==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 17-AUG-12 4GO1 . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR LSRR; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.WU,Y.TAO,X.LIU,J.ZANG . 593 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26958.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 428 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 55 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 5.4 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 27 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 215 36.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.0 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 1 1 2 3 4 1 3 2 3 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 4 3 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 PARALLEL BRIDGES PER LADDER . 6 2 2 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 2 0 0 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 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 10 A E 0 0 164 0, 0.0 4,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 117.9 -8.8 -23.4 0.2 2 11 A Q - 0 0 54 2,-0.1 3,-0.0 3,-0.1 31,-0.0 -0.322 360.0 -62.0-148.9 57.1 -9.9 -24.3 3.8 3 12 A G S S+ 0 0 33 1,-0.0 2,-0.4 393,-0.0 393,-0.1 -0.024 113.4 118.2-114.2 87.8 -8.8 -26.9 2.9 4 13 A M - 0 0 2 2,-0.0 -2,-0.1 3,-0.0 -1,-0.0 -0.933 55.6-125.9-118.1 132.8 -11.0 -27.9 -0.0 5 14 A C >> - 0 0 55 -2,-0.4 4,-1.8 -4,-0.1 3,-0.7 -0.291 42.7 -94.9 -64.4 160.9 -10.1 -28.5 -3.6 6 15 A E H 3> S+ 0 0 90 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.836 122.0 58.5 -45.0 -47.4 -12.1 -26.4 -6.2 7 16 A E H 3> S+ 0 0 41 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.911 107.4 46.3 -55.1 -47.9 -14.7 -29.2 -6.9 8 17 A E H <> S+ 0 0 28 -3,-0.7 4,-2.7 2,-0.2 5,-0.2 0.920 109.3 54.8 -61.4 -48.5 -15.7 -29.3 -3.3 9 18 A Q H X S+ 0 0 5 -4,-1.8 4,-3.3 2,-0.2 -2,-0.2 0.945 112.4 44.6 -48.4 -54.5 -15.9 -25.5 -3.1 10 19 A V H X S+ 0 0 6 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.964 112.2 49.3 -55.2 -59.7 -18.3 -25.6 -6.1 11 20 A A H X S+ 0 0 0 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.857 117.1 44.5 -50.6 -37.0 -20.5 -28.5 -4.9 12 21 A R H X S+ 0 0 1 -4,-2.7 4,-2.4 -5,-0.2 5,-0.3 0.952 108.1 53.9 -74.6 -52.7 -20.8 -26.7 -1.5 13 22 A I H X S+ 0 0 2 -4,-3.3 4,-2.3 -5,-0.2 5,-0.2 0.919 110.2 52.2 -44.2 -51.9 -21.4 -23.2 -2.9 14 23 A A H >X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 3,-0.6 0.965 108.1 47.3 -46.0 -70.4 -24.3 -24.8 -4.8 15 24 A W H 3<>S+ 0 0 9 -4,-1.9 5,-1.1 1,-0.2 4,-0.4 0.826 113.7 49.4 -42.6 -43.1 -25.9 -26.5 -1.8 16 25 A F H 3<5S+ 0 0 19 -4,-2.4 6,-2.5 3,-0.2 -1,-0.2 0.897 115.2 42.2 -71.0 -39.6 -25.7 -23.3 0.2 17 26 A Y H <<5S+ 0 0 67 -4,-2.3 -2,-0.2 -3,-0.6 -1,-0.2 0.865 131.1 21.6 -74.5 -38.7 -27.2 -21.1 -2.4 18 27 A Y T <5S+ 0 0 42 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.1 0.932 127.2 