==== 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 PROTEIN TRANSPORT 11-SEP-06 2IBM . COMPND 2 MOLECULE: PREPROTEIN TRANSLOCASE SECA SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR J.ZIMMER,W.LI,T.A.RAPOPORT . 1550 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 66849.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1116 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 119 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.1 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 . 2 0.1 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 . 76 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 188 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 638 41.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 43 2.8 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 2 3 4 4 6 2 4 1 2 4 2 2 2 4 2 1 0 1 0 0 0 0 0 2 1 2 RESIDUES PER ALPHA HELIX . 1 3 7 6 7 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 . 3 0 1 3 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 . 2 2 0 0 1 3 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 0 240 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 20.7 -37.3 -5.2 -10.5 2 2 A L - 0 0 170 2,-0.0 3,-0.1 0, 0.0 0, 0.0 -0.469 360.0 -43.5 -75.6 150.3 -38.3 -8.3 -12.6 3 3 A G S S- 0 0 74 -2,-0.1 2,-0.3 1,-0.1 0, 0.0 0.088 85.5 -89.9 29.2-136.8 -37.3 -11.8 -11.3 4 4 A I > - 0 0 103 379,-0.0 3,-0.6 0, 0.0 -1,-0.1 -0.853 38.0-108.3-160.0 139.3 -33.7 -11.6 -10.0 5 5 A L T 3 S+ 0 0 35 -2,-0.3 375,-0.1 1,-0.2 374,-0.1 -0.266 93.1 27.8 -68.2 152.8 -30.6 -12.2 -12.1 6 6 A N T 3 S+ 0 0 36 373,-0.6 -1,-0.2 371,-0.1 1508,-0.1 0.687 92.1 104.0 79.3 12.0 -28.3 -15.3 -11.7 7 7 A K S < S- 0 0 119 -3,-0.6 2,-0.4 372,-0.2 1507,-0.2 0.687 79.0 -54.1-102.5 -92.5 -31.0 -17.7 -10.4 8 8 A M + 0 0 123 1506,-0.1 2,-0.2 371,-0.0 -1,-0.1 -0.969 49.1 156.9-153.9 148.8 -32.3 -20.2 -12.8 9 9 A F - 0 0 115 -2,-0.4 374,-0.1 1,-0.2 373,-0.0 -0.840 44.8 -35.8-147.0-171.1 -33.9 -20.6 -16.3 10 10 A D - 0 0 106 -2,-0.2 -1,-0.2 372,-0.1 372,-0.0 0.178 59.2 -75.4 -60.9 171.7 -34.3 -23.4 -19.0 11 11 A P - 0 0 84 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.635 9.8-144.9 -58.2-179.8 -32.2 -26.3 -20.5 12 12 A T S S+ 0 0 82 1,-0.1 378,-0.0 3,-0.1 377,-0.0 -0.953 72.4 42.8-147.7 155.3 -29.5 -28.2 -22.5 13 13 A K S S+ 0 0 142 -2,-0.3 -1,-0.1 1,-0.1 0, 0.0 0.754 104.8 61.3 72.3 30.9 -29.4 -31.5 -24.4 14 14 A R S > S+ 0 0 217 -3,-0.0 4,-1.3 3,-0.0 -1,-0.1 0.153 106.6 49.5-135.5 -33.4 -32.7 -31.4 -26.1 15 15 A T H > S+ 0 0 27 2,-0.2 4,-1.4 1,-0.1 5,-0.1 0.915 113.5 45.9 -68.8 -43.6 -31.4 -28.3 -27.8 16 16 A L H > S+ 0 0 30 2,-0.2 4,-2.9 1,-0.2 -1,-0.1 0.887 110.2 50.4 -66.2 -46.9 -28.1 -30.0 -28.8 17 17 A N H > S+ 0 0 87 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.869 108.4 55.1 -62.5 -35.5 -29.6 -33.3 -30.1 18 18 A R H X S+ 0 0 113 -4,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.896 110.2 46.1 -60.0 -44.1 -32.0 -31.2 -32.2 19 19 A Y H X S+ 0 0 1 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.928 