==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GENE REGULATION/DNA 28-MAY-10 3N97 . COMPND 2 MOLECULE: RNA POLYMERASE SIGMA FACTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS AQUATICUS; . AUTHOR S.LARA-GONZALEZ,J.J.BIRKTOFT,C.L.LAWSON . 252 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16549.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 166 65.9 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 . 4 1.6 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 . 8 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 41.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.4 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 2 2 0 4 0 0 2 2 0 0 1 1 0 0 0 0 0 0 0 0 0 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 . 2 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 1 374 A S 0 0 157 0, 0.0 7,-0.1 0, 0.0 49,-0.0 0.000 360.0 360.0 360.0 -18.9 33.5 -8.9 -65.0 2 375 A K + 0 0 89 47,-0.1 2,-0.3 2,-0.0 48,-0.0 0.214 360.0 111.0 -80.7 15.6 32.5 -8.5 -61.3 3 376 A L S S- 0 0 30 1,-0.1 43,-0.0 2,-0.1 0, 0.0 -0.712 74.8-110.9 -94.1 141.3 33.0 -12.3 -61.3 4 377 A S > - 0 0 55 -2,-0.3 4,-2.3 1,-0.1 5,-0.3 -0.108 34.2-101.0 -61.5 165.5 35.9 -13.9 -59.4 5 378 A E H > S+ 0 0 175 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.944 125.0 44.2 -47.0 -53.2 38.7 -15.6 -61.3 6 379 A R H > S+ 0 0 122 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.963 109.7 52.6 -62.0 -58.6 37.1 -18.9 -60.5 7 380 A E H > S+ 0 0 12 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.910 112.8 45.6 -44.7 -55.1 33.5 -18.0 -61.3 8 381 A A H >X S+ 0 0 32 -4,-2.3 4,-1.8 2,-0.2 3,-0.8 0.967 110.3 54.2 -53.3 -59.3 34.5 -16.7 -64.7 9 382 A M H >X S+ 0 0 53 -4,-2.3 4,-2.8 -5,-0.3 3,-0.9 0.907 105.5 53.2 -37.7 -64.3 36.7 -19.7 -65.5 10 383 A V H 3X S+ 0 0 1 -4,-2.4 4,-3.6 1,-0.3 -1,-0.3 0.812 106.4 51.8 -45.3 -43.2 33.9 -22.2 -64.7 11 384 A L H S+ 0 0 77 -4,-1.8 6,-1.0 -3,-0.9 4,-0.9 0.933 115.4 47.3 -68.8 -45.3 34.0 -20.6 -70.0 13 386 A M H ><5S+ 0 0 16 -4,-2.8 3,-1.8 -5,-0.2 10,-1.1 0.993 118.0 40.4 -50.2 -68.3 34.6 -24.3 -69.1 14 387 A R H 3<5S+ 0 0 67 -4,-3.6 -2,-0.2 1,-0.3 -1,-0.2 0.804 119.3 45.3 -55.8 -36.4 31.0 -25.1 -68.9 15 388 A K H 3<5S- 0 0 28 -4,-2.4 -1,-0.3 -5,-0.2 7,-0.2 0.480 111.9-118.6 -90.6 -1.5 30.0 -23.0 -71.9 16 389 A G T - 0 0 68 -2,-0.4 