38.3 -97.2 -64.8 -30.0 -23.5 -3.5 19 28 A H T 5S+ 0 0 85 -4,-0.4 -3,-0.2 -5,-0.3 -4,-0.1 0.669 135.1 25.6 -63.0 -21.1 -30.8 -26.1 -0.8 20 29 A D S - 0 0 54 1,-0.1 4,-2.3 2,-0.0 5,-0.2 -0.330 29.0-122.8 -66.1 142.4 -27.0 -15.0 0.5 24 33 A Q H > S+ 0 0 93 1,-0.2 4,-1.3 2,-0.2 3,-0.1 0.931 115.4 33.7 -45.9 -56.6 -24.3 -14.8 -2.2 25 34 A S H > S+ 0 0 45 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.715 112.7 61.7 -78.2 -22.5 -21.9 -12.8 0.1 26 35 A E H > S+ 0 0 114 2,-0.2 4,-1.0 1,-0.2 -2,-0.2 0.810 103.2 51.1 -70.0 -32.3 -23.1 -14.7 3.3 27 36 A I H >X S+ 0 0 2 -4,-2.3 4,-1.7 2,-0.2 3,-0.6 0.947 100.1 69.0 -60.5 -50.1 -21.8 -17.8 1.6 28 37 A S H 3<>S+ 0 0 17 -4,-1.3 5,-2.7 1,-0.3 3,-0.4 0.821 105.9 34.3 -34.3 -59.8 -18.5 -16.0 1.1 29 38 A D H 3<5S+ 0 0 140 -4,-1.2 3,-0.4 3,-0.2 -1,-0.3 0.774 108.7 65.9 -78.0 -25.1 -17.5 -15.8 4.8 30 39 A R H <<5S+ 0 0 141 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.821 116.8 28.2 -67.4 -29.3 -19.0 -19.2 5.7 31 40 A L T <5S- 0 0 6 -4,-1.7 -1,-0.2 -3,-0.4 -2,-0.2 0.260 115.2-118.5-109.0 8.3 -16.4 -20.9 3.5 32 41 A G T 5 + 0 0 40 -3,-0.4 2,-0.3 -5,-0.3 -3,-0.2 0.959 67.4 127.4 53.9 64.6 -13.9 -18.1 4.0 33 42 A L < - 0 0 24 -5,-2.7 -1,-0.2 -6,-0.1 -2,-0.1 -0.978 64.8 -86.5-143.4 154.4 -13.6 -16.9 0.4 34 43 A T > - 0 0 88 -2,-0.3 4,-2.0 1,-0.1 3,-0.2 -0.276 34.9-122.8 -58.3 143.5 -13.8 -13.6 -1.5 35 44 A R H > S+ 0 0 143 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.782 113.5 55.2 -60.1 -30.3 -17.3 -12.6 -2.7 36 45 A L H > S+ 0 0 123 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.912 106.3 50.2 -66.8 -42.8 -16.0 -12.4 -6.3 37 46 A K H > S+ 0 0 66 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.895 107.7 53.4 -62.2 -42.6 -14.7 -16.0 -6.1 38 47 A V H X S+ 0 0 3 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.936 109.5 49.4 -51.9 -50.3 -18.1 -17.2 -4.8 39 48 A S H X S+ 0 0 61 -4,-1.6 4,-0.8 1,-0.2 -2,-0.2 0.866 112.7 47.7 -59.7 -42.0 -19.7 -15.5 -7.9 40 49 A R H >X S+ 0 0 164 -4,-2.1 4,-2.5 1,-0.2 3,-1.1 0.953 109.4 50.0 -61.5 -54.9 -17.2 -17.2 -10.2 41 50 A L H 3X S+ 0 0 9 -4,-2.8 4,-1.6 1,-0.3 -1,-0.2 0.736 104.6 58.8 -66.9 -22.7 -17.5 -20.7 -8.9 42 51 A L H 3X S+ 0 0 26 -4,-1.4 4,-0.6 -5,-0.2 -1,-0.3 0.813 110.1 43.9 -72.9 -31.0 -21.3 -20.6 -9.1 43 52 A E H XX S+ 0 0 113 -3,-1.1 4,-3.4 -4,-0.8 3,-0.9 0.923 111.2 53.0 -74.9 -47.3 -21.0 -19.9 -12.8 44 53 A K H 3X S+ 0 0 105 -4,-2.5 4,-2.1 1,-0.3 6,-0.3 0.809 104.8 56.9 -59.0 -32.7 -18.3 -22.6 -13.3 45 54 A G H 3<>S+ 0 0 0 -4,-1.6 6,-3.3 -5,-0.2 5,-1.4 0.815 114.0 39.0 -65.1 -32.7 -20.7 -25.1 -11.6 46 55 A H H X<5S+ 0 0 35 -3,-0.9 3,-0.7 -4,-0.6 -2,-0.2 0.875 115.4 51.0 -83.0 -43.0 -23.3 -24.3 -14.2 47 56 A Q H 3<5S+ 0 0 120 -4,-3.4 80,-0.2 1,-0.2 -2,-0.2 0.868 117.8 38.2 -64.6 -36.2 -20.9 -24.1 -17.1 48 57 A S T 3<5S- 0 0 25 -4,-2.1 80,-3.7 -5,-0.2 -1,-0.2 0.333 112.9-114.2-100.3 5.8 -19.3 -27.4 -16.4 49 58 A G