107.7 56.1 -64.6 -51.1 -28.9 -29.4 -33.7 20 20 A E H X S+ 0 0 89 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.883 107.5 50.2 -43.5 -49.3 -27.1 -32.6 -34.3 21 21 A K H X S+ 0 0 128 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.935 108.7 51.4 -60.6 -51.4 -30.0 -33.8 -36.3 22 22 A I H X S+ 0 0 20 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.884 109.4 50.6 -48.6 -48.9 -30.1 -30.6 -38.4 23 23 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.944 110.9 47.8 -60.4 -50.8 -26.3 -31.0 -39.2 24 24 A N H X S+ 0 0 68 -4,-2.5 4,-0.8 1,-0.2 -1,-0.2 0.857 110.3 52.8 -58.3 -36.0 -26.8 -34.6 -40.3 25 25 A D H X S+ 0 0 55 -4,-2.5 4,-1.4 2,-0.2 3,-0.3 0.880 107.5 52.7 -63.3 -37.1 -29.8 -33.4 -42.4 26 26 A I H < S+ 0 0 0 -4,-2.2 3,-0.4 1,-0.2 -2,-0.2 0.965 108.4 48.7 -63.0 -48.4 -27.4 -30.8 -43.9 27 27 A D H >< S+ 0 0 33 -4,-2.5 3,-0.9 1,-0.2 -1,-0.2 0.697 103.3 66.2 -60.8 -20.1 -24.9 -33.6 -44.8 28 28 A A H >< S+ 0 0 74 -4,-0.8 3,-0.5 -3,-0.3 -1,-0.2 0.940 105.5 37.8 -74.9 -46.8 -27.8 -35.5 -46.3 29 29 A I G >< S+ 0 0 42 -4,-1.4 3,-1.3 -3,-0.4 -1,-0.3 0.128 85.3 115.5 -85.6 22.0 -28.5 -33.1 -49.1 30 30 A R G < S+ 0 0 136 -3,-0.9 4,-0.5 1,-0.3 3,-0.4 0.708 74.7 51.7 -65.6 -20.4 -24.7 -32.6 -49.4 31 31 A G G <> S+ 0 0 31 -3,-0.5 4,-0.6 1,-0.2 -1,-0.3 0.640 89.6 78.4 -90.1 -16.6 -24.7 -34.1 -52.9 32 32 A D T <4 S+ 0 0 109 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.575 110.8 22.9 -70.0 -8.5 -27.5 -31.9 -54.1 33 33 A Y T 4 S+ 0 0 13 -3,-0.4 3,-0.5 -4,-0.3 -1,-0.2 0.480 99.1 90.6-130.7 -16.1 -25.1 -29.0 -54.7 34 34 A E T 4 S+ 0 0 115 -4,-0.5 -2,-0.1 1,-0.3 -3,-0.1 0.798 101.9 26.0 -65.8 -35.8 -21.7 -30.7 -55.0 35 35 A N S < S+ 0 0 140 -4,-0.6 -1,-0.3 2,-0.0 -3,-0.1 0.331 94.7 120.0-113.1 8.0 -21.8 -31.1 -58.8 36 36 A L - 0 0 55 -3,-0.5 -3,-0.1 1,-0.1 -4,-0.0 -0.321 69.9-106.5 -61.3 149.7 -24.1 -28.2 -59.5 37 37 A S > - 0 0 67 1,-0.1 4,-1.0 4,-0.0 -1,-0.1 -0.114 28.8-107.5 -69.5 178.1 -22.7 -25.4 -61.7 38 38 A D H > S+ 0 0 81 2,-0.2 4,-2.0 3,-0.1 5,-0.1 0.833 117.8 49.5 -79.8 -33.0 -21.7 -22.1 -60.3 39 39 A D H > S+ 0 0 135 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.986 106.8 52.7 -69.0 -57.8 -24.6 -20.3 -61.8 40 40 A A H 4 S+ 0 0 38 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.824 110.0 52.3 -45.6 -39.4 -27.3 -22.7 -60.6 41 41 A L H >X S+ 0 0 0 -4,-1.0 3,-3.3 2,-0.2 4,-0.6 0.987 106.4 49.9 -60.2 -59.1 -25.8 -22.3 -57.1 42 42 A K H >X S+ 0 0 104 -4,-2.0 3,-1.5 1,-0.3 4,-0.8 0.883 102.0 65.0 -52.7 -40.0 -26.0 -18.5 -57.1 43 43 A H H 3X S+ 0 0 102 -4,-2.5 4,-2.9 1,-0.3 -1,-0.3 0.715 86.5 72.0 -50.7 -25.0 -29.6 -18.8 -58.2 44 44 A K H <> S+ 0 0 39 -3,-3.3 4,-3.2 -4,-0.4 -1,-0.3 0.900 89.7 58.9 -63.9 -39.2 -30.4 -20.5 -54.9 45 45 A T H S+ 0 0 76 -4,-2.3 5,-2.4 -5,-0.3 4,-1.3 0.898 108.7 53.7 -68.7 -40.8 -39.7 -18.5 -51.2 52 52 A L H <5S+ 0 0 26 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.892 112.7 42.0 -60.7 -43.1 -39.4 -16.4 -48.1 53 53 A E H <5S+ 0 0 176 