==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER COMPLEX (OPERON REPRESSOR/PEPTIDE) 12-MAY-95 1WRS . COMPND 2 MOLECULE: HOLO TRP REPRESSOR; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR D.ZHAO,Z.ZHENG . 210 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15321.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 135 64.3 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 . 9 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 42.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 4.3 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 0 1 0 1 2 1 0 1 0 0 1 0 1 1 1 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 . 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 4 R Q 0 0 229 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 163.1 41.5 0.3 39.5 2 5 R S - 0 0 95 2,-0.0 2,-0.2 0, 0.0 0, 0.0 -0.464 360.0-173.3-147.4 71.5 40.1 -3.2 39.1 3 6 R P - 0 0 101 0, 0.0 2,-1.4 0, 0.0 3,-0.2 -0.434 24.5-131.6 -67.4 133.4 36.7 -3.3 37.3 4 7 R Y S S- 0 0 209 2,-0.2 -2,-0.0 1,-0.2 0, 0.0 -0.665 77.4 -44.1 -89.6 89.6 35.0 -6.7 37.3 5 8 R S S S- 0 0 118 -2,-1.4 -1,-0.2 2,-0.0 0, 0.0 0.956 98.9 -83.2 54.9 52.6 34.0 -7.1 33.6 6 9 R A - 0 0 83 -3,-0.2 2,-0.3 2,-0.1 -2,-0.2 -0.175 69.2 -76.2 51.7-144.4 32.7 -3.5 33.4 7 10 R A - 0 0 79 -4,-0.1 2,-1.4 0, 0.0 -2,-0.0 -0.926 38.9 -90.4-144.8 169.5 29.1 -3.2 34.7 8 11 R M - 0 0 176 -2,-0.3 -2,-0.1 6,-0.0 0, 0.0 -0.641 46.8-152.4 -85.9 90.2 25.6 -4.0 33.7 9 12 R A - 0 0 55 -2,-1.4 4,-0.1 1,-0.1 5,-0.1 -0.213 8.8-140.7 -58.9 151.0 24.5 -0.8 32.0 10 13 R E S S+ 0 0 200 2,-0.1 -1,-0.1 3,-0.0 3,-0.1 0.943 81.9 56.8 -80.4 -49.7 20.8 0.0 32.1 11 14 R Q S S- 0 0 142 1,-0.1 2,-1.0 2,-0.0 3,-0.3 -0.070 109.5 -75.6 -72.5 179.4 20.4 1.4 28.6 12 15 R R S S+ 0 0 140 1,-0.2 -1,-0.1 2,-0.1 -2,-0.1 -0.663 84.9 115.0 -83.0 104.5 21.4 -0.5 25.4 13 16 R H > + 0 0 70 -2,-1.0 4,-0.8 -4,-0.1 -1,-0.2 0.402 65.5 57.0-144.2 -11.1 25.2 -0.4 25.2 14 17 R Q H > S+ 0 0 95 -3,-0.3 4,-1.7 2,-0.2 3,-0.2 0.911 111.7 34.0 -90.1 -72.4 26.3 -4.1 25.5 15 18 R E H > S+ 0 0 61 1,-0.3 4,-1.7 2,-0.2 5,-0.2 0.888 117.6 62.0 -49.3 -35.3 24.6 -6.1 