4,-1.5 1,-0.1 3,-0.2 -0.211 34.0-107.1 -60.4 161.4 29.9 -31.5 -67.8 25 398 A L H > S+ 0 0 37 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.915 116.8 64.0 -57.9 -44.2 30.0 -30.6 -64.2 26 399 A E H > S+ 0 0 93 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.888 103.8 44.2 -43.3 -55.1 32.0 -33.7 -63.4 27 400 A E H > S+ 0 0 96 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.896 113.4 48.3 -65.4 -45.5 35.0 -32.7 -65.5 28 401 A V H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 5,-0.2 0.917 112.5 49.5 -63.2 -44.4 35.2 -29.1 -64.3 29 402 A G H X>S+ 0 0 0 -4,-2.7 5,-2.4 2,-0.2 4,-1.3 0.949 108.9 52.4 -56.7 -50.5 34.9 -30.2 -60.7 30 403 A A H <5S+ 0 0 78 -4,-2.6 3,-0.3 -5,-0.3 -1,-0.2 0.903 109.7 51.3 -50.7 -42.5 37.7 -32.7 -61.4 31 404 A Y H <5S+ 0 0 147 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.931 119.3 33.1 -62.6 -48.7 39.7 -29.8 -62.7 32 405 A F H <5S- 0 0 54 -4,-2.7 -1,-0.2 2,-0.1 -2,-0.2 0.426 115.2-115.0 -86.6 1.2 39.2 -27.6 -59.7 33 406 A G T <5S+ 0 0 65 -4,-1.3 2,-0.3 -3,-0.3 -3,-0.3 0.967 76.0 115.7 61.5 54.8 39.1 -30.7 -57.4 34 407 A V < - 0 0 48 -5,-2.4 -1,-0.2 -8,-0.2 2,-0.2 -0.921 68.9 -87.3-144.6 169.8 35.5 -30.3 -56.3 35 408 A T > - 0 0 91 -2,-0.3 4,-1.7 1,-0.1 3,-0.4 -0.501 36.2-115.6 -81.7 151.8 32.2 -32.1 -56.6 36 409 A R H > S+ 0 0 134 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.888 115.7 60.3 -51.0 -42.7 29.8 -31.5 -59.6 37 410 A E H > S+ 0 0 75 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.936 101.9 51.5 -49.7 -53.9 27.3 -30.0 -57.2 38 411 A R H > S+ 0 0 98 -3,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.916 107.5 53.3 -52.1 -50.5 29.7 -27.3 -56.2 39 412 A I H X S+ 0 0 1 -4,-1.7 4,-3.1 2,-0.2 -1,-0.2 0.929 109.6 47.1 -51.7 -53.6 30.4 -26.4 -59.8 40 413 A R H X S+ 0 0 108 -4,-2.2 4,-2.5 1,-0.2 5,-0.3 0.949 110.3 53.1 -52.7 -53.6 26.7 -26.0 -60.6 41 414 A Q H X S+ 0 0 88 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.885 112.4 45.3 -49.0 -44.5 26.2 -23.9 -57.4 42 415 A I H X S+ 0 0 13 -4,-2.6 4,-2.9 -5,-0.2 5,-0.2 0.918 111.9 51.5 -67.4 -46.0 29.1 -21.7 -58.6 43 416 A E H X S+ 0 0 9 -4,-3.1 4,-2.7 1,-0.2 3,-0.3 0.989 111.9 45.3 -50.9 -67.9 27.8 -21.5 -62.2 44 417 A N H X S+ 0 0 54 -4,-2.5 4,-2.6 1,-0.3 -1,-0.2 0.825 112.6 52.7 -47.1 -40.1 24.3 -20.4 -61.1 45 418 A K H X S+ 0 0 109 -4,-1.7 