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.842 106.5 61.2 -78.3 -32.1 -41.6 -13.6 -49.3 54 54 A K H <5S- 0 0 186 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.803 136.4 -73.3 -65.1 -29.0 -44.2 -16.0 -50.8 55 55 A G T <5S+ 0 0 61 -4,-1.3 -3,-0.2 1,-0.2 -2,-0.1 0.320 91.4 123.1 157.8 -10.1 -44.7 -17.4 -47.3 56 56 A A < - 0 0 31 -5,-2.4 2,-0.2 -6,-0.1 -1,-0.2 -0.312 51.0-126.8 -76.7 159.5 -41.9 -19.5 -46.2 57 57 A T > - 0 0 51 1,-0.1 4,-0.9 -2,-0.0 5,-0.1 -0.671 19.6-116.0-105.3 157.6 -39.8 -18.9 -43.0 58 58 A T T >4 S+ 0 0 32 1,-0.2 3,-0.9 -2,-0.2 7,-0.2 0.897 122.8 52.4 -51.6 -40.2 -36.1 -18.5 -42.4 59 59 A D G >4 S+ 0 0 99 1,-0.3 3,-1.4 2,-0.2 4,-0.4 0.862 100.6 62.4 -68.8 -35.9 -36.5 -21.6 -40.3 60 60 A D G 34 S+ 0 0 106 1,-0.3 -1,-0.3 2,-0.1 -2,-0.2 0.712 111.8 35.1 -61.0 -25.1 -38.2 -23.4 -43.2 61 61 A L G S+ 0 0 10 -3,-1.4 4,-2.8 2,-0.2 5,-0.4 0.997 76.7 48.3 -61.8 -70.1 -32.5 -23.6 -42.8 63 63 A V H > S+ 0 0 44 -4,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.816 120.5 40.3 -34.4 -52.0 -31.2 -27.1 -43.8 64 64 A E H > S+ 0 0 45 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.934 112.9 50.5 -69.8 -52.4 -30.9 -25.9 -47.4 65 65 A A H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.919 113.7 47.8 -52.6 -45.2 -29.6 -22.4 -47.0 66 66 A F H X S+ 0 0 0 -4,-2.8 4,-2.5 -5,-0.3 -1,-0.2 0.904 109.3 53.3 -63.0 -43.7 -26.9 -23.9 -44.8 67 67 A A H X S+ 0 0 5 -4,-1.9 4,-2.1 -5,-0.4 -1,-0.2 0.827 109.6 49.3 -57.2 -39.0 -26.2 -26.6 -47.4 68 68 A V H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.900 111.6 47.1 -67.7 -46.2 -25.8 -23.9 -50.1 69 69 A V H X S+ 0 0 1 -4,-2.3 4,-3.1 2,-0.2 -2,-0.2 0.886 110.9 54.3 -65.2 -36.7 -23.4 -21.8 -47.9 70 70 A R H X S+ 0 0 12 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.970 111.8 41.9 -58.4 -56.1 -21.5 -25.0 -47.1 71 71 A E H X S+ 0 0 11 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.905 114.5 52.8 -58.7 -44.0 -21.0 -25.8 -50.8 72 72 A A H >X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 3,-1.5 0.971 108.6 49.7 -51.8 -60.2 -20.2 -22.2 -51.6 73 73 A S H 3X>S+ 0 0 0 -4,-3.1 4,-2.8 1,-0.3 5,-1.7 0.896 107.7 53.5 -43.3 -56.7 -17.5 -22.0 -48.9 74 74 A R H 3<5S+ 0 0 133 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.744 114.5 43.6 -51.8 -30.0 -15.9 -25.3 -50.2 75 75 A R H <<5S+ 0 0 74 -3,-1.5 -1,-0.3 -4,-1.2 -2,-0.2 0.768 125.1 30.5 -89.9 -29.4 -15.7 -23.6 -53.6 76 76 A V H <5S+ 0 0 43 -4,-2.1 -2,-0.2 -3,-0.3 -3,-0.2 0.895 134.1 21.9 -98.3 -50.2 -14.5 -20.2 -52.5 77 77 A T T <5S- 0 0 35 -4,-2.8 -3,-0.2 2,-0.2 -4,-0.1 0.763 97.3-119.8 -89.0 -26.2 -12.4 -20.7 -49.4 78 78 A G S - 0 0 92 1,-0.1 4,-2.8 4,-0.0 3,-0.3 -0.240 23.9-103.6 -73.5 165.6 -17.8 -29.5 -40.4 83 83 A K H > S+ 0 0 79 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.861 123.3 58.5 -57.7 -37.1 -20.9 -30.8 -38.7 84 84 A V H > S+ 0 0 16 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.935 109.2 44.5 -60.1 -41.6 -19.7 -29.1 -35.5 85 85 A Q H > S+ 0 0 8 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.970 