T < 5S+ 0 0 3 -3,-0.7 80,-0.3 78,-0.2 -3,-0.2 0.748 79.7 124.4 70.6 24.9 -22.5 -29.2 -15.3 50 59 A I S S- 0 0 20 -2,-1.3 3,-1.5 290,-0.1 4,-0.2 -0.988 80.8-115.9-147.1 157.5 -42.6 -31.2 -16.7 58 67 A R T 3 S+ 0 0 172 -2,-0.3 3,-0.4 1,-0.3 -1,-0.1 0.725 116.3 63.1 -59.4 -19.4 -43.9 -32.4 -20.0 59 68 A F T 3 + 0 0 28 1,-0.2 -1,-0.3 3,-0.1 -3,-0.1 0.071 61.8 115.0 -96.6 23.8 -43.3 -28.7 -21.0 60 69 A E S < S+ 0 0 29 -3,-1.5 -1,-0.2 -5,-0.1 252,-0.2 0.972 92.0 7.3 -51.4 -55.0 -39.5 -28.6 -20.5 61 70 A G S S- 0 0 0 -3,-0.4 2,-1.6 -4,-0.2 20,-0.2 -0.292 118.9 -51.6-109.7-166.2 -39.2 -28.0 -24.2 62 71 A C > - 0 0 0 18,-2.2 4,-2.5 1,-0.2 5,-0.2 -0.630 56.9-172.5 -72.5 91.8 -41.7 -27.3 -27.0 63 72 A L H > S+ 0 0 52 -2,-1.6 4,-2.6 1,-0.2 5,-0.2 0.899 77.1 56.5 -52.5 -49.5 -43.9 -30.2 -26.2 64 73 A E H > S+ 0 0 71 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.911 113.5 40.0 -54.3 -48.4 -46.1 -29.8 -29.4 65 74 A Y H > S+ 0 0 56 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.925 111.7 56.7 -67.1 -48.1 -43.1 -30.0 -31.7 66 75 A E H X S+ 0 0 13 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.915 108.7 47.2 -48.5 -50.0 -41.3 -32.8 -29.7 67 76 A T H X S+ 0 0 45 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.886 111.1 48.8 -67.4 -41.2 -44.3 -35.1 -30.0 68 77 A Q H X S+ 0 0 90 -4,-1.7 4,-3.0 -5,-0.2 5,-0.3 0.930 111.5 52.5 -61.0 -44.3 -44.9 -34.6 -33.7 69 78 A L H X S+ 0 0 0 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.857 108.0 49.1 -58.0 -41.5 -41.2 -35.2 -34.2 70 79 A R H X>S+ 0 0 104 -4,-2.1 4,-1.6 -5,-0.2 5,-1.0 0.937 114.9 47.4 -61.0 -46.7 -41.3 -38.5 -32.3 71 80 A R H <5S+ 0 0 185 -4,-2.0 3,-0.3 1,-0.2 -2,-0.2 0.957 116.1 40.0 -61.2 -57.2 -44.3 -39.6 -34.4 72 81 A Q H <5S+ 0 0 115 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.797 128.9 29.0 -67.4 -32.5 -42.9 -38.7 -37.8 73 82 A F H <5S- 0 0 25 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.456 99.2-121.9-113.1 0.5 -39.4 -39.9 -37.3 74 83 A S T <5 - 0 0 104 -4,-1.6 2,-0.4 -3,-0.3 -3,-0.2 0.979 45.0-176.9 55.2 59.1 -39.8 -42.7 -34.8 75 84 A L < - 0 0 10 -5,-1.0 206,-0.2 -6,-0.2 -1,-0.2 -0.745 31.5-154.5 -93.3 135.2 -37.4 -41.0 -32.3 76 85 A Q S S+ 0 0 98 204,-2.2 2,-0.3 -2,-0.4 205,-0.2 0.874 86.0 8.5 -67.7 -40.8 -36.5 -42.7 -29.0 77 86 A H E +b 281 0B 63 203,-1.0 205,-1.4 2,-0.0 2,-0.3 -0.991 67.9 179.5-143.3 150.0 -35.8 -39.2 -27.5 78 87 A V E -b 282 0B 5 -2,-0.3 2,-0.4 203,-0.2 205,-0.2 -0.980 7.1-177.8-153.1 134.3 -36.4 -35.6 -28.5 79 88 A R E -b 283 0B 39 203,-2.5 205,-2.2 -2,-0.3 2,-0.5 -0.999 3.9-172.4-134.0 132.7 -35.8 -32.2 -27.1 80 89 A V E -b 284 0B 0 -2,-0.4 -18,-2.2 203,-0.2 205,-0.3 -0.959 23.2-141.0-122.1 108.3 -36.7 -29.0 -28.7 81 90 A I E -b 285 0B 0 203,-3.2 205,-2.2 -2,-0.5 -20,-0.1 -0.500 27.6 -98.3 -78.2 137.6 -35.3 -26.0 -26.8 82 91 A P - 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -21,-0.0 -0.322 51.7-104.5 -57.3 