4,-1.9 -5,-0.3 -1,-0.3 0.955 111.0 45.3 -62.7 -50.3 25.7 -17.9 -58.7 46 419 A A H X S+ 0 0 0 -4,-2.9 4,-0.5 -3,-0.3 -2,-0.2 0.844 112.2 53.9 -60.9 -34.7 27.9 -16.3 -61.3 47 420 A L H >X S+ 0 0 20 -4,-2.7 3,-1.2 -5,-0.2 4,-1.1 0.925 108.4 47.7 -63.0 -47.2 24.8 -16.4 -63.6 48 421 A R H 3X S+ 0 0 143 -4,-2.6 4,-1.5 1,-0.3 -2,-0.2 0.821 103.8 64.2 -63.6 -30.1 22.8 -14.6 -61.0 49 422 A K H 3< S+ 0 0 77 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.706 104.9 44.6 -65.1 -21.5 25.7 -12.1 -60.7 50 423 A L H << S+ 0 0 13 -3,-1.2 -1,-0.2 -4,-0.5 -2,-0.2 0.672 106.3 56.7-100.8 -22.6 25.2 -11.0 -64.3 51 424 A R H < S+ 0 0 117 -4,-1.1 -2,-0.2 1,-0.2 -3,-0.1 0.808 115.8 41.2 -71.7 -32.5 21.4 -10.6 -64.3 52 425 A H < 0 0 103 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.1 -0.522 360.0 360.0-116.7 62.8 21.8 -8.2 -61.3 53 426 A P 0 0 113 0, 0.0 -2,-0.1 0, 0.0 -3,-0.1 0.679 360.0 360.0-102.1 360.0 24.8 -6.0 -62.1 54 !* 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 55 375 D K 0 0 140 0, 0.0 2,-0.3 0, 0.0 48,-0.0 0.000 360.0 360.0 360.0 19.4 43.1 -15.7 -80.9 56 376 D L - 0 0 46 1,-0.1 43,-0.0 2,-0.1 0, 0.0 -0.744 360.0-112.4 -96.4 141.9 39.5 -14.7 -81.5 57 377 D S > - 0 0 56 -2,-0.3 4,-2.4 1,-0.1 5,-0.3 -0.203 33.4-102.1 -64.2 159.2 38.5 -11.2 -82.9 58 378 D E H > S+ 0 0 177 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.911 124.7 45.1 -42.6 -50.6 36.7 -8.7 -80.8 59 379 D R H > S+ 0 0 120 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.912 110.1 52.9 -69.7 -43.7 33.5 -9.6 -82.6 60 380 D E H > S+ 0 0 10 2,-0.2 4,-1.6 1,-0.2 5,-0.2 0.965 112.1 44.4 -55.8 -57.5 33.9 -13.3 -82.4 61 381 D A H >X S+ 0 0 31 -4,-2.4 4,-2.1 1,-0.2 3,-0.7 0.958 110.8 55.3 -51.0 -58.5 34.5 -13.4 -78.6 62 382 D M H >X S+ 0 0 52 -4,-2.3 4,-3.0 -5,-0.3 3,-0.7 0.909 104.8 53.1 -35.8 -65.8 31.6 -11.0 -78.1 63 383 D V H 3X S+ 0 0 0 -4,-2.3 4,-3.7 1,-0.3 -1,-0.2 0.809 108.3 48.4 -45.4 -45.3 29.1 -13.2 -79.9 64 384 D L H S+ 0 0 77 -4,-2.1 6,-0.8 -3,-0.7 4,-0.7 0.932 115.3 46.7 -66.4 -41.3 29.6 -14.4 -74.6 66 386 D M H ><5S+ 0 0 17 -4,-3.0 3,-1.9 -5,-0.3 10,-0.9 0.997 117.1 40.3 -55.3 -69.1 26.3 -13.1 -76.0 67 387 D R H 3<5S+ 0 0 67 -4,-3.7 -2,-0.2 1,-0.3 -1,-0.2 0.815 118.8 47.2 -52.9 -36.5 25.1 -16.5 -77.1 68 388 D K H 3<5S- 0 0 32 -4,-2.7 -1,-0.3 -5,-0.2 7,-0.2 0.478 111.3-117.6 -90.8 -1.4 