108.6 54.9 -65.9 -53.0 -19.7 -25.8 -37.4 86 86 A L H X S+ 0 0 0 -4,-2.8 4,-1.4 1,-0.3 -1,-0.2 0.886 109.7 49.9 -39.9 -48.8 -23.1 -26.5 -39.0 87 87 A M H X S+ 0 0 16 -4,-2.6 4,-2.3 1,-0.2 -1,-0.3 0.904 104.7 58.1 -55.7 -46.6 -24.3 -26.9 -35.4 88 88 A G H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.936 102.1 54.9 -47.9 -52.2 -22.6 -23.6 -34.5 89 89 A G H X S+ 0 0 0 -4,-2.2 4,-3.3 1,-0.2 -1,-0.2 0.876 106.3 49.4 -53.9 -45.6 -24.8 -21.9 -37.1 90 90 A V H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.934 106.1 56.6 -59.6 -47.9 -28.0 -23.1 -35.6 91 91 A A H <>S+ 0 0 0 -4,-2.3 5,-1.9 1,-0.2 -1,-0.2 0.904 115.7 38.5 -48.0 -46.7 -26.9 -22.0 -32.1 92 92 A L H ><5S+ 0 0 0 -4,-2.0 3,-2.0 3,-0.2 -2,-0.2 0.848 109.8 58.7 -72.3 -40.6 -26.5 -18.5 -33.7 93 93 A H H 3<5S+ 0 0 2 -4,-3.3 -2,-0.2 1,-0.3 -1,-0.2 0.818 103.2 55.0 -62.4 -29.4 -29.6 -18.7 -35.9 94 94 A D T 3<5S- 0 0 53 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.290 122.2-109.4 -81.5 7.8 -31.6 -19.3 -32.6 95 95 A G T < 5S+ 0 0 9 -3,-2.0 -3,-0.2 1,-0.2 272,-0.2 0.886 78.3 130.9 61.2 40.7 -30.1 -16.1 -31.3 96 96 A N < - 0 0 6 -5,-1.9 273,-1.9 -6,-0.2 2,-0.6 -0.478 66.8 -94.7-107.1-179.6 -28.0 -18.0 -28.8 97 97 A I E -ab 369 389A 0 291,-2.5 293,-3.0 271,-0.2 2,-0.8 -0.900 31.6-150.3 -96.6 123.2 -24.4 -18.0 -27.8 98 98 A A E -ab 370 390A 0 271,-3.4 273,-1.3 -2,-0.6 2,-0.8 -0.868 10.8-160.3 -91.7 112.2 -22.4 -20.6 -29.7 99 99 A E E +ab 371 391A 11 291,-3.3 293,-2.8 -2,-0.8 2,-0.3 -0.851 25.9 153.3 -95.1 103.6 -19.6 -21.6 -27.5 100 100 A M - 0 0 4 271,-1.1 4,-0.1 -2,-0.8 3,-0.1 -0.957 41.1-110.5-125.8 146.5 -16.8 -23.2 -29.5 101 101 A K > - 0 0 81 -2,-0.3 3,-1.1 291,-0.3 4,-0.2 -0.219 43.3 -73.8 -82.0 164.7 -13.2 -23.2 -28.5 102 102 A T T 3 S+ 0 0 35 1,-0.2 -1,-0.2 2,-0.1 427,-0.1 -0.351 120.9 30.0 -58.0 124.7 -10.2 -21.4 -30.0 103 103 A G T 3 S+ 0 0 5 425,-0.1 -1,-0.2 -2,-0.1 426,-0.1 0.581 91.0 109.6 100.1 18.4 -9.2 -23.0 -33.3 104 104 A E S < S- 0 0 10 -3,-1.1 -2,-0.1 -4,-0.1 -3,-0.1 0.666 87.1-102.1-102.2 -21.9 -12.7 -24.2 -34.1 105 105 A G > + 0 0 31 -4,-0.2 4,-2.3 -5,-0.1 5,-0.2 0.816 54.9 158.7 103.2 39.9 -13.9 -22.1 -37.1 106 106 A K H > S+ 0 0 22 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.957 73.8 54.4 -59.8 -53.8 -16.2 -19.5 -35.6 107 107 A T H > S+ 0 0 29 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.889 109.7 48.2 -49.7 -46.5 -15.9 -17.0 -38.5 108 108 A L H >> S+ 0 0 10 1,-0.2 3,-1.1 2,-0.2 4,-1.0 0.972 109.9 52.0 -56.0 -52.7 -16.9 -19.7 -41.0 109 109 A T H >< S+ 0 0 0 -4,-2.3 3,-0.6 1,-0.3 5,-0.2 0.857 102.6 60.7 -53.1 -38.2 -19.8 -20.7 -38.8 110 110 A S H 3X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 -1,-0.3 0.873 95.5 60.5 -61.1 -37.9 -20.9 -17.1 -38.8 111 111 A T H S+ 0 0 0 0, 0.0 4,-3.0 0, 0.0 -1,-0.2 0.820 117.4 65.0 -77.1 -26.1 -26.6 -18.0 -40.3 114 114 A V H X S+ 0 0 0 -4,-2.5 4,-0.7 -5,-0.2 -2,-0.2 0.978 107.9 43.1 -54.1 -56.3 -25.4 -14.5 -41.4 115 115 A Y H >X S+ 0 0 0 -4,-3.1 3,-2.3 -5,-0.2 4,-0.8 0.957 112.5 