==== 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 TRANSCRIPTION 31-MAY-07 2Q5C . COMPND 2 MOLECULE: NTRC FAMILY TRANSCRIPTIONAL REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM ACETOBUTYLICUM ATCC 824; . AUTHOR U.A.RAMAGOPAL,M.DICKEY,R.TORO,M.IIZUKA,K.GROSHONG,L.RODGERS, . 374 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19191.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 284 75.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 17.1 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 . 29 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 148 39.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.1 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 0 0 0 4 2 2 4 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 4 0 2 2 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 4 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 0 A S 0 0 148 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 149.2 26.9 -12.1 7.6 2 1 A L + 0 0 178 2,-0.1 2,-0.2 0, 0.0 0, 0.0 0.580 360.0 105.7 -85.4 -13.2 25.0 -12.5 10.8 3 2 A S - 0 0 64 1,-0.1 2,-0.3 25,-0.1 25,-0.1 -0.463 67.8-135.3 -69.0 136.0 23.3 -9.1 10.2 4 3 A L - 0 0 50 23,-0.4 25,-3.2 -2,-0.2 2,-0.4 -0.750 16.6-161.8 -90.6 144.6 19.7 -9.2 9.1 5 4 A K E -a 29 0A 67 -2,-0.3 47,-2.8 23,-0.2 48,-1.1 -0.992 8.8-179.2-129.4 124.5 18.6 -6.9 6.2 6 5 A I E -ab 30 53A 0 23,-2.2 25,-1.9 -2,-0.4 2,-0.4 -0.994 12.7-151.3-128.8 129.6 15.0 -6.1 5.5 7 6 A A E -ab 31 54A 0 46,-2.2 48,-2.9 -2,-0.4 2,-0.5 -0.835 1.8-160.3 -98.0 133.4 13.7 -3.8 2.7 8 7 A L E -ab 32 55A 0 23,-2.9 25,-2.0 -2,-0.4 2,-0.5 -0.965 7.3-170.0-106.6 125.6 10.5 -1.8 3.0 9 8 A I E +a 33 0A 1 46,-2.5 48,-0.4 -2,-0.5 2,-0.3 -0.977 31.6 126.3-119.3 115.6 9.1 -0.8 -0.4 10 9 A S E -a 34 0A 12 23,-2.1 25,-0.7 -2,-0.5 26,-0.1 -0.967 58.9-137.2-159.3 162.3 6.3 1.7 -0.1 11 10 A Q S S+ 0 0 51 -2,-0.3 2,-0.8 23,-0.2 23,-0.1 0.313 74.6 108.4-107.2 5.4 5.2 5.2 -1.2 12 11 A N > - 0 0 19 1,-0.2 4,-2.5 2,-0.0 5,-0.2 -0.733 54.9-161.8 -90.4 108.9 4.0 6.1 2.3 13 12 A E H > S+ 0 0 105 -2,-0.8 4,-2.4 1,-0.2 5,-0.2 0.842 88.6 55.7 -59.9 -35.3 6.4 8.7 3.7 14 13 A N H > S+ 0 0 127 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.934 111.3 43.5 -66.2 -43.0 5.3 8.0 7.3 15 14 A L