22.8 16 19 R W H > S+ 0 0 5 1,-0.3 4,-1.9 2,-0.2 -1,-0.3 0.974 98.7 51.9 -51.0 -62.5 25.0 -2.9 20.8 17 20 R L H X S+ 0 0 82 -4,-0.8 4,-3.1 1,-0.2 5,-0.3 0.828 102.8 62.1 -45.8 -38.1 28.7 -3.1 21.1 18 21 R R H X S+ 0 0 96 -4,-1.7 4,-1.9 1,-0.2 5,-0.4 0.991 102.1 47.7 -55.9 -66.4 28.5 -6.7 19.8 19 22 R F H X S+ 0 0 4 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.891 120.9 41.5 -39.3 -43.2 27.0 -5.6 16.4 20 23 R V H X S+ 0 0 1 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 1.000 104.5 60.7 -68.1 -70.7 29.8 -3.0 16.4 21 24 R D H X S+ 0 0 31 -4,-3.1 4,-1.4 1,-0.3 -1,-0.2 0.753 114.3 37.5 -26.0 -48.8 32.8 -5.0 17.6 22 25 R L H X S+ 0 0 19 -4,-1.9 4,-1.8 -5,-0.3 -1,-0.3 0.956 112.1 57.9 -77.3 -45.7 32.5 -7.4 14.7 23 26 R L H X S+ 0 0 2 -4,-1.7 4,-1.8 -5,-0.4 -2,-0.2 0.928 115.9 35.7 -47.1 -52.7 31.5 -4.7 12.2 24 27 R K H X S+ 0 0 33 -4,-2.1 4,-1.2 1,-0.2 3,-0.3 0.999 113.7 52.2 -66.9 -68.5 34.7 -2.8 12.8 25 28 R N H < S+ 0 0 66 -4,-1.4 4,-0.3 1,-0.2 -1,-0.2 0.736 113.0 53.8 -41.9 -20.5 37.3 -5.6 13.4 26 29 R A H >X>S+ 0 0 0 -4,-1.8 3,-3.0 -5,-0.2 5,-0.7 0.949 92.9 61.2 -83.6 -54.2 35.9 -6.9 10.1 27 30 R Y H 3<5S+ 0 0 79 -4,-1.8 -2,-0.2 -3,-0.3 -1,-0.2 0.808 89.8 78.6 -43.8 -26.0 36.3 -4.0 7.7 28 31 R Q T 3<5S+ 0 0 145 -4,-1.2 -1,-0.3 1,-0.1 -2,-0.2 0.887 118.0 6.0 -50.8 -41.9 40.0 -4.4 8.6 29 32 R N T <45S- 0 0 102 -3,-3.0 -2,-0.2 -4,-0.3 -3,-0.1 0.772 115.3 -84.5-106.1 -72.2 40.1 -7.3 6.2 30 33 R D T <5S+ 0 0 92 -4,-0.7 3,-0.5 0, 0.0 -3,-0.2 0.359 93.4 102.0 170.7 17.4 36.8 -7.7 4.3 31 34 R L >< + 0 0 15 -5,-0.7 4,-2.5 1,-0.2 5,-0.3 0.591 53.2 99.9 -92.7 -10.5 34.2 -9.7 6.3 32 35 R H H > S+ 0 0 31 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.810 79.3 56.5 -44.5 -30.9 32.3 -6.6 7.3 33 36 R L H > S+ 0 0 72 -3,-0.5 4,-1.7 2,-0.2 -1,-0.2 0.984 109.9 40.2 -69.7 -58.1 29.8 -7.3 4.5 34 37 R P H 4 S+ 0 0 48 0, 0.0 4,-0.3 0, 0.0 -2,-0.2 0.840 120.4 48.2 -58.2 -30.0 28.8 -10.9 5.6 35 38 R L H >X S+ 0 0 4 -4,-2.5 3,-2.2 2,-0.2 4,-1.6 0.913 102.1 60.6 -75.5 -46.0 28.8 -9.6 9.2 36 39 R L H 3< S+ 0 0 2 -4,-2.8 4,-0.4 -5,-0.3 -1,-0.2 0.916 105.0 51.0 -45.9 -44.2 26.8 -6.5 8.5 37 40 R N T 3< S+ 0 0 68 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.641 104.4 60.8 -70.2 -16.5 24.0 -8.9 7.3 38 41 R L T <4 S+ 0 0 43 -3,-2.2 -2,-0.2 -4,-0.3 -1,-0.2 0.931 124.2 9.3 -78.6 -48.6 24.4 -10.8 10.6 39 42 R M S < S+ 0 0 9 -4,-1.6 2,-0.2 1,-0.2 -2,-0.2 -0.131 129.9 39.3-128.1 47.4 23.5 -8.0 13.1 40 43 R L + 0 0 0 -4,-0.4 -1,-0.2 -5,-0.1 109,-0.0 -0.649 65.6 101.8 173.3 117.5 22.2 -5.2 11.0 41 44 R T > + 0 0 22 -2,-0.2 4,-0.6 -3,-0.1 5,-0.1 0.378 63.0 57.9-173.9 -35.9 20.0 -5.2 7.9 42 45 R P H > S+ 0 0 38 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.871 120.9 7.3 -80.9-101.2 16.2 -4.4 8.0 43 46 R D H >>S+ 0 0 48 1,-0.2 4,-2.1 2,-0.2 5,-0.9 0.764 130.2 68.2 -53.4 -18.9 15.2 -0.9 9.4 44 47 R E H >>S+ 0 0 0 3,-0.2 4,-1.5 2,-0.2 5,-1.0 0.998 96.8 43.5 -63.8 -65.7 18.9 -0.6 9.2 45 48 R R H <5S+ 0 0 62 -4,-0.6 4,-0.3 3,-0.2 -1,-0.2 0.830 125.8 39.5 -51.6 -30.6 19.4 -0.6 5.4 46 49 R E H X5S+ 0 0 73 -4,-1.7 4,-1.9 3,-0.1 -2,-0.2 0.959 126.0 25.8 -82.9 -72.8 16.4 1.7 5.3 47 50 R A H X5S+ 0 0 22 -4,-2.1 4,-1.7 1,-0.2 5,-0.2 0.893 119.7 56.2 -62.2 -43.0 16.6 4.2 8.2 48 51 R L H XX S+ 0 0 13 -4,-1.9 4,-3.8 1,-0.2 3,-1.3 0.861 107.6 44.4 -34.3 -78.7 18.4 7.9 5.3 51 54 R R H 3X S+ 0 0 15 -4,-1.7 4,-2.0 1,-0.3 5,-0.4 0.869 117.6 43.1 -41.8 -56.4 20.0 9.7 8.3 52 55 R V H 3X S+ 0 0 6 -4,-1.8 4,-1.2 92,-0.3 -1,-0.3 0.840 121.6 44.8 -67.0 -18.9 23.6 9.6 7.0 53 56 R R H + 0 0 77 -7,-0.1 3,-0.7 15,-0.0 2,-0.5 0.536 58.8 82.9-124.9 -24.7 14.2 20.7 2.3 66 69 R R T 3 + 0 0 242 1,-0.3 3,-0.0 2,-0.0 -1,-0.0 0.095 59.0 108.7 -72.4 29.0 11.7 21.5 -0.4 67 70 R E T 3 S- 0 0 101 -2,-0.5 -1,-0.3 1,-0.0 -2,-0.0 0.432 81.5-129.3 -85.6 1.3 12.2 18.0 -1.7 68 71 R L < - 0 0 149 -3,-0.7 7,-0.1 2,-0.1 -1,-0.0 0.455 47.6 -43.0 61.4 147.4 8.8 17.0 -0.5 69 72 R K - 0 0 117 6,-0.2 3,-0.1 1,-0.2 6,-0.1 -0.118 47.0-160.8 -42.6 128.3 8.2 14.0 1.7 70 73 R N - 0 0 105 1,-0.2 2,-1.7 2,-0.0 3,-0.2 0.342 18.5-167.3 -96.7 10.6 10.3 11.1 0.2 71 74 R E S S+ 0 0 138 1,-0.3 -1,-0.2 3,-0.3 5,-0.1 -0.135 77.6 65.6 40.5 -75.0 7.9 8.9 2.1 72 75 R L S S+ 0 0 154 -2,-1.7 -1,-0.3 1,-0.2 3,-0.1 