51.8 -46.5 -63.6 -26.4 -15.5 -44.9 116 116 A L H >< S+ 0 0 1 -4,-1.9 3,-1.1 1,-0.3 4,-0.2 0.906 115.8 40.9 -43.7 -53.4 -29.7 -17.1 -43.9 117 117 A N H 3< S+ 0 0 5 -4,-3.0 -1,-0.3 1,-0.2 5,-0.2 0.451 107.3 63.0 -81.9 0.9 -30.8 -14.0 -42.0 118 118 A A H X< S+ 0 0 0 -3,-2.3 3,-0.9 -4,-0.7 -1,-0.2 0.519 80.5 82.6 -97.8 -9.6 -29.5 -11.6 -44.6 119 119 A L T << S+ 0 0 8 -3,-1.1 -1,-0.1 -4,-0.8 -2,-0.1 0.699 79.1 66.8 -70.8 -22.6 -31.9 -12.8 -47.3 120 120 A T T 3 S- 0 0 60 -4,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.800 103.7-129.1 -64.3 -32.4 -34.7 -10.6 -46.0 121 121 A G S < S+ 0 0 33 -3,-0.9 -2,-0.1 -4,-0.1 -3,-0.1 0.455 80.8 115.4 88.7 2.4 -32.7 -7.5 -47.0 122 122 A K S S- 0 0 125 -5,-0.2 80,-0.2 1,-0.2 -4,-0.1 0.709 78.8-120.1 -67.1 -26.2 -33.2 -6.1 -43.5 123 123 A G - 0 0 2 -5,-0.2 80,-0.6 -6,-0.2 2,-0.3 -0.094 18.9-126.3 98.6 159.3 -29.4 -6.4 -43.0 124 124 A V E -cd 172 203A 0 47,-0.8 49,-2.6 46,-0.3 2,-0.6 -0.997 8.4-145.2-144.7 143.6 -27.0 -8.2 -40.6 125 125 A H E -cd 173 204A 8 78,-1.2 80,-3.1 -2,-0.3 2,-0.8 -0.935 6.0-162.9-120.2 116.5 -24.2 -6.9 -38.3 126 126 A V E -cd 174 205A 5 47,-2.4 49,-1.3 -2,-0.6 2,-0.4 -0.851 20.2-156.1-103.6 105.5 -21.2 -9.1 -37.8 127 127 A V E +cd 175 206A 0 78,-3.3 80,-3.9 -2,-0.8 2,-0.3 -0.699 19.7 167.9 -98.0 127.2 -19.5 -7.7 -34.7 128 128 A T E -c 176 0A 3 47,-2.0 49,-1.7 -2,-0.4 80,-0.1 -0.803 42.8-108.9-124.8 176.0 -15.9 -8.1 -33.7 129 129 A V S S+ 0 0 22 -2,-0.3 2,-0.3 47,-0.2 49,-0.3 0.753 89.4 17.0 -77.0 -28.3 -13.7 -6.4 -31.1 130 130 A N S > S- 0 0 22 45,-0.1 4,-1.6 1,-0.1 3,-0.3 -0.975 77.0-100.5-150.7 155.7 -11.5 -4.2 -33.3 131 131 A E H > S+ 0 0 70 -2,-0.3 4,-2.4 1,-0.2 3,-0.4 0.839 114.9 50.3 -36.0 -59.6 -10.9 -2.6 -36.7 132 132 A Y H > S+ 0 0 52 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.893 107.3 52.0 -58.2 -47.4 -8.5 -5.2 -38.0 133 133 A L H > S+ 0 0 0 -3,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.774 113.8 45.9 -65.9 -28.8 -10.5 -8.3 -37.2 134 134 A A H X S+ 0 0 0 -4,-1.6 4,-3.5 -3,-0.4 5,-0.4 0.969 111.3 49.3 -66.5 -72.7 -13.5 -6.8 -39.0 135 135 A S H X S+ 0 0 37 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.780 116.3 45.8 -35.2 -42.7 -11.5 -5.6 -42.1 136 136 A R H X S+ 0 0 43 -4,-2.7 4,-2.3 -5,-0.2 5,-0.2 0.986 115.6 42.1 -68.5 -60.8 -10.0 -9.1 -42.3 137 137 A D H X>S+ 0 0 6 -4,-1.6 4,-2.2 1,-0.2 5,-0.6 0.829 116.1 53.0 -52.3 -35.8 -13.2 -11.1 -41.8 138 138 A A H X5S+ 0 0 11 -4,-3.5 4,-0.6 1,-0.2 -1,-0.2 0.906 112.3 43.6 -66.4 -44.8 -15.0 -8.6 -44.1 139 139 A E H X5S+ 0 0 152 -4,-2.0 4,-0.7 -5,-0.4 -2,-0.2 0.797 121.4 38.8 -72.1 -31.4 -12.3 -9.2 -46.8 140 140 A Q H X5S+ 0 0 103 -4,-2.3 4,-0.7 2,-0.2 -2,-0.2 0.910 126.5 30.3 -92.3 -47.7 -12.2 -13.0 -46.5 141 141 A M H X5S+ 0 0 8 -4,-2.2 4,-2.2 -5,-0.2 5,-0.3 0.653 105.2 79.2 -81.6 -23.9 -15.8 -14.1 -45.9 142 142 A G H XS+ 0 0 1 -4,-2.2 5,-0.7 -3,-0.2 4,-0.4 0.914 112.6 51.2 -62.3 -43.2 -21.3 -13.9 -49.4 146 146 A E H ><5S+ 0 0 105 -4,-2.4 3,-2.0 -5,-0.3 -1,-0.2 0.909 104.1 59.0 -63.6 -39.5 -20.7 -12.0 -52.6 147 147 A F H 3<5S+ 0 0 46 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.849 104.5 49.8 -58.9 -35.4 -20.4 -15.3 -54.5 148 148 A L T 3<5S- 0 0 1 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.535 131.7 -95.1 -83.1 -1.4 -23.9 -16.1 -53.4 149 149 A G T < 5S+ 0 0 27 -3,-2.0 2,-0.3 -4,-0.4 -3,-0.2 0.893 80.4 127.8 92.1 52.4 -25.1 -12.7 -54.6 150 150 A L < - 0 0 7 -5,-0.7 2,-0.6 -4,-0.2 -1,-0.3 -0.981 56.5-116.7-139.8 148.1 -25.0 -10.5 -51.5 151 151 A T - 0 0 76 -2,-0.3 21,-2.9 18,-0.1 2,-0.3 -0.758 23.8-161.4 -90.4 120.8 -23.5 -7.2 -50.6 152 152 A V E -e 172 0A 28 -2,-0.6 2,-0.4 19,-0.2 21,-0.2 -0.741 9.1-165.7 -94.5 147.2 -20.8 -7.1 -47.9 153 153 A G E -e 173 0A 8 19,-1.5 21,-3.6 -2,-0.3 2,-0.5 -0.997 11.6-152.3-138.0 134.7 -20.0 -3.7 -46.1 154 154 A L E -e 174 0A 51 -2,-0.4 2,-0.6 19,-0.2 21,-0.2 -0.925 9.4-161.6-109.5 125.9 -17.1 -2.6 -43.9 155 155 A N E +e 175 0A 0 19,-2.8 21,-0.5 -2,-0.5 2,-0.3 -0.911 18.5 167.7-108.5 113.6 -17.8 0.2 -41.4 156 156 A L - 0 0 30 -2,-0.6 3,-0.1 19,-0.1 8,-0.0 -0.768 47.2-113.3-122.3 168.5 -14.7 2.0 -39.9 157 157 A N S S+ 0 0 95 -2,-0.3 -1,-0.1 1,-0.2 7,-0.0 0.733 112.8 59.2 -73.1 -23.7 -14.0 5.1 -37.9 158 158 A S S S+ 0 0 101 2,-0.0 -1,-0.2 0, 0.0 -3,-0.0 0.923 82.2 105.2 -67.4 -44.8 -12.3 6.7 -40.9 159 159 A M S S- 0 0 42 -3,-0.1 2,-0.1 1,-0.1 -4,-0.0 0.122 74.3-107.9 -48.0 146.9 -15.2 6.6 -43.3 160 160 A S > - 0 0 62 1,-0.1 4,-2.3 4,-0.0 5,-0.3 -0.339 35.1-102.6 -66.5 151.2 -17.3 9.7 -44.3 161 161 A K T 4 S+ 0 0 86 1,-0.2 4,-0.2 2,-0.2 -1,-0.1 0.461 126.8 50.5 -55.7 3.8 -20.9 10.1 -43.0 162 162 A D T >> S+ 0 0 101 2,-0.1 4,-1.9 3,-0.1 3,-0.9 0.791 104.8 47.8-103.3 -66.2 -21.6 9.0 -46.6 163 163 A E H 3> S+ 0 0 98 1,-0.3 4,-1.2 2,-0.2 -2,-0.2 0.790 110.8 57.6 -45.8 -34.4 -19.5 5.8 -47.1 164 164 A K H 3X S+ 0 0 3 -4,-2.3 4,-2.7 2,-0.2 -1,-0.3 0.900 103.9 48.7 -63.5 -47.7 -20.9 4.7 -43.7 165 165 A R H <> S+ 0 0 72 -3,-0.9 4,-1.0 -5,-0.3 -2,-0.2 0.931 109.3 55.4 -56.5 -43.6 -24.5 4.9 -44.8 166 166 A E H X S+ 0 0 131 -4,-1.9 4,-0.7 2,-0.2 -1,-0.2 0.764 108.4 47.3 -63.7 -32.3 -23.4 2.9 -47.9 167 167 A A H >< S+ 0 0 6 -4,-1.2 3,-1.0 -3,-0.2 -1,-0.2 0.920 110.2 50.0 -73.6 -48.1 -22.0 0.2 -45.7 168 168 A Y H 3< S+ 0 0 3 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.680 104.9 64.3 -61.1 -15.9 -25.1 0.0 -43.5 169 169 A A H 3< S+ 0 0 48 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.864 83.9 96.5 -70.6 -39.0 -26.8 -0.2 -46.9 170 170 A A S << S- 0 0 8 -3,-1.0 -46,-0.3 -4,-0.7 -18,-0.1 -0.099 86.3-119.3 -55.5 147.6 -25.2 -3.6 -47.7 171 171 A D S S+ 0 0 33 1,-0.2 -47,-0.8 -48,-0.1 2,-0.4 0.890 106.5 27.9 -49.8 -43.1 -27.1 -6.8 -47.0 172 172 A I E S-ce 124 152A 0 -21,-2.9 -19,-1.5 -49,-0.2 2,-0.4 -0.978 75.7-171.6-125.9 132.2 -24.2 -7.7 -44.6 173 173 A T E -ce 125 153A 3 -49,-2.6 -47,-2.4 -2,-0.4 2,-0.4 -0.990 9.1-152.5-132.2 136.0 -22.0 -5.1 -42.6 174 174 A Y E +ce 126 154A 2 -21,-3.6 -19,-2.8 -2,-0.4 2,-0.3 -0.858 27.3 149.5-108.0 140.4 -18.9 -5.6 -40.5 175 175 A S E -ce 127 155A 1 -49,-1.3 -47,-2.0 -2,-0.4 2,-0.4 -0.992 45.9-102.7-161.5 156.5 -17.9 -3.3 -37.6 176 176 A T E > -c 128 0A 5 -21,-0.5 4,-1.7 -2,-0.3 3,-0.4 -0.733 43.9-112.4 -78.8 138.8 -16.2 -3.0 -34.2 177 177 A N H > S+ 0 0 0 -49,-1.7 4,-2.2 -2,-0.4 5,-0.2 0.864 114.0 59.3 -30.3 -51.8 -18.6 -2.8 -31.3 178 178 A N H > S+ 0 0 55 -49,-0.3 4,-3.3 1,-0.2 -1,-0.2 0.916 102.5 48.2 -58.7 -53.1 -17.6 0.8 -30.7 179 179 A E H > S+ 0 0 4 -3,-0.4 4,-3.7 1,-0.2 5,-0.4 0.890 108.0 56.0 -51.7 -46.2 -18.6 2.3 -34.1 180 180 A L H X S+ 0 0 1 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.954 113.1 42.8 -51.3 -47.2 -21.9 0.5 -33.8 181 181 A G H X S+ 0 0 0 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.962 118.8 43.9 -60.7 -56.2 -22.3 2.4 -30.5 182 182 A F H X S+ 0 0 43 -4,-3.3 4,-3.3 2,-0.2 5,-0.3 0.957 110.5 52.3 -51.4 -59.8 -21.0 5.7 -31.9 183 183 A D H X S+ 0 0 1 -4,-3.7 4,-2.2 1,-0.3 14,-0.3 0.870 109.8 51.4 -53.5 -41.1 -22.8 5.6 -35.2 184 184 A Y H X S+ 0 0 17 -4,-1.8 4,-0.9 -5,-0.4 -1,-0.3 0.981 114.5 42.4 -53.3 -58.0 -26.1 5.1 -33.3 185 185 A L H >< S+ 0 0 0 -4,-2.2 3,-0.7 1,-0.2 -2,-0.2 0.866 113.1 51.2 -60.2 -43.7 -25.3 8.1 -31.0 186 186 A R H >< S+ 0 0 59 -4,-3.3 3,-1.3 1,-0.2 -1,-0.2 0.884 102.9 61.2 -62.2 -39.0 -24.1 10.3 -33.8 187 187 A D H >< S+ 0 0 3 -4,-2.2 3,-0.7 -5,-0.3 -1,-0.2 0.803 100.6 56.8 -54.1 -31.1 -27.3 9.5 -35.7 188 188 A N T << S+ 0 0 15 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.1 -0.183 99.7 56.2 -99.5 39.6 -29.2 11.1 -32.7 189 189 A M T < S+ 0 0 61 -3,-1.3 -1,-0.2 164,-0.0 -2,-0.1 0.025 82.8 134.2-145.3 22.5 -27.4 14.5 -32.9 190 190 A V < - 0 0 1 -3,-0.7 3,-0.1 1,-0.1 -3,-0.1 -0.388 46.9-160.9 -85.9 150.5 -28.4 15.1 -36.5 191 191 A L S S+ 0 0 72 1,-0.3 2,-0.4 -2,-0.1 -1,-0.1 0.693 86.6 33.2-100.6 -28.6 -29.8 18.3 -38.1 192 192 A Y S > S- 0 0 151 1,-0.1 3,-1.2 0, 0.0 4,-0.4 -1.000 82.2-128.5-130.0 134.2 -31.2 16.6 -41.2 193 193 A K T 3 S+ 0 0 93 -2,-0.4 3,-0.5 1,-0.3 -1,-0.1 0.664 103.1 65.6 -55.6 -24.3 -32.6 13.1 -41.1 194 194 A E T 3 S+ 0 0 134 1,-0.2 -1,-0.3 3,-0.0 -4,-0.0 0.948 85.1 72.2 -59.3 -47.6 -30.5 12.0 -44.1 195 195 A Q S < S+ 0 0 51 -3,-1.2 -1,-0.2 2,-0.1 -2,-0.2 0.730 72.5 105.5 -47.0 -35.8 -27.3 12.4 -42.2 196 196 A M - 0 0 53 -3,-0.5 -12,-0.1 -4,-0.4 -13,-0.0 -0.141 54.1-165.6 -43.1 133.1 -28.1 9.3 -40.1 197 197 A V + 0 0 5 -14,-0.3 -29,-0.2 2,-0.1 -1,-0.1 0.728 56.3 85.4 -97.5 -26.4 -25.9 6.4 -41.3 198 198 A Q - 0 0 25 -15,-0.3 3,-0.1 -14,-0.1 -33,-0.1 -0.407 57.3-153.3 -83.0 149.1 -27.8 3.5 -39.6 199 199 A R - 0 0 76 1,-0.2 3,-0.1 -2,-0.1 -2,-0.1 -0.691 55.3 -58.1 -98.2 168.3 -30.7 1.4 -40.7 200 200 A P - 0 0 115 0, 0.0 2,-1.2 0, 0.0 -1,-0.2 -0.103 62.3-107.5 -39.0 136.7 -33.1 -0.3 -38.2 201 201 A L + 0 0 24 1,-0.2 164,-1.0 162,-0.1 3,-0.1 -0.642 54.0 159.9 -81.5 99.8 -31.1 -2.6 -36.0 202 202 A H - 0 0 36 -2,-1.2 163,-1.6 1,-0.3 164,-1.0 0.936 56.5 -4.6 -79.5 -82.2 -32.2 -6.1 -37.2 203 203 A F E -df 124 366A 0 -80,-0.6 -78,-1.2 162,-0.2 2,-0.4 -0.864 54.9-165.6-122.9 143.7 -29.7 -8.7 -36.2 204 204 A