26.4 -18.3 -74.0 69 389 D G T - 0 0 69 -2,-0.4 4,-1.7 1,-0.1 3,-0.3 -0.211 34.5-107.3 -58.9 156.6 19.0 -16.4 -79.6 78 398 D L H > S+ 0 0 39 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.911 117.7 65.1 -50.1 -44.1 20.7 -15.7 -82.9 79 399 D E H > S+ 0 0 98 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.904 103.4 42.1 -45.5 -58.2 17.9 -13.2 -83.5 80 400 D E H > S+ 0 0 99 -3,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.890 113.1 50.4 -64.8 -44.8 18.8 -10.9 -80.7 81 401 D V H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.913 108.9 54.5 -60.6 -41.9 22.5 -10.9 -81.1 82 402 D G H X>S+ 0 0 1 -4,-2.7 5,-2.5 1,-0.2 4,-0.9 0.924 106.2 51.6 -54.7 -46.8 22.0 -10.2 -84.8 83 403 D A H <5S+ 0 0 82 -4,-2.0 3,-0.4 -5,-0.2 -1,-0.2 0.885 107.3 54.8 -57.5 -39.6 19.9 -7.1 -83.9 84 404 D Y H <5S+ 0 0 146 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.898 116.3 33.5 -64.2 -45.7 22.7 -5.9 -81.6 85 405 D F H <5S- 0 0 56 -4,-1.9 -1,-0.2 2,-0.1 -2,-0.2 0.435 113.5-115.3 -88.6 -0.2 25.5 -5.9 -84.2 86 406 D G T <5S+ 0 0 63 -4,-0.9 2,-0.3 -3,-0.4 -3,-0.2 0.989 75.3 115.9 59.2 61.9 23.1 -5.0 -87.0 87 407 D V < - 0 0 47 -5,-2.5 2,-0.2 -6,-0.1 -1,-0.2 -0.919 69.2 -86.4-147.1 171.9 23.4 -8.2 -88.9 88 408 D T >> - 0 0 92 -2,-0.3 4,-1.6 1,-0.1 3,-0.8 -0.596 36.9-115.1 -86.0 148.2 21.3 -11.2 -90.0 89 409 D R H 3> S+ 0 0 144 1,-0.3 4,-2.0 -2,-0.2 5,-0.2 0.876 116.4 60.7 -47.5 -43.8 20.9 -14.2 -87.8 90 410 D E H 3> S+ 0 0 76 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.924 101.3 51.6 -46.3 -54.0 22.7 -16.2 -90.4 91 411 D R H <> S+ 0 0 96 -3,-0.8 4,-2.5 2,-0.2 -1,-0.2 0.923 107.7 52.9 -53.1 -49.7 25.8 -14.1 -90.1 92 412 D I H >X S+ 0 0 2 -4,-1.6 4,-3.3 2,-0.2 3,-1.0 0.966 110.4 45.6 -49.7 -66.2 25.8 -14.6 -86.3 93 413 D R H 3X S+ 0 0 101 -4,-2.0 4,-2.7 1,-0.3 5,-0.4 0.916 111.4 53.0 -41.7 -60.5 25.7 -18.4 -86.5 94 414 D Q H 3X S+ 0 0 88 -4,-2.7 4,-1.6 1,-0.2 -1,-0.3 0.844 114.0 44.0 -44.7 -41.0 28.3 -18.4 -89.2 95 415 D I H X S+ 0 0 26 -4,-2.2 3,-1.1 -5,-0.2 4,-0.9 0.916 108.3 48.4 -65.5 -45.2 34.1 -22.5 -82.2 101 421 D R H >< S+ 0 0 155 -4,-2.5 3,-0.6 1,-0.2 -2,-0.2 0.884 103.6 63.6 -60.8 -38.8 36.2 -24.1 -84.8 102 422 D K H 3< S+ 0 0 102 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.687 103.4 47.9 -57.9 -22.2 39.0 -21.7 -83.9 103 423 D L H << 0 0 47 -3,-1.1 -1,-0.2 -4,-0.5 -2,-0.2 0.695 360.0 360.0 -97.8 -22.3 39.2 -23.1 -80.4 104 424 D R << 0 0 171 -4,-0.9 -2,-0.2 -3,-0.6 -3,-0.1 0.870 360.0 360.0 -91.0 360.0 39.3 -26.8 -81.2 105 !