126.1 -37.5 -22.9 -26.4 83 92 A G - 0 0 18 -2,-0.1 2,-0.3 -3,-0.1 -3,-0.0 0.111 35.3-170.5 -56.7 157.3 -36.5 -20.3 -28.9 84 93 A L - 0 0 39 3,-0.1 2,-0.4 0, 0.0 3,-0.1 -0.992 25.8-109.7-147.0 151.0 -34.5 -17.1 -28.5 85 94 A A S S- 0 0 51 -2,-0.3 0, 0.0 1,-0.2 0, 0.0 -0.670 92.0 -19.1 -83.3 125.0 -33.6 -14.0 -30.6 86 95 A D S S+ 0 0 170 -2,-0.4 -1,-0.2 1,-0.2 3,-0.0 0.437 94.5 150.0 63.3 1.4 -29.9 -13.6 -31.8 87 96 A A - 0 0 30 -3,-0.1 2,-1.4 1,-0.1 -1,-0.2 -0.212 64.3 -95.1 -60.9 151.8 -28.7 -16.1 -29.1 88 97 A D > - 0 0 114 1,-0.2 4,-2.1 2,-0.1 5,-0.2 -0.611 40.2-167.5 -66.0 94.7 -25.7 -18.2 -29.7 89 98 A V H > S+ 0 0 55 -2,-1.4 4,-2.7 1,-0.2 5,-0.2 0.844 84.5 59.6 -56.8 -36.9 -27.7 -21.2 -30.9 90 99 A G H > S+ 0 0 20 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.946 109.0 42.0 -53.9 -51.8 -24.5 -23.3 -30.6 91 100 A G H > S+ 0 0 16 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.814 115.1 49.9 -68.2 -33.7 -24.2 -22.5 -26.9 92 101 A R H X S+ 0 0 14 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.869 107.7 51.9 -74.4 -40.4 -28.0 -23.0 -26.2 93 102 A L H X S+ 0 0 5 -4,-2.7 4,-2.9 -5,-0.2 5,-0.2 0.857 104.8 63.9 -59.8 -35.3 -28.1 -26.3 -28.0 94 103 A G H X S+ 0 0 0 -4,-1.4 4,-2.7 -5,-0.2 5,-0.2 0.965 102.8 42.3 -47.3 -67.5 -25.2 -27.1 -25.7 95 104 A I H X S+ 0 0 8 -4,-1.5 4,-2.8 2,-0.2 5,-0.2 0.933 116.3 50.2 -50.7 -53.4 -27.1 -26.9 -22.4 96 105 A G H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.954 112.2 45.0 -49.3 -63.1 -30.1 -28.7 -23.9 97 106 A A H X S+ 0 0 1 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.853 113.0 51.4 -53.4 -41.5 -28.0 -31.6 -25.2 98 107 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.2 -1,-0.2 0.952 110.1 49.6 -59.9 -48.1 -26.0 -31.9 -22.0 99 108 A H H X S+ 0 0 20 -4,-2.8 4,-0.8 -5,-0.2 -2,-0.2 0.844 110.3 50.2 -63.2 -35.3 -29.2 -32.1 -19.9 100 109 A M H >< S+ 0 0 11 -4,-2.2 3,-1.1 -5,-0.2 4,-0.4 0.946 109.7 49.6 -66.7 -48.3 -30.8 -34.7 -22.1 101 110 A L H >X S+ 0 0 1 -4,-2.2 4,-2.5 1,-0.3 3,-1.3 0.839 102.2 61.9 -60.7 -35.7 -27.7 -37.0 -21.9 102 111 A M H 3< S+ 0 0 7 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.826 106.9 47.5 -55.2 -31.7 -27.6 -36.6 -18.1 103 112 A S T << S+ 0 0 77 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.540 117.5 41.2 -85.6 -7.5 -31.0 -38.3 -18.3 104 113 A L T <4 S+ 0 0 24 -3,-1.3 2,-0.5 -4,-0.4 -2,-0.2 0.712 91.0 88.1-113.2 -30.9 -29.9 -41.1 -20.6 105 114 A L < - 0 0 7 -4,-2.5 3,-0.1 -5,-0.1 30,-0.0 -0.662 60.7-151.0 -85.0 122.9 -26.5 -42.2 -19.5 106 115 A Q > - 0 0 108 -2,-0.5 3,-1.8 1,-0.1 -2,-0.1 -0.556 45.1 -74.3 -80.3 155.7 -26.3 -44.9 -16.9 107 116 A P T 3 S+ 0 0 79 0, 0.0 27,-0.2 0, 0.0 -1,-0.1 -0.235 117.2 6.6 -53.7 134.2 -23.2 -44.9 -14.5 108 117 A Q T 3 S+ 0 0 102 25,-3.0 27,-0.1 1,-0.2 26,-0.1 0.593 94.0 142.9 66.5 15.0 -20.0 -46.0 -16.3 109 118 A Q < - 0 0 43 -3,-1.8 27,-2.3 24,-0.2 2,-0.5 -0.306 52.4-106.8 -77.1 