0.724 117.1 31.1 -42.7 -22.7 10.0 5.8 1.7 73 76 R G S S- 0 0 37 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.844 125.5 -84.3-102.5 -61.2 12.6 7.7 3.8 74 77 R A - 0 0 22 -24,-0.1 -3,-0.3 3,-0.0 -1,-0.1 -0.279 31.8-162.6-171.0 -94.6 10.6 9.9 6.1 75 78 R G S S+ 0 0 9 -6,-0.1 -6,-0.2 -5,-0.1 -3,-0.0 0.458 74.6 61.2 103.5 1.0 9.2 13.4 5.2 76 79 R I S S- 0 0 118 -5,-0.1 4,-0.2 -7,-0.0 -2,-0.0 0.640 112.1 -14.7-122.1 -73.0 8.6 14.8 8.7 77 80 R A S > S+ 0 0 68 2,-0.1 3,-2.8 1,-0.1 4,-0.5 0.885 120.5 56.8-102.3 -71.3 11.4 15.2 11.3 78 81 R T G >> S+ 0 0 20 1,-0.3 4,-0.6 2,-0.2 3,-0.5 0.716 104.8 62.6 -37.1 -21.1 14.7 13.4 10.5 79 82 R I G 34 S+ 0 0 45 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.855 105.4 41.6 -79.8 -31.3 14.6 15.4 7.2 80 83 R T G <> S+ 0 0 55 -3,-2.8 4,-0.7 -4,-0.2 -1,-0.2 0.212 97.7 75.5-100.3 19.7 14.8 18.8 8.8 81 84 R R H <> S+ 0 0 28 -3,-0.5 4,-2.1 -4,-0.5 8,-0.2 0.867 74.7 76.1 -93.5 -39.7 17.4 18.1 11.5 82 85 R G H < S+ 0 0 0 -4,-0.6 -1,-0.2 1,-0.2 4,-0.1 0.727 99.8 49.9 -40.6 -24.7 20.4 18.0 9.2 83 86 R S H >4 S+ 0 0 39 1,-0.1 3,-1.6 2,-0.1 -1,-0.2 0.964 113.4 36.9 -81.5 -70.3 20.0 21.8 9.3 84 87 R N H >X S+ 0 0 102 -4,-0.7 3,-2.4 1,-0.3 4,-1.8 0.570 88.2 105.2 -60.3 -3.6 19.8 22.6 13.0 85 88 R S H 3X + 0 0 4 -4,-2.1 4,-1.4 1,-0.3 -1,-0.3 0.792 54.6 87.2 -48.5 -26.7 22.3 19.8 13.4 86 89 R L H <4 S+ 0 0 119 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.1 0.855 114.8 5.4 -41.2 -42.1 24.8 22.7 13.9 87 90 R K H <4 S+ 0 0 173 -3,-2.4 -2,-0.2 4,-0.0 -1,-0.2 0.767 124.3 66.9-109.0 -50.3 23.8 22.6 17.6 88 91 R A H < S+ 0 0 79 -4,-1.8 -3,-0.2 -7,-0.1 -2,-0.1 0.866 92.7 69.7 -39.3 -55.3 21.5 19.6 17.9 89 92 R A S < S- 0 0 7 -4,-1.4 51,-0.1 -5,-0.2 4,-0.0 -0.206 105.5 -80.2 -63.4 162.8 24.3 17.1 17.1 90 93 R P - 0 0 45 0, 0.0 4,-0.3 0, 0.0 3,-0.2 0.014 31.7-128.7 -56.8 170.0 27.1 16.6 19.7 91 94 R V S >> S+ 0 0 117 1,-0.2 3,-0.8 2,-0.1 4,-0.7 0.780 101.0 69.7 -94.0 -31.1 29.9 19.2 19.9 92 95 R E H 3> S+ 0 0 117 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.464 88.9 72.4 -66.5 3.6 32.8 16.7 19.8 93 96 R L H >> S+ 0 0 10 -3,-0.2 