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.864 114.2 50.4 -58.1 -47.9 -5.1 0.1 -48.1 55 48 A R H > S+ 0 0 38 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.935 112.2 46.4 -67.5 -39.9 -2.1 -2.2 -48.1 56 49 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.888 111.5 54.2 -61.6 -37.9 -2.7 -3.6 -51.6 57 50 A L H X S+ 0 0 8 -4,-1.9 4,-2.5 2,-0.2 5,-0.3 0.949 109.9 46.6 -57.4 -52.3 -3.2 0.1 -52.7 58 51 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.915 113.2 49.8 -53.7 -46.7 0.2 1.1 -51.3 59 52 A T H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.920 112.7 43.3 -65.4 -45.6 1.8 -1.9 -52.8 60 53 A V H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 5,-0.2 0.891 114.1 50.8 -71.6 -36.9 0.5 -1.4 -56.4 61 54 A L H X S+ 0 0 1 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.926 111.2 50.0 -63.1 -43.6 1.1 2.3 -56.3 62 55 A A H X S+ 0 0 0 -4,-2.5 4,-1.1 -5,-0.3 -2,-0.2 0.932 111.4 47.2 -59.7 -45.3 4.7 1.7 -55.2 63 56 A A H <>S+ 0 0 0 -4,-2.1 5,-1.9 1,-0.2 3,-0.2 0.889 113.6 47.0 -67.4 -40.2 5.4 -0.8 -57.9 64 57 A R H ><5S+ 0 0 60 -4,-2.2 3,-1.8 1,-0.2 -1,-0.2 0.856 106.3 58.6 -70.4 -35.4 3.9 1.4 -60.6 65 58 A A H 3<5S+ 0 0 9 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.798 107.2 50.0 -60.3 -25.4 5.9 4.4 -59.3 66 59 A L T 3<5S- 0 0 12 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.153 119.9-113.2-100.8 16.2 9.0 2.2 -59.9 67 60 A N T < 5 - 0 0 123 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.848 39.0-162.2 61.3 40.4 7.9 1.3 -63.5 68 61 A I < - 0 0 7 -5,-1.9 -1,-0.2 1,-0.1 117,-0.1 -0.273 11.5-165.1 -55.1 138.8 7.2 -2.4 -62.9 69 62 A Q + 0 0 157 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.380 67.5 52.2-109.5 -1.7 7.1 -4.3 -66.2 70 63 A T S S- 0 0 59 0, 0.0 3,-0.2 0, 0.0 115,-0.0 -0.475 86.1-113.0-117.1-170.9 5.5 -7.5 -64.9 71 64 A E S >> S+ 0 0 111 -2,-0.2 3,-1.7 1,-0.1 4,-0.9 0.117 79.9 114.9-110.4 20.3 2.3 -8.3 -62.8 72 65 A Q H 3> + 0 0 66 1,-0.3 4,-2.3 2,-0.2 5,-0.1 0.749 65.2 67.2 -64.6 -23.1 4.4 -9.5 -59.8 73 66 A H H 3> S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.730 92.6 59.4 -67.3 -24.1 3.1 -6.6 -57.8 74 67 A H H <> S+ 0 0 25 -3,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.927 108.3 44.9 -66.5 -45.1 -0.4 -8.2 -57.9 75 68 A T H X S+ 0 0 28 -4,-0.9 4,-2.6 2,-0.2 -2,-0.2 0.929 113.7 50.3 -58.9 -47.3 1.1 -11.3 -56.2 76 69 A L H X S+ 0 0 1 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.923 108.7 51.4 -59.2 -43.8 3.0 -9.1 -53.7 77 70 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.905 110.7 48.1 -62.2 -40.4 -0.1 -7.1 -52.9 78 71 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.911 110.4 52.5 -66.2 -41.7 -2.0 -10.3 -52.2 79 72 A I H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.951 110.6 47.7 -55.5 -49.5 0.8 -11.6 -50.0 80 73 A I H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.904 112.7 47.4 -62.8 -44.7 0.9 -8.4 -47.9 81 74 A E H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.857 109.2 54.0 -67.8 -32.9 -2.9 -8.4 -47.4 82 75 A F H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.910 109.3 49.4 -64.6 -41.4 -2.9 -12.1 -46.5 83 76 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.926 113.1 46.7 -59.8 -45.8 -0.2 -11.4 -43.8 84 77 A H H X S+ 0 0 31 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.929 113.9 46.8 -62.4 -46.7 -2.3 -8.5 -42.5 85 78 A T H X S+ 0 0 5 -4,-2.8 4,-2.5 2,-0.2 5,-0.2 0.929 111.6 51.2 -64.2 -44.8 -5.6 -10.5 -42.5 86 79 A A H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.933 111.4 49.1 -55.8 -47.4 -3.8 -13.5 -40.7 87 80 A T H X S+ 0 0 12 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.875 110.1 50.4 -56.7 -44.9 -2.5 -11.1 -38.1 88 81 A L H X S+ 0 0 76 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.908 