170.2 -21.6 -46.3 -19.7 110 119 A M E -c 136 0B 31 25,-0.2 85,-2.4 83,-0.1 86,-1.6 -0.895 26.2-164.5-111.6 124.1 -19.7 -45.3 -22.9 111 120 A L E -cd 137 196B 0 25,-2.7 27,-1.7 -2,-0.5 2,-0.3 -0.914 7.2-154.0-108.6 116.8 -20.4 -42.2 -24.9 112 121 A A E -cd 138 197B 0 84,-2.3 86,-2.2 -2,-0.6 2,-0.4 -0.652 18.4-158.8 -85.2 146.8 -19.0 -41.8 -28.4 113 122 A I E -cd 139 198B 0 25,-2.2 27,-3.2 -2,-0.3 28,-0.6 -0.983 12.8-154.7-138.8 136.7 -18.4 -38.3 -29.6 114 123 A G - 0 0 0 84,-1.9 2,-0.1 -2,-0.4 85,-0.0 -0.370 29.9-104.2 -92.5 178.4 -18.1 -36.4 -32.9 115 124 A F + 0 0 56 -2,-0.1 85,-0.5 4,-0.1 4,-0.3 -0.365 63.4 83.3 -94.8 177.2 -16.2 -33.1 -33.5 116 125 A G S > S- 0 0 35 30,-0.3 4,-2.5 1,-0.1 5,-0.3 -0.061 83.1 -71.3 108.8 156.9 -17.7 -29.7 -34.0 117 126 A E H > S+ 0 0 133 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.813 123.9 46.1 -51.2 -44.3 -18.9 -26.6 -32.1 118 127 A A H > S+ 0 0 18 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.926 115.3 44.2 -70.9 -45.1 -22.2 -28.1 -30.8 119 128 A T H > S+ 0 0 0 -4,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.940 116.0 46.3 -66.9 -49.0 -20.8 -31.5 -29.7 120 129 A M H X S+ 0 0 4 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.874 112.7 53.5 -57.1 -39.0 -17.7 -29.9 -28.0 121 130 A N H X S+ 0 0 21 -4,-1.7 4,-1.5 -5,-0.3 -2,-0.2 0.892 108.0 48.4 -64.1 -43.5 -20.1 -27.4 -26.5 122 131 A T H < S+ 0 0 0 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.751 109.3 53.1 -67.0 -32.5 -22.3 -30.1 -25.1 123 132 A L H >X S+ 0 0 0 -4,-1.7 3,-1.0 2,-0.2 4,-0.5 0.834 104.0 56.0 -75.0 -36.3 -19.3 -31.9 -23.6 124 133 A Q H >< S+ 0 0 58 -4,-1.8 3,-0.9 1,-0.2 4,-0.3 0.923 109.3 46.7 -56.9 -45.5 -18.2 -28.7 -21.9 125 134 A R T 3< S+ 0 0 43 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.452 113.3 51.7 -79.8 3.2 -21.6 -28.6 -20.2 126 135 A L T <> S+ 0 0 0 -3,-1.0 4,-3.2 2,-0.1 -1,-0.2 0.381 74.7 100.8-118.2 -1.4 -21.4 -32.3 -19.3 127 136 A S H S+ 0 0 2 -80,-3.7 4,-2.4 -4,-0.3 -1,-0.2 0.951 115.6 39.8 -46.5 -56.9 -19.4 -32.5 -14.1 129 138 A F H > S+ 0 0 6 -80,-0.3 4,-2.6 -81,-0.2 6,-0.3 0.911 109.3 60.3 -63.0 -46.9 -21.6 -35.5 -15.0 130 139 A I H <>S+ 0 0 0 -4,-3.2 5,-3.2 1,-0.2 4,-0.2 0.922 117.2 29.9 -48.8 -56.6 -19.0 -37.3 -17.0 131 140 A S H ><5S+ 0 0 29 -4,-2.0 3,-0.8 3,-0.2 -1,-0.2 0.879 115.9 60.3 -71.8 -40.6 -16.5 -37.6 -14.1 132 141 A S H 3<5S+ 0 0 29 -4,-2.4 -2,-0.2 -5,-0.4 -1,-0.2 0.845 120.3 27.8 -55.8 -32.3 -19.3 -37.8 -11.5 133 142 A Q T 3<5S- 0 0 56 -4,-2.6 -25,-3.0 -5,-0.1 -1,-0.2 0.252 108.6-117.8-117.0 9.9 -20.6 -40.9 -13.2 134 143 A Q T < 5 - 0 0 121 -3,-0.8 -3,-0.2 -4,-0.2 2,-0.2 0.894 43.8-176.4 56.5 46.5 -17.4 -42.2 -14.7 135 144 A I < - 0 0 1 -5,-3.2 2,-0.5 -6,-0.3 24,-0.2 -0.536 19.2-135.3 -74.2 140.1 -18.7 -42.0 -18.2 136 145 A R E -c 110 0B 105 -27,-2.3 -25,-2.7 -2,-0.2 2,-0.3 -0.894 17.2-152.3-102.4 125.6 -16.2 -43.3 -20.7 137 146 A L E -ce 111 160B 0 