A E -df 125 367A 0 162,-1.9 164,-2.4 -2,-0.3 2,-0.5 -0.994 4.3-170.6-133.1 134.0 -26.3 -8.6 -34.5 205 205 A V E -df 126 368A 0 -80,-3.1 -78,-3.3 -2,-0.4 2,-0.5 -0.929 12.2-163.3-118.2 98.0 -23.8 -11.4 -34.3 206 206 A I E -df 127 369A 0 162,-2.2 164,-1.9 -2,-0.5 3,-0.5 -0.726 3.7-156.7 -79.5 126.9 -21.0 -10.5 -31.8 207 207 A D E S+ f 0 370A 10 -80,-3.9 164,-0.2 -2,-0.5 5,-0.2 -0.861 85.8 23.1 -98.9 144.5 -17.9 -12.6 -32.2 208 208 A E S >> S+ 0 0 17 162,-2.1 4,-1.6 -2,-0.4 3,-0.7 0.866 82.5 176.5 62.0 40.2 -15.8 -12.8 -29.0 209 209 A V H 3> + 0 0 0 161,-1.9 4,-3.3 -3,-0.5 5,-0.5 0.717 66.1 59.8 -50.0 -33.0 -19.1 -11.9 -27.2 210 210 A D H 3>>S+ 0 0 0 3,-0.2 4,-2.5 2,-0.2 5,-2.0 0.935 104.8 46.7 -61.3 -51.9 -17.5 -12.1 -23.7 211 211 A S H <>>S+ 0 0 2 -3,-0.7 5,-2.6 3,-0.2 4,-0.7 0.980 122.0 39.1 -53.0 -57.9 -14.9 -9.4 -24.2 212 212 A I H <5S+ 0 0 0 -4,-1.6 -2,-0.2 3,-0.2 -3,-0.2 0.961 130.5 24.1 -57.7 -63.3 -17.6 -7.2 -25.7 213 213 A L H <5S+ 0 0 0 -4,-3.3 -3,-0.2 -5,-0.1 -1,-0.2 0.729 132.7 32.5 -81.7 -23.0 -20.7 -7.9 -23.5 214 214 A I H <5S+ 0 0 0 -4,-2.5 -3,-0.2 -5,-0.5 4,-0.2 0.871 129.3 24.1-102.6 -38.6 -19.0 -9.1 -20.3 215 215 A D T >< S+ 0 0 185 3,-0.0 4,-0.8 4,-0.0 -1,-0.1 0.914 73.9 161.6 44.4 40.4 -16.4 29.3 -26.8 230 230 A S H >> + 0 0 8 2,-0.2 4,-1.8 3,-0.1 3,-0.6 0.973 29.4 40.9 -57.9 -92.7 -16.1 28.8 -23.1 231 231 A T H >> S+ 0 0 36 1,-0.3 4,-1.1 2,-0.2 3,-0.6 0.837 117.8 46.5 -40.5 -58.4 -13.2 29.6 -20.7 232 232 A K H >> S+ 0 0 142 1,-0.2 4,-1.2 2,-0.2 3,-0.6 0.888 113.0 48.4 -51.7 -49.7 -12.4 33.0 -22.3 233 233 A L H < S+ 0 0 96 -4,-1.2 3,-1.1 1,-0.3 -2,-0.2 0.796 104.7 55.9 -72.3 -33.6 -15.9 38.4 -19.8 237 237 A A H >< S+ 0 0 5 -4,-2.2 3,-0.9 1,-0.2 -1,-0.3 0.848 105.9 55.1 -62.3 -33.3 -19.4 37.6 -18.6 238 238 A N G >< S+ 0 0 13 -4,-1.0 3,-0.8 1,-0.2 -1,-0.2 0.397 79.3 90.5 -84.5 2.8 -18.0 38.3 -15.1 239 239 A A G X S+ 0 0 76 -3,-1.1 3,-0.6 1,-0.2 -1,-0.2 0.625 70.9 79.4 -69.4 -12.2 -16.7 41.8 -16.2 240 240 A F G < + 0 0 60 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.1 0.049 50.5 115.7 -89.1 26.4 -20.2 43.0 -15.0 241 241 A V G < S+ 0 0 87 -3,-0.8 3,-0.4 2,-0.1 -1,-0.2 0.913 71.1 64.8 -58.4 -41.7 -19.3 43.0 -11.3 242 242 A R S < S+ 0 0 213 -3,-0.6 3,-0.1 1,-0.2 0, 0.0 -0.431 99.7 12.8 -92.9 162.3 -19.8 46.8 -11.4 243 243 A T + 0 0 109 1,-0.2 2,-1.4 -2,-0.1 3,-0.4 0.841 60.6 167.3 47.2 51.2 -22.8 49.1 -12.0 244 244 A L + 0 0 60 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.0 -0.428 48.4 98.8 -87.4 58.5 -25.4 46.4 -11.8 245 245 A K S S+ 0 0 180 -2,-1.4 -1,-0.2 -3,-0.1 3,-0.1 0.764 81.9 37.1-100.6 -68.9 -28.1 49.2 -11.6 246 246 A A S S+ 0 0 26 -3,-0.4 19,-0.5 1,-0.2 16,-0.4 0.735 133.0 28.7 -65.1 -25.0 -29.5 49.4 -15.1 247 247 A E S S+ 0 0 15 -4,-0.4 2,-2.3 17,-0.2 -1,-0.2 0.473 79.4 119.3-116.3 -6.3 -29.3 45.6 -15.7 248 248 A K - 0 0 112 -3,-0.1 13,-0.1 -5,-0.1 12,-0.0 -0.421 65.7-149.3 -61.8 86.8 -29.7 44.3 -12.2 249 249 A D - 0 0 22 -2,-2.3 12,-0.1 11,-0.3 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