109.7 50.2 -62.7 -46.6 -5.9 -9.5 -37.5 89 82 A L H X S+ 0 0 9 -4,-2.5 4,-0.8 1,-0.2 3,-0.3 0.941 114.0 45.1 -56.8 -48.0 -7.6 -12.9 -37.1 90 83 A H H >X S+ 0 0 41 -4,-2.4 4,-1.6 1,-0.2 3,-0.6 0.883 110.8 53.2 -66.9 -37.8 -5.0 -13.9 -34.6 91 84 A D H 3X S+ 0 0 23 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.777 103.1 57.9 -66.1 -29.0 -5.1 -10.6 -32.7 92 85 A D H 3< S+ 0 0 41 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.689 103.4 53.2 -79.7 -17.4 -8.9 -10.9 -32.3 93 86 A V H << S+ 0 0 43 -4,-0.8 -2,-0.2 -3,-0.6 -1,-0.2 0.965 109.6 47.4 -69.5 -55.7 -8.5 -14.2 -30.5 94 87 A V H < 0 0 77 -4,-1.6 -2,-0.2 1,-0.1 -1,-0.1 0.692 360.0 360.0 -65.3 -25.1 -6.1 -12.7 -28.0 95 88 A D < 0 0 118 -4,-1.3 -1,-0.1 -5,-0.1 -4,-0.0 -0.582 360.0 360.0 -68.7 360.0 -8.4 -9.7 -27.4 96 ! 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 97 98 A T > 0 0 65 0, 0.0 4,-2.0 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 151.3 -15.2 -10.4 -36.0 98 99 A A H > + 0 0 5 1,-0.2 4,-4.3 2,-0.2 5,-0.4 0.844 360.0 53.0 -59.3 -36.6 -14.5 -13.8 -37.6 99 100 A N H > S+ 0 0 23 2,-0.2 4,-1.7 3,-0.2 -1,-0.2 0.880 108.8 48.9 -69.0 -35.7 -13.7 -15.5 -34.2 100 101 A E H 4 S+ 0 0 157 -3,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.891 122.6 36.4 -64.2 -38.3 -17.0 -14.3 -32.6 101 102 A V H < S+ 0 0 83 -4,-2.0 -2,-0.2 1,-0.1 -3,-0.2 0.932 136.0 18.8 -81.3 -50.4 -18.7 -15.7 -35.7 102 103 A F H X S- 0 0 63 -4,-4.3 4,-0.5 1,-0.2 -3,-0.2 0.468 112.7-105.0-101.8 -4.8 -16.7 -18.8 -36.5 103 104 A G H X - 0 0 28 -4,-1.7 4,-1.9 -5,-0.4 -1,-0.2 0.031 31.3 -83.8 93.2 151.0 -14.9 -19.4 -33.1 104 105 A N H > S+ 0 0 82 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.903 123.4 58.1 -49.1 -48.5 -11.4 -18.8 -31.9 105 106 A Q H > S+ 0 0 46 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.927 108.9 39.7 -59.6 -50.9 -10.3 -22.1 -33.3 106 107 A A H X S+ 0 0 15 -4,-0.5 4,-3.5 2,-0.2 5,-0.4 0.919 113.9 54.4 -66.3 -47.7 -11.3 -21.7 -36.9 107 108 A S H X S+ 0 0 0 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.896 110.5 48.0 -52.4 -43.4 -10.1 -18.0 -37.0 108 109 A V H X S+ 0 0 49 -4,-2.7 4,-2.0 -5,-0.2 -2,-0.2 0.952 116.1 42.8 -60.7 -46.5 -6.7 -19.2 -35.7 109 110 A L H X S+ 0 0 114 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.887 113.4 48.8 -76.6 -39.3 -6.4 -22.0 -38.2 110 111 A V H X S+ 0 0 4 -4,-3.5 4,-2.7 2,-0.2 -1,-0.2 0.835 108.3 57.5 -64.6 -35.2 -7.7 -20.0 -41.3 111 112 A G H X S+ 0 0 0 -4,-1.8 4,-2.6 -5,-0.4 -2,-0.2 0.932 107.9 46.4 -53.7 -47.8 -5.2 -17.4 -40.2 112 113 A D H X S+ 0 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195 A A H X S+ 0 0 6 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.933 112.9 43.3 -60.3 -47.9 13.8 5.6 -50.0 195 196 A M H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -16,-0.3 0.894 112.0 53.9 -68.6 -41.5 10.8 3.3 -50.5 196 197 A Q H X S+ 0 0 49 -4,-2.7 4,-2.3 -18,-0.2 -1,-0.2 0.931 110.6 46.2 -56.4 -49.8 11.4 1.5 -47.2 197 198 A D H X S+ 0 0 52 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.895 108.5 56.3 -61.0 -41.9 11.4 4.7 -45.3 198 199 A Y H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.956 111.5 43.1 -55.0 -50.3 8.3 5.9 -47.1 199 200 A G H X S+ 0 0 0 -4,-2.4 4,-2.8 -24,-0.2 -24,-0.4 0.920 112.8 52.1 -61.7 -44.7 6.4 2.8 -46.0 200 201 A K H X S+ 0 0 48 -4,-2.3 4,-2.0 -26,-0.2 -1,-0.2 0.948 115.1 40.5 -59.0 -51.3 7.7 2.8 -42.4 201 202 A Y H X S+ 0 0 56 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.883 114.2 52.7 -69.1 -38.5 6.7 6.4 -41.8 202 203 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.3 -1,-0.2 0.929 110.4 47.8 -59.1 -47.9 3.4 6.1 -43.6 203 204 A G H X S+ 0 0 0 -4,-2.8 4,-2.1 -32,-0.2 -2,-0.2 0.892 110.1 53.1 -62.1 -36.3 2.4 3.1 -41.5 204 205 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