4,-2.3 2,-0.2 3,-1.1 0.901 87.6 54.8 -84.7 -44.9 31.8 16.2 16.1 94 97 R R H <> S+ 0 0 81 -3,-0.8 4,-0.6 -4,-0.3 -2,-0.2 0.778 98.9 67.8 -59.1 -24.3 33.0 19.6 14.8 95 98 R Q H 3< S+ 0 0 146 -4,-0.7 -1,-0.3 2,-0.1 -2,-0.2 0.910 120.3 13.7 -63.3 -40.1 36.4 18.6 16.2 96 99 R W H XX S+ 0 0 26 -3,-1.1 3,-3.0 -4,-0.5 4,-1.2 0.860 119.1 61.3-101.2 -60.0 36.7 15.8 13.7 97 100 R L H 3X>S+ 0 0 23 -4,-2.3 4,-2.5 1,-0.3 5,-0.7 0.681 86.0 79.2 -43.7 -19.7 34.2 16.2 10.9 98 101 R E H 3X5S+ 0 0 116 -4,-0.6 4,-1.4 -5,-0.5 -1,-0.3 0.975 108.7 32.3 -53.2 -37.1 35.9 19.6 10.2 99 102 R E H <>5S+ 0 0 134 -3,-3.0 4,-1.0 2,-0.2 -2,-0.3 0.858 120.5 46.8 -86.8 -37.7 38.1 17.1 8.5 100 103 R V H <5S+ 0 0 44 -4,-1.2 4,-0.3 2,-0.1 -3,-0.2 0.662 118.7 44.5 -82.6 -9.5 35.7 14.3 7.4 101 104 R L H <5S+ 0 0 44 -4,-2.5 3,-0.5 -5,-0.3 -2,-0.2 0.895 116.7 37.6 -94.4 -56.2 33.3 16.9 6.0 102 105 R L H < + 0 0 109 -2,-0.3 4,-0.5 3,-0.0 -1,-0.1 0.289 62.1 63.0-157.3 -0.8 25.5 0.6 -1.1 119 17 S Q H > S+ 0 0 150 2,-0.2 4,-2.0 3,-0.1 3,-0.3 0.846 108.5 30.1 -95.4 -83.3 26.1 4.4 -1.0 120 18 S E H > S+ 0 0 18 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.853 120.8 63.3 -45.2 -30.5 24.6 6.1 2.1 121 19 S W H > S+ 0 0 7 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.983 98.6 48.5 -55.9 -64.0 25.4 2.6 3.4 122 20 S L H X>S+ 0 0 63 -4,-0.5 4,-2.5 -3,-0.3 5,-0.7 0.845 106.3 60.8 -48.1 -36.7 29.1 3.0 2.9 123 21 S R H X5S+ 0 0 79 -4,-2.0 4,-3.1 1,-0.2 5,-0.5 0.994 103.5 47.3 -56.5 -67.4 28.9 6.5 4.6 124 22 S F H X5S+ 0 0 0 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.903 125.5 34.3 -37.5 -47.3 27.6 4.9 7.9 125 23 S V H X5S+ 0 0 2 -4,-2.1 4,-2.0 2,-0.2 3,-0.5 0.993 118.7 45.2 -74.3 -74.7 30.4 2.4 7.6 126 24 S D H X5S+ 0 0 64 -4,-2.5 4,-1.7 1,-0.3 5,-0.2 0.837 114.5 54.0 -37.1 -41.7 33.4 4.3 6.0 127 25 S L H XX S+ 0 0 1 -4,-1.5 4,-3.0 -5,-0.5 3,-1.3 0.973 108.7 55.2 -56.1 -61.5 32.8 4.8 11.4 129 27 S K H 3X S+ 0 0 57 -4,-2.0 4,-0.6 1,-0.3 -1,-0.2 0.893 111.6 44.7 -39.7 -54.0 36.0 2.9 10.4 130 28 S N H 3X S+ 0 0 86 -4,-1.7 4,-0.5 -5,-0.3 -1,-0.3 0.789 117.5 47.0 -66.0 -25.3 37.9 6.2 10.1 131 29 S A H XX S+ 