22,-2.7 24,-2.9 -2,-0.5 2,-0.4 -0.743 13.8-179.5 -98.6 143.5 -15.5 -41.2 -23.8 138 147 A V E -ce 112 161B 1 -27,-1.7 -25,-2.2 -2,-0.3 2,-0.3 -0.988 28.4-123.0-136.7 133.2 -14.4 -42.4 -27.3 139 148 A T E -c 113 0B 0 22,-1.7 52,-0.2 -2,-0.4 -25,-0.2 -0.554 11.6-156.7 -70.1 132.2 -13.8 -40.3 -30.3 140 149 A L S S+ 0 0 0 -27,-3.2 106,-2.8 -2,-0.3 2,-0.2 0.791 76.1 28.6 -74.1 -30.0 -15.9 -41.3 -33.3 141 150 A S B S-H 245 0C 3 -28,-0.6 22,-0.4 104,-0.3 3,-0.4 -0.774 86.0 -98.4-129.2 168.9 -13.5 -39.8 -35.8 142 151 A G S S+ 0 0 0 102,-2.5 25,-0.4 25,-0.4 -1,-0.2 -0.067 73.2 99.7 -69.3-176.6 -9.8 -38.9 -36.2 143 152 A G - 0 0 19 22,-3.0 2,-3.2 20,-0.2 24,-0.2 -0.332 45.6-171.2 132.7 -49.7 -8.6 -35.4 -35.5 144 153 A V S S+ 0 0 62 -3,-0.4 3,-0.4 1,-0.3 4,-0.2 -0.297 80.6 49.0 64.5 -62.2 -7.1 -35.7 -32.0 145 154 A G S > S+ 0 0 48 -2,-3.2 3,-0.9 1,-0.2 -1,-0.3 0.746 100.5 63.7 -83.3 -25.1 -6.6 -31.9 -31.5 146 155 A S T 3 S+ 0 0 59 1,-0.2 3,-0.4 -3,-0.2 -30,-0.3 0.672 99.5 54.4 -74.1 -18.2 -10.1 -30.8 -32.6 147 156 A Y T >> S+ 0 0 0 -3,-0.4 3,-1.9 1,-0.2 4,-1.8 0.551 83.0 94.0 -85.0 -10.4 -11.6 -32.7 -29.6 148 157 A M H <> S+ 0 0 97 -3,-0.9 4,-1.1 1,-0.3 -1,-0.2 0.698 72.7 63.0 -60.6 -24.7 -9.4 -30.9 -27.2 149 158 A T H 34 S+ 0 0 78 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.650 113.5 35.0 -75.0 -14.7 -11.9 -28.1 -26.5 150 159 A G H <4 S+ 0 0 0 -3,-1.9 3,-0.3 2,-0.1 4,-0.2 0.730 123.0 40.9-105.2 -32.0 -14.3 -30.7 -25.0 151 160 A I H < S+ 0 0 19 -4,-1.8 3,-0.2 1,-0.2 -3,-0.2 0.461 97.6 75.1 -98.8 -3.5 -11.9 -33.2 -23.3 152 161 A G S < S+ 0 0 53 -4,-1.1 -1,-0.2 -5,-0.3 -3,-0.1 0.630 89.6 64.0 -77.5 -13.9 -9.5 -30.5 -21.9 153 162 A Q S S+ 0 0 95 -3,-0.3 -1,-0.2 -5,-0.1 -2,-0.2 0.811 87.3 89.8 -75.3 -33.2 -12.2 -29.9 -19.3 154 163 A L S S- 0 0 23 -3,-0.2 2,-0.2 -4,-0.2 -26,-0.1 -0.018 80.1-101.5 -72.7 165.9 -12.1 -33.3 -17.6 155 164 A N > - 0 0 83 -28,-0.2 3,-1.8 1,-0.1 -1,-0.1 -0.506 33.3-113.6 -72.0 151.0 -10.1 -34.7 -14.7 156 165 A A T 3 S+ 0 0 113 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.1 0.859 114.4 73.4 -48.6 -34.6 -7.1 -36.9 -15.5 157 166 A A T 3 S+ 0 0 99 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.655 76.4 93.4 -56.8 -26.4 -9.3 -39.6 -13.8 158 167 A C S < S- 0 0 16 -3,-1.8 2,-0.8 1,-0.1 -22,-0.1 -0.560 78.9-122.7 -77.5 132.7 -11.8 -39.9 -16.8 159 168 A S + 0 0 63 -2,-0.3 -22,-2.7 -24,-0.2 2,-0.5 -0.633 35.0 174.5 -68.2 107.8 -11.3 -42.5 -19.5 160 169 A V E -e 137 0B 52 -2,-0.8 2,-0.8 -24,-0.2 -22,-0.2 -0.969 12.9-163.3-119.4 114.7 -11.0 -40.7 -22.8 161 170 A N E -e 138 0B 59 -24,-2.9 -22,-1.7 -2,-0.5 2,-0.3 -0.820 11.6-166.4-105.4 96.9 -10.1 -43.1 -25.6 162 171 A I - 0 0 42 -2,-0.8 25,-0.1 -24,-0.2 -20,-0.1 -0.615 25.2-122.3 -91.8 141.6 -8.9 -41.1 -28.7 163 172 A I - 0 0 0 -22,-0.4 2,-2.2 -2,-0.3 -20,-0.2 -0.712 28.9-137.1 -76.2 115.8 -8.4 -42.3 -32.3 164 173 A P S S+ 0 0 68 0, 0.0 20,-0.1 0, 0.0 -1,-0.1 -0.413 70.1 78.9 -82.3 69.3 -4.7 -41.6 -32.8 165 174 A A S S- 0 0 8 -2,-2.2 -22,-3.0 -24,-0.1 -2,-0.1 -0.958 84.0 -91.1-158.1 163.2 -5.0 -40.2 -36.4 166 175 A P - 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0 0 64 1,-0.0 5,-0.1 3,-0.0 0, 0.0 -0.991 360.0-120.5-124.4 131.3 -50.0 -20.9 -22.4 302 14 B C > - 0 0 63 -2,-0.4 4,-1.1 1,-0.1 5,-0.1 -0.044 32.5-109.9 -47.0 161.2 -50.9 -23.1 -19.4 303 15 B E H >> S+ 0 0 105 2,-0.2 4,-1.9 1,-0.2 3,-0.7 0.964 122.5 49.1 -58.6 -52.2 -49.5 -21.9 -16.1 304 16 B E H 3> S+ 0 0 61 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.888 107.3 54.3 -55.4 -43.2 -47.1 -25.0 -16.1 305 17 B E H 3> S+ 0 0 31 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.814 111.1 46.2 -62.4 -29.9 -46.0 -24.2 -19.7 306 18 B Q H S+ 0 0 1 -4,-2.3 5,-1.7 1,-0.2 4,-1.6 0.864 114.6 46.8 -53.4 -45.5 -35.2 -22.5 -19.0 313 25 B F H <5S+ 0 0 15 -4,-2.2 6,-2.1 3,-0.2 -1,-0.2 0.881 118.6 40.2 -68.1 -35.8 -34.6 -18.8 -19.5 314 26 B Y H <5S+ 0 0 66 -4,-2.6 -2,-0.2 -3,-0.2 -1,-0.2 0.839 126.8 28.3 -83.3 -36.3 -33.5 -18.2 -15.9 315 27 B Y H <5S+ 0 0 24 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.649 132.2 28.9-103.7 -22.2 -31.4 -21.2 -15.2 316 28 B H T <5S+ 0 0 13 -4,-1.6 -3,-0.2 -5,-0.5 -4,-0.1 0.774 132.6 31.0-107.6 -40.0 -30.0 -22.3 -18.6 317 29 B D S - 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0 0 26 -5,-1.4 -1,-0.2 -6,-0.3 -2,-0.2 -0.917 64.4 -94.6-122.2 153.3 -45.8 -10.7 -18.3 331 43 B T > - 0 0 83 -2,-0.3 4,-3.1 1,-0.1 5,-0.1 -0.335 20.3-129.8 -66.9 144.3 -45.2 -8.7 -15.1 332 44 B R H > S+ 0 0 117 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.880 115.2 57.1 -52.5 -41.0 -42.0 -9.0 -13.1 333 45 B L H > S+ 0 0 126 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.890 109.4 43.8 -57.6 -43.8 -44.4 -9.4 -10.1 334 46 B K H > S+ 0 0 89 2,-0.2 4,-2.6 1,-0.1 5,-0.2 0.969 112.7 51.4 -64.9 -54.1 -46.0 -12.4 -12.0 335 47 B V H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 5,-0.3 0.919 108.3 51.8 -50.0 -54.0 -42.6 -13.8 -13.0 336 48 B S H X S+ 0 0 38 -4,-3.2 4,-1.9 1,-0.2 -1,-0.2 0.900 112.6 46.2 -47.0 -50.0 -41.4 -13.7 -9.4 337 49 B R H X S+ 0 0 177 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.865 112.0 51.2 -61.8 -39.0 -44.5 -15.6 -8.3 338 50 B L H X S+ 0 0 9 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.757 109.9 48.1 -75.2 -28.1 -44.2 -18.1 -11.1 339 51 B L H X S+ 0 0 24 -4,-2.3 4,-2.0 -5,-0.2 5,-0.3 0.840 110.2 54.1 -72.5 -39.1 -40.6 -18.9 -10.2 340 52 B E H X S+ 0 0 117 -4,-1.9 4,-3.7 -5,-0.3 -2,-0.2 0.909 111.1 45.8 -57.3 -43.1 -41.8 -19.2 -6.6 341 53 B K H X S+ 0 0 110 -4,-2.1 4,-1.4 2,-0.2 6,-0.3 0.821 106.6 56.8 -72.7 -34.4 -44.4 -21.8 -7.9 342 54 B G H < S+ 0 0 0 -4,-1.5 6,-1.8 2,-0.2 5,-0.4 0.925 120.8 31.0 -61.7 -46.2 -41.9 -23.7 -10.0 343 55 B H H < S+ 0 0 79 -4,-2.0 -2,-0.2 4,-0.2 3,-0.2 0.939 103.5 80.4 -69.7 -49.0 -39.8 -24.2 -6.9 344 56 B Q H < S- 0 0 139 -4,-3.7 2,-0.2 -5,-0.3 -2,-0.2 0.700 115.1 -16.0 -32.0 -42.6 -42.9 -24.2 -4.7 345 57 B S S < S- 0 0 99 -4,-1.4 2,-1.5 -3,-0.2 -1,-0.2 -0.758 112.7 -19.0-171.5 135.5 -43.4 -27.8 -5.7 346 58 B G S S+ 0 0 48 -3,-0.2 -290,-0.1 -2,-0.2 -4,-0.1 -0.461 103.8 68.4 93.3 -61.9 -42.4 -30.4 -8.2 347 59 B I S S+ 0 0 25 -2,-1.5 -291,-2.4 -5,-0.4 2,-0.7 0.962 87.8 50.2 -73.5 -66.9 -41.0 -28.7 -11.3 348 60 B I E +A 55 0A 10 -6,-1.8 2,-0.4 -293,-0.2 -293,-0.2 -0.640 64.6 170.5 -83.7 113.7 -37.7 -27.0 -10.6 349 61 B R E -A 54 0A 151 -295,-2.2 -295,-2.4 -2,-0.7 2,-0.7 -0.987 23.5-147.2-128.6 123.1 -35.2 -29.3 -8.9 350 62 B V E -A 53 0A 18 -2,-0.4 2,-0.3 -297,-0.2 -297,-0.2 -0.826 19.9-179.2 -95.5 114.1 -31.6 -28.6 -8.4 351 63 B Q E -A 52 0A 62 -299,-2.9 -299,-2.9 -2,-0.7 2,-0.4 -0.795 15.6-144.4-105.6 150.8 -29.3 -31.6 -8.5 352 64 B I E -A 51 0A 2 -2,-0.3 2,-0.9 -301,-0.2 -301,-0.2 -0.978 4.8-146.1-118.0 130.2 -25.5 -31.6 -8.1 353 65 B N + 0 0 3 -303,-3.8 2,-0.2 -2,-0.4 -221,-0.1 -0.818 57.1 84.2 -96.3 99.5 -23.1 -33.8 -10.0 354 66 B S S > S- 0 0 12 -2,-0.9 3,-1.0 -222,-0.1 4,-0.4 -0.909 82.3-105.0-174.7 165.6 -20.1 -34.8 -7.8 355 67 B R T >> S+ 0 0 96 -2,-0.2 3,-1.1 1,-0.2 4,-0.8 0.877 115.3 67.4 -63.1 -33.8 -18.9 -37.3 -5.2 356 68 B F H 3> S+ 0 0 6 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.677 80.3 77.4 -60.0 -21.8 -19.3 -34.4 -2.6 357 69 B E H <> S+ 0 0 52 -3,-1.0 4,-2.4 1,-0.2 -1,-0.2 0.915 93.7 49.6 -56.0 -44.7 -23.1 -34.4 -3.0 358 70 B G H <> S+ 0 0 17 -3,-1.1 4,-2.7 -4,-0.4 5,-0.3 0.915 109.8 51.5 -61.4 -45.2 -23.4 -37.5 -0.9 359 71 B C H X S+ 0 0 0 -4,-0.8 4,-2.7 1,-0.2 5,-0.2 0.973 109.5 49.4 -52.4 -58.4 -21.2 -36.0 1.8 360 72 B L H X S+ 0 0 2 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.876 112.2 50.3 -48.3 -44.8 -23.4 -32.8 1.8 361 73 B E H X S+ 0 0 80 -4,-2.4 4,-2.0 2,-0.2 3,-0.3 0.981 112.6 42.5 -59.8 -62.6 -26.5 -35.0 2.1 362 74 B Y H X S+ 0 0 65 -4,-2.7 4,-2.6 1,-0.3 5,-0.2 0.792 112.8 57.0 -54.8 -32.3 -25.3 -37.1 5.1 363 75 B E H X S+ 0 0 6 -4,-2.7 4,-2.2 -5,-0.3 -1,-0.3 0.938 106.8 48.1 -61.6 -47.9 -24.0 -33.9 6.6 364 76 B T H X S+ 0 0 20 -4,-2.3 4,-1.5 -3,-0.3 -2,-0.2 0.840 114.5 45.5 -63.7 -35.5 -27.4 -32.4 6.4 365 77 B Q H X S+ 0 0 70 -4,-2.0 4,-3.7 2,-0.2 5,-0.3 0.936 111.2 50.0 -75.4 -49.3 -29.1 -35.4 8.0 366 78 B L H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 6,-0.5 0.914 110.3 54.2 -50.2 -45.0 -26.5 -35.9 10.8 367 79 B R H < S+ 0 0 81 -4,-2.2 5,-0.5 -5,-0.2 4,-0.4 0.896 116.5 35.7 -59.0 -43.7 -27.0 -32.2 11.5 368 80 B R H < S+ 0 0 192 -4,-1.5 -2,-0.2 3,-0.2 3,-0.2 0.920 120.1 47.1 -74.7 -44.8 -30.8 -32.7 11.8 369 81 B Q H < S+ 0 0 109 -4,-3.7 -2,-0.2 1,-0.2 -3,-0.2 0.688 127.3 24.5 -75.5 -25.1 -30.9 -36.1 13.4 370 82 B F S < S- 0 0 26 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.257 98.2-128.3-123.3 7.4 -28.2 -35.5 16.1 371 83 B S - 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