* 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 0.0 106 250 B D 0 0 147 0, 0.0 4,-0.4 0, 0.0 29,-0.1 0.000 360.0 360.0 360.0 161.7 14.5 11.5 -57.5 107 251 B P + 0 0 84 0, 0.0 4,-0.2 0, 0.0 3,-0.1 0.673 360.0 48.4 -80.0 -23.1 15.0 8.9 -60.3 108 252 B I S S+ 0 0 35 1,-0.2 3,-0.3 2,-0.1 26,-0.2 0.564 97.8 71.0 -95.7 -10.2 17.3 6.8 -58.1 109 253 B L S S+ 0 0 24 1,-0.2 26,-1.3 25,-0.1 27,-0.2 0.762 95.6 52.4 -74.3 -25.5 14.8 6.9 -55.2 110 254 B L S S+ 0 0 93 -4,-0.4 -1,-0.2 24,-0.2 -2,-0.1 0.647 87.5 106.8 -87.0 -15.3 12.4 4.6 -57.1 111 255 B R S S- 0 0 116 -3,-0.3 23,-2.2 -4,-0.2 24,-0.3 -0.194 78.9 -96.4 -67.2 154.7 14.9 1.9 -57.8 112 256 B P B > -A 133 0A 54 0, 0.0 3,-1.8 0, 0.0 21,-0.2 -0.358 29.5-118.7 -66.4 150.6 15.0 -1.5 -56.0 113 257 B V G > S+ 0 0 8 19,-2.3 3,-1.6 1,-0.3 5,-0.4 0.645 108.0 76.1 -67.2 -14.6 17.4 -1.9 -53.1 114 258 B D G > S+ 0 0 49 18,-0.3 3,-2.2 1,-0.3 -1,-0.3 0.748 76.7 74.7 -69.8 -22.7 19.2 -4.6 -55.0 115 259 B D G < S+ 0 0 44 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.567 86.6 67.0 -63.7 -7.2 20.7 -1.9 -57.1 116 260 B L G < S- 0 0 7 -3,-1.6 -1,-0.3 -4,-0.1 -2,-0.2 0.583 94.0-144.1 -90.8 -12.0 22.8 -1.4 -54.0 117 261 B E < + 0 0 132 -3,-2.2 -3,-0.1 -4,-0.1 -2,-0.1 0.909 36.3 176.2 47.8 46.1 24.6 -4.7 -54.3 118 262 B L - 0 0 29 -5,-0.4 2,-0.1 1,-0.2 -1,-0.1 -0.083 35.0 -84.3 -69.9 176.8 24.6 -4.9 -50.5 119 263 B T > - 0 0 67 36,-0.1 4,-2.7 1,-0.1 -1,-0.2 -0.332 40.7-106.9 -75.9 167.6 25.8 -7.9 -48.6 120 264 B V H > S+ 0 0 108 2,-0.2 4,-3.5 3,-0.2 5,-0.3 0.952 118.0 52.2 -60.1 -53.7 23.5 -10.9 -48.0 121 265 B R H > S+ 0 0 149 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.963 113.3 43.5 -43.8 -69.4 23.0 -10.1 -44.3 122 266 B S H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 3,-0.2 0.910 114.6 50.6 -42.4 -60.2 22.0 -6.6 -45.0 123 267 B A H X S+ 0 0 21 -4,-2.7 4,-2.6 1,-0.2 5,-0.3 0.919 110.2 49.1 -44.8 -57.0 19.8 -7.7 -48.0 124 268 B N H X S+ 0 0 96 -4,-3.5 4,-1.8 1,-0.2 -1,-0.2 0.865 108.3 52.5 -55.2 -43.4 18.0 -10.3 -45.9 125 269 B C H < S+ 0 0 9 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.922 111.8 47.7 -59.4 -43.6 17.2 -8.0 -43.1 126 270 B L H ><>S+ 0 0 2 -4,-2.2 3,-2.6 -5,-0.2 5,-1.8 0.940 110.2 48.2 -65.3 -51.6 15.7 -5.5 -45.5 127 271 B K H ><5S+ 0 0 119 -4,-2.6 3,-0.8 1,-0.3 -1,-0.2 0.820 110.9 54.8 -59.0 -28.3 13.5 -8.0 -47.3 128 272 B A T 3<5S+ 0 0 80 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.515 106.9 54.7 -77.6 -5.3 12.5 -9.1 -43.9 129 273 B E T < 5S- 0 0 57 -3,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.062 114.6-105.2-122.4 23.6 11.6 -5.5 -43.2 130 274 B A T < 5S+ 0 0 69 -3,-0.8 2,-0.7 1,-0.2 -3,-0.2 0.784 76.0 139.9 58.1 26.8 9.1 -4.6 -46.0 131 275 B I < + 0 0 1 -5,-1.8 -1,-0.2 1,-0.2 -2,-0.2 -0.896 4.6 140.2-105.2 107.8 11.9 -2.6 -47.6 132 276 B H + 0 0 103 -2,-0.7 -19,-2.3 1,-0.2 2,-0.4 0.703 58.6 54.9-113.0 -34.7 11.9 -3.0 -51.3 133 277 B Y B >> S-A 112 0A 110 -21,-0.2 4,-1.5 -20,-0.1 3,-0.9 -0.866 76.0-128.2-114.9 137.0 12.7 0.5 -52.6 134 278 B I H 3> S+ 0 0 2 -23,-2.2 4,-2.4 -2,-0.4 5,-0.2 0.750 111.8 61.5 -49.6 -25.8 15.6 2.8 -51.8 135 279 B G H 3> S+ 0 0 0 -26,-1.3 4,-1.1 -24,-0.3 -1,-0.3 0.944 100.1 50.4 -65.7 -49.6 12.9 5.4 -51.1 136 280 B D H <4 S+ 0 0 34 -3,-0.9 4,-0.4 -27,-0.2 -2,-0.2 0.861 114.2 51.4 -51.8 -34.8 11.4 3.3 -48.3 137 281 B L H >< S+ 0 0 0 -4,-1.5 3,-2.5 1,-0.2 34,-0.4 0.960 99.7 53.1 -74.5 -58.0 15.0 3.1 -47.0 138 282 B V H 3< S+ 0 0 0 -4,-2.4 34,-2.4 1,-0.3 -1,-0.2 0.728 103.3 63.6 -56.1 -20.3 16.4 6.6 -46.8 139 283 B Q T 3< S+ 0 0 72 -4,-1.1 2,-0.3 32,-0.2 -1,-0.3 0.731 84.6 91.0 -75.2 -23.0 13.3 7.5 -44.8 140 284 B R S < S- 0 0 46 -3,-2.5 31,-1.6 -4,-0.4 32,-0.2 -0.595 80.4-123.5 -78.8 131.6 14.4 5.1 -42.0 141 285 B T > - 0 0 58 -2,-0.3 4,-1.4 29,-0.2 5,-0.2 -0.353 20.0-113.3 -74.6 153.3 16.5 6.6 -39.3 142 286 B E H > S+ 0 0 83 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.811 120.3 47.5 -53.1 -33.3 19.9 5.2 -38.4 143 287 B V H > S+ 0 0 89 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.937 103.9 57.6 -73.6 -50.4 18.4 4.2 -35.0 144 288 B E H > S+ 0 0 84 1,-0.2 4,-0.6 2,-0.2 -2,-0.2 0.727 109.7 49.9 -53.9 -23.3 15.3 2.6 -36.4 145 289 B L H >< S+ 0 0 0 -4,-1.4 3,-1.2 2,-0.2 -1,-0.2 0.909 98.2 61.1 -82.0 -47.6 17.6 0.3 -38.4 146 290 B L H 3< S+ 0 0 63 -4,-1.4 -2,-0.2 1,-0.3 -1,-0.2 0.727 99.8 61.0 -57.0 -19.8 19.9 -0.8 -35.6 147 291 B K H 3< S+ 0 0 105 -4,-1.1 -1,-0.3 2,-0.1 -2,-0.2 0.894 80.6 99.9 -71.6 -41.3 16.7 -2.3 -34.0 148 292 B T S X< S- 0 0 8 -3,-1.2 3,-1.3 -4,-0.6 -23,-0.1 -0.197 87.9 -99.3 -50.7 132.7 16.1 -4.6 -36.9 149 293 B P T 3 S+ 0 0 44 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.136 101.1 11.4 -56.0 146.6 17.3 -8.1 -36.1 150 294 B N T 3 S+ 0 0 109 1,-0.2 2,-0.8 -3,-0.1 5,-0.1 0.346 97.9 116.4 67.1 -8.1 20.7 -9.3 -37.4 151 295 B L < + 0 0 0 -3,-1.3 -1,-0.2 -6,-0.2 2,-0.1 -0.832 40.6 159.1 -95.5 106.6 21.5 -5.8 -38.4 152 296 B G > - 0 0 30 -2,-0.8 4,-3.2 -3,-0.1 5,-0.3 -0.398 56.2 -65.9-112.9-168.3 24.5 -4.6 -36.4 153 297 B K H > S+ 0 0 174 1,-0.2 4,-4.9 2,-0.2 5,-0.2 0.889 128.7 47.1 -45.4 -55.3 27.2 -1.9 -36.6 154 298 B K H > S+ 0 0 183 2,-0.2 4,-4.2 1,-0.2 -1,-0.2 0.932 115.0 44.5 -59.8 -52.3 28.9 -3.3 -39.7 155 299 B S H > S+ 0 0 9 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.965 118.7 44.3 -54.7 -55.6 25.7 -3.8 -41.7 156 300 B L H X S+ 0 0 6 -4,-3.2 4,-2.3 2,-0.2 -2,-0.2 0.977 115.6 48.9 -50.7 -57.8 24.5 -0.4 -40.6 157 301 B T H X S+ 0 0 63 -4,-4.9 4,-2.2 -5,-0.3 -2,-0.2 0.926 110.1 50.2 -48.1 -58.5 27.9 1.0 -41.3 158 302 B E H X S+ 0 0 45 -4,-4.2 4,-2.2 1,-0.2 5,-0.3 0.934 110.1 51.5 -42.4 -57.7 28.2 -0.6 -44.8 159 303 B I H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 5,-0.2 0.868 107.5 50.6 -53.2 -47.3 24.7 0.7 -45.7 160 304 B K H X S+ 0 0 78 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.934 110.8 51.3 -55.9 -46.1 25.5 4.3 -44.7 161 305 B D H X S+ 0 0 110 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.894 111.3 45.3 -59.6 -45.1 28.7 4.1 -46.8 162 306 B V H < S+ 0 0 28 -4,-2.2 -1,-0.2 2,-0.2 6,-0.2 0.791 112.5 50.6 -76.3 -27.3 27.0 2.9 -50.0 163 307 B L H ><>S+ 0 0 2 -4,-2.1 5,-2.8 -5,-0.3 3,-1.2 0.898 112.7 48.4 -69.4 -41.2 24.2 5.4 -49.6 164 308 B A H ><5S+ 0 0 62 -4,-2.6 3,-2.4 1,-0.3 -2,-0.2 0.892 99.6 65.6 -62.4 -41.5 26.8 8.0 -49.3 165 309 B S T 3<5S+ 0 0 85 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.548 111.5 37.7 -61.4 -4.6 28.7 6.7 -52.3 166 310 B R T < 5S- 0 0 107 -3,-1.2 -1,-0.3 2,-0.2 -2,-0.2 0.121 127.2 -91.2-135.1 18.6 25.7 7.8 -54.3 167 311 B G T < 5S+ 0 0 74 -3,-2.4 -3,-0.2 1,-0.3 2,-0.2 0.207 88.1 121.2 94.3 -13.5 24.7 11.0 -52.6 168 312 B L < + 0 0 21 -5,-2.8 -1,-0.3 -6,-0.2 2,-0.3 -0.484 32.2 172.3 -96.2 154.1 22.3 9.4 -50.1 169 313 B S - 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