0 0 0 -4,-1.4 4,-2.4 -3,-1.3 3,-1.6 0.926 93.8 69.3 -83.0 -49.0 36.4 7.4 13.4 132 30 S Y H 3< S+ 0 0 72 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.1 0.740 94.8 64.6 -42.1 -21.7 36.9 4.4 15.6 133 31 S Q H 3< S+ 0 0 164 -4,-0.6 -1,-0.3 -5,-0.3 -2,-0.2 0.948 108.3 35.4 -69.6 -47.2 40.6 5.4 15.2 134 32 S N H << S- 0 0 106 -3,-1.6 -2,-0.2 -4,-0.5 -1,-0.2 0.776 114.4-122.1 -74.7 -27.7 40.1 8.7 17.1 135 33 S D S < S+ 0 0 113 -4,-2.4 -3,-0.2 3,-0.0 -2,-0.1 0.923 81.0 111.1 86.5 50.7 37.5 7.0 19.3 136 34 S L > + 0 0 19 -5,-0.5 4,-1.6 -8,-0.2 5,-0.2 0.137 33.0 114.5-136.1 14.6 34.5 9.2 18.7 137 35 S H H > + 0 0 13 1,-0.2 4,-2.4 -6,-0.2 5,-0.1 0.701 69.4 66.4 -61.7 -19.2 32.4 6.6 16.9 138 36 S L H > S+ 0 0 64 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.983 101.7 42.7 -69.6 -59.0 30.0 6.7 19.7 139 37 S P H 4 S+ 0 0 30 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.865 118.4 49.0 -54.3 -34.8 28.7 10.2 19.2 140 38 S L H >X S+ 0 0 2 -4,-1.6 3,-2.3 1,-0.2 4,-1.9 0.890 102.8 60.2 -72.1 -40.4 28.7 9.5 15.5 141 39 S L H 3X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.3 -1,-0.2 0.956 97.1 59.2 -50.6 -50.8 26.7 6.2 16.0 142 40 S N H 3< S+ 0 0 59 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.609 111.6 47.0 -56.5 -6.1 23.9 8.1 17.5 143 41 S L H <4 S+ 0 0 15 -3,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.861 117.8 31.0-100.4 -67.9 23.9 9.9 14.2 144 42 S M H < S+ 0 0 1 -4,-1.9 2,-0.3 1,-0.2 -92,-0.3 0.591 136.6 25.3 -70.6 -3.9 24.0 7.3 11.4 145 43 S L S < S+ 0 0 0 -4,-2.3 -1,-0.2 -5,-0.4 -101,-0.0 -0.953 70.9 114.4-157.0 132.9 22.1 5.0 13.7 146 44 S T + 0 0 30 -2,-0.3 -4,-0.1 -3,-0.1 -2,-0.1 0.476 66.0 42.9-170.4 -30.4 19.7 5.6 16.6 147 45 S P S > S+ 0 0 43 0, 0.0 4,-1.6 0, 0.0 5,-0.2 0.635 124.1 5.8 -99.0-103.0 16.0 4.6 16.4 148 46 S D H > S+ 0 0 80 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.755 131.7 64.0 -54.4 -16.7 14.8 1.3 14.9 149 47 S E H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.995 96.2 49.0 -68.3 -67.5 18.6 0.8 14.8 150 48 S R H > S+ 0 0 57 2,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.799 123.6 37.1 -41.6 -33.8 19.2 0.9 18.6 151 49 S E H X S+ 0 0 102 -4,-1.6 4,-1.6 2,-0.2 3,-0.2 0.955 112.9 48.9 -84.8 -67.8 16.3 -1.6 18.8 152 50 S A H X S+ 0 0 11 -4,-2.2 4,-1.9 1,-0.2 5,-0.2 0.765 113.3 55.4 -45.9 -23.7 16.5 -3.9 15.9 153 51 S L H X S+ 0 0 0 -4,-2.6 4,-2.0 -5,-0.3 5,-0.3 0.976 100.4 51.6 -77.5 -56.7 20.2 -4.3 16.8 154 52 S G H X S+ 0 0 8 -4,-1.1 4,-1.3 -5,-0.3 -1,-0.2 0.769 113.4 55.7 -50.0 -21.6 19.8 -5.4 20.5 155 53 S T H >X S+ 0 0 20 -4,-1.6 4,-2.2 2,-0.2 3,-0.8 0.984 103.8 43.0 -73.6 -78.7 17.5 -7.9 18.8 156 54 S R H 3X S+ 0 0 8 -4,-1.9 4,-2.0 1,-0.3 5,-0.3 0.780 118.4 52.5 -41.6 -27.0 19.6 -9.7 16.1 157 55 S V H 3X>S+ 0 0 0 -4,-2.0 4,-1.8 -5,-0.2 5,-0.6 0.901 104.1 52.4 -80.0 -41.5 22.2 -9.8 18.8 158 56 S R H X5S+ 0 0 93 -4,-1.8 4,-1.4 -5,-0.3 3,-0.7 0.916 115.9 47.6 -48.5 -46.7 24.5 -14.4 20.7 162 60 S E H 3X + 0 0 65 2,-0.0 3,-1.2 3,-0.0 -1,-0.2 0.493 66.6 125.2-137.1 -31.5 12.0 -16.9 24.0 173 71 S L T 3 S- 0 0 119 1,-0.2 8,-0.1 2,-0.1 -3,-0.0 -0.118 99.0 -29.0 -39.8 106.5 10.4 -18.8 21.3 174 72 S K T 3 + 0 0 112 1,-0.2 -1,-0.2 6,-0.1 3,-0.1 0.783 61.3 174.9 48.8 57.2 8.1 -16.0 19.8 175 73 S N < - 0 0 101 -3,-1.2 2,-1.6 1,-0.2 -1,-0.2 0.567 40.6-148.7 -74.1 18.2 7.4 -13.7 22.8 176 74 S E S S+ 0 0 121 1,-0.2 5,-0.2 2,-0.1 -1,-0.2 -0.468 79.0 41.0 40.8 -51.1 5.7 -11.9 19.7 177 75 S L S S+ 0 0 147 -2,-1.6 -1,-0.2 1,-0.2 -2,-0.0 0.458 109.5 61.2 -91.3 -20.4 5.9 -8.3 20.4 178 76 S G S S- 0 0 41 -23,-0.0 -1,-0.2 2,-0.0 -2,-0.1 0.606 123.9 -0.7 -82.2 -16.4 9.5 -8.4 21.9 179 77 S A S S- 0 0 41 -3,-0.1 2,-0.2 -7,-0.0 -23,-0.1 0.427 93.1 -96.6-136.7 -69.2 11.3 -9.8 18.8 180 78 S G >> - 0 0 26 1,-0.1 4,-1.0 2,-0.1 3,-0.6 -0.456 20.4-125.1 149.1 127.7 9.5 -10.5 15.4 181 79 S I T 34 S+ 0 0 92 1,-0.2 -7,-0.1 -5,-0.2 -1,-0.1 0.938 113.0 61.8 -68.2 -22.6 8.5 -13.9 14.7 182 80 S A T >> S+ 0 0 52 1,-0.2 3,-1.1 2,-0.2 4,-0.9 0.734 93.0 61.1 -63.7 -37.3 10.6 -13.3 11.5 183 81 S T H X> S+ 0 0 11 -3,-0.6 4,-1.3 1,-0.2 3,-0.5 0.995 98.6 56.4 -53.7 -55.9 13.8 -12.8 13.3 184 82 S I H 3< S+ 0 0 41 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.320 98.5 65.5 -63.3 11.2 13.7 -16.3 14.8 185 83 S T H X> S+ 0 0 67 -3,-1.1 3,-2.6 -2,-0.5 4,-0.9 0.864 100.1 42.4 -96.6 -62.3 13.5 -17.9 11.3 186 84 S R H XX S+ 0 0 92 -4,-0.9 4,-1.6 -3,-0.5 3,-0.7 0.845 106.2 71.9 -52.3 -23.7 16.9 -17.0 9.6 187 85 S G H 3< S+ 0 0 7 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.1 0.642 95.7 48.2 -67.6 -11.1 18.1 -17.9 13.1 188 86 S S H <4 S+ 0 0 84 -3,-2.6 4,-0.3 1,-0.1 -1,-0.3 0.700 119.6 37.4-100.5 -23.2 17.4 -21.5 12.3 189 87 S N H 4 S+ 0 0 125 -5,-0.2 3,-1.0 -3,-0.1 -1,-0.2 0.973 113.3 20.5 -71.7 -78.9 23.5 -22.4 10.6 192 90 S K T 34 S+ 0 0 193 -4,-0.3 -2,-0.1 1,-0.2 -3,-0.1 0.983 123.2 52.5 -54.0 -66.6 23.8 -23.9 7.0 193 91 S A T 3< S+ 0 0 86 -4,-0.9 -1,-0.2 -7,-0.1 -3,-0.1 0.442 83.6 118.3 -53.5 0.3 23.5 -20.7 5.0 194 92 S A S < S- 0 0 25 -3,-1.0 -3,-0.1 -5,-0.3 2,-0.0 -0.199 76.9 -93.3 -68.1 160.0 26.3 -19.0 6.9 195 93 S P - 0 0 50 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 -0.378 31.0-141.8 -68.3 158.2 29.5 -18.0 5.1 196 94 S V S > S+ 0 0 122 1,-0.1 3,-2.9 2,-0.1 4,-0.4 0.951 92.2 55.1 -88.0 -65.1 32.3 -20.5 5.1 197 95 S E T >> S+ 0 0 125 1,-0.3 3,-1.1 2,-0.2 4,-0.8 0.642 92.8 79.2 -45.4 -12.4 35.6 -18.7 5.4 198 96 S L H >> S+ 0 0 16 1,-0.2 4,-3.0 2,-0.2 3,-1.0 0.887 78.4 68.3 -65.6 -34.9 34.0 -17.1 8.5 199 97 S R H <4 S+ 0 0 164 -3,-2.9 4,-0.4 1,-0.3 -1,-0.2 0.745 98.1 52.9 -54.1 -24.2 34.9 -20.3 10.4 200 98 S Q H <4 S+ 0 0 138 -3,-1.1 -1,-0.3 -4,-0.4 4,-0.2 0.802 118.9 32.8 -82.8 -28.9 38.5 -19.3 10.0 201 99 S W H XX S+ 0 0 41 -3,-1.0 3,-2.7 -4,-0.8 4,-1.2 0.889 107.0 63.9 -90.3 -56.2 37.9 -15.8 11.5 202 100 S L H 3X>S+ 0 0 36 -4,-3.0 4,-2.9 1,-0.3 5,-0.8 0.775 85.5 76.1 -40.2 -31.6 35.2 -16.3 14.1 203 101 S E H 3>>S+ 0 0 133 -5,-0.4 4,-1.3 -4,-0.4 5,-0.6 0.965 108.9 34.0 -46.7 -39.7 37.6 -18.5 16.0 204 102 S E H <4>S+ 0 0 122 -3,-2.7 5,-1.0 -4,-0.2 -2,-0.3 0.831 120.6 46.0 -86.0 -32.8 39.0 -15.2 16.9 205 103 S V H <5S+ 0 0 13 -4,-1.2 -2,-0.2 3,-0.2 -3,-0.2 0.602 120.8 38.5 -90.6 -2.4 35.8 -13.1 17.0 206 104 S L H <5S+ 0 0 67 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.2 0.818 120.2 36.4-109.1 -49.4 33.9 -15.6 19.1 207 105 S L T <