H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.909 112.5 53.3 -64.3 -43.6 6.1 4.3 7.1 16 15 A L H < S+ 0 0 7 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.877 112.7 43.4 -63.5 -37.2 9.3 5.0 5.3 17 16 A N H < S+ 0 0 101 -4,-2.4 4,-0.4 -5,-0.2 -1,-0.2 0.801 114.8 49.5 -78.6 -27.7 10.5 7.3 8.0 18 17 A L H >X S+ 0 0 33 -4,-1.8 4,-2.0 -5,-0.2 3,-1.1 0.853 95.5 73.6 -72.5 -35.9 9.4 5.1 10.8 19 18 A F H 3X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.3 -1,-0.2 0.875 93.4 49.5 -56.0 -46.8 11.0 1.9 9.5 20 19 A P H 3> S+ 0 0 52 0, 0.0 4,-1.1 0, 0.0 -1,-0.3 0.806 109.0 55.2 -63.4 -25.6 14.7 2.8 10.3 21 20 A K H <> S+ 0 0 138 -3,-1.1 4,-1.2 -4,-0.4 3,-0.3 0.909 108.8 46.7 -69.6 -40.6 13.6 3.7 13.9 22 21 A L H X S+ 0 0 4 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.847 104.4 62.5 -68.9 -31.0 12.0 0.3 14.3 23 22 A A H X>S+ 0 0 3 -4,-2.1 5,-1.7 -5,-0.2 4,-0.7 0.851 101.4 51.9 -62.9 -32.9 15.2 -1.3 12.8 24 23 A L H <5S+ 0 0 154 -4,-1.1 3,-0.4 -3,-0.3 -1,-0.2 0.909 110.7 48.0 -64.7 -40.9 17.2 0.1 15.7 25 24 A E H <5S+ 0 0 100 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.787 121.3 35.5 -70.8 -30.6 14.7 -1.5 18.2 26 25 A K H <5S- 0 0 97 -4,-1.8 -1,-0.2 2,-0.1 -2,-0.2 0.326 107.1-122.7-108.8 6.4 14.8 -4.8 16.5 27 26 A N T <5 + 0 0 147 -4,-0.7 -23,-0.4 -3,-0.4 2,-0.3 0.928 64.8 124.3 51.7 57.0 18.5 -4.8 15.4 28 27 A F < - 0 0 12 -5,-1.7 -23,-0.2 -8,-0.1 -1,-0.2 -0.952 65.6-107.0-133.1 161.2 18.2 -5.3 11.6 29 28 A I E -a 5 0A 74 -25,-3.2 -23,-2.2 -2,-0.3 2,-0.3 -0.785 38.1-141.7 -85.9 122.7 19.6 -3.1 8.8 30 29 A P E -a 6 0A 46 0, 0.0 2,-0.4 0, 0.0 -23,-0.2 -0.636 17.9-173.1 -87.4 144.6 16.8 -1.2 7.1 31 30 A I E -a 7 0A 28 -25,-1.9 -23,-2.9 -2,-0.3 2,-0.4 -0.997 9.0-169.3-125.8 130.7 16.6 -0.6 3.4 32 31 A T E +a 8 0A 59 -2,-0.4 2,-0.3 -25,-0.2 -23,-0.2 -0.980 7.1 177.3-122.5 139.9 13.8 1.8 2.2 33 32 A K E -a 9 0A 90 -25,-2.0 -23,-2.1 -2,-0.4 2,-0.8 -0.998 26.0-133.9-140.5 139.9 12.7 2.3 -1.4 34 33 A T E +a 10 0A 69 -2,-0.3 2,-0.3 -25,-0.2 -23,-0.2 -0.826 58.4 103.6 -99.3 107.0 9.9 4.5 -2.8 35 34 A A - 0 0 1 -2,-0.8 2,-0.3 -25,-0.7 -2,-0.1 -0.979 43.1-152.7-169.3 165.1 7.9 2.5 -5.3 36 35 A S >> - 0 0 15 -2,-0.3 4,-1.7 -26,-0.1 3,-0.7 -0.959 53.3 -14.2-143.1 164.5 4.7 0.6 -6.1 37 36 A L H 3> S- 0 0 5 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 -0.057 123.5 -0.4 52.4-133.2 3.4 -2.2 -8.3 38 37 A T H 3> S+ 0 0 71 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.926 136.1 50.9 -60.6 -43.1 5.5 -3.3 -11.3 39 38 A R H <> S+ 0 0 159 -3,-0.7 4,-2.0 1,-0.2 -1,-0.2 0.912 109.6 51.7 -61.0 -40.0 8.3 -0.7 -10.6 40 39 A A H X S+ 0 0 0 -4,-1.7 4,-2.8 1,-0.2 -1,-0.2 0.884 106.5 54.2 -60.4 -37.8 8.4 -2.0 -7.0 41 40 A S H X S+ 0 0 17 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.878 106.8 51.1 -68.2 -34.4 8.7 -5.6 -8.3 42 41 A K H X S+ 0 0 167 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.923 112.4 46.0 -65.9 -42.6 11.8 -4.6 -10.4 43 42 A I H X S+ 0 0 41 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.937 113.7 49.4 -65.7 -43.5 13.4 -3.0 -7.4 44 43 A A H X S+ 0 0 0 -4,-2.8 4,-1.1 1,-0.2 3,-0.3 0.919 109.5 51.6 -59.5 -43.7 12.6 -6.0 -5.2 45 44 A F H >< S+ 0 0 125 -4,-2.6 3,-0.6 1,-0.2 4,-0.4 0.914 109.6 50.3 -60.5 -40.9 14.0 -8.3 -7.8 46 45 A G H 3< S+ 0 0 52 -4,-2.1 -1,-0.2 1,-0.2 3,-0.2 0.772 115.8 42.9 -68.6 -27.0 17.2 -6.3 -7.9 47 46 A L H >X S+ 0 0 16 -4,-1.5 3,-2.3 -3,-0.3 4,-0.8 0.551 85.4 95.1 -91.4 -11.3 17.5 -6.4 -4.1 48 47 A Q T << S+ 0 0 17 -4,-1.1 3,-0.4 -3,-0.6 -1,-0.2 0.785 84.4 47.7 -67.7 -26.6 16.6 -10.0 -3.4 49 48 A D T 34 S+ 0 0 156 -4,-0.4 -1,-0.3 -3,-0.2 -2,-0.1 0.529 115.0 50.0 -85.7 -2.2 20.1 -11.4 -3.3 50 49 A E T <4 S+ 0 0 117 -3,-2.3 2,-0.3 -4,-0.0 -2,-0.2 0.420 107.9 49.2-112.7 -5.0 21.1 -8.6 -0.9 51 50 A V < - 0 0 12 -4,-0.8 -45,-0.2 -3,-0.4 3,-0.1 -0.920 66.7-135.5-134.4 162.8 18.4 -8.7 1.7 52 51 A D S S- 0 0 39 -47,-2.8 2,-0.3 -2,-0.3 -46,-0.2 0.701 84.9 -3.5 -89.7 -25.9 16.7 -11.4 3.9 53 52 A A E -b 6 0A 0 -48,-1.1 -46,-2.2 17,-0.1 2,-0.4 -0.982 58.3-136.7-161.7 160.2 13.1 -10.2 3.4 54 53 A I E -bc 7 72A 0 17,-2.2 19,-3.1 -2,-0.3 2,-0.4 -0.966 12.9-161.8-124.0 137.0 10.9 -7.6 1.8 55 54 A I E +bc 8 73A 0 -48,-2.9 -46,-2.5 -2,-0.4 2,-0.3 -0.966 24.8 145.6-115.6 138.0 7.9 -5.8 3.3 56 55 A S E - c 0 74A 1 17,-2.1 19,-3.1 -2,-0.4 2,-0.4 -0.885 35.9-111.2-156.5-178.0 5.3 -4.0 1.2 57 56 A R E >> - c 0 75A 35 -48,-0.4 3,-1.0 -2,-0.3 4,-0.9 -0.941 55.0 -35.9-130.0 149.3 1.6 -3.3 1.3 58 57 A G H >> S+ 0 0 23 17,-1.4 4,-1.0 -2,-0.4 3,-0.7 -0.048 120.9 1.9 54.9-135.8 -1.5 -4.2 -0.7 59 58 A A H >> S+ 0 0 13 1,-0.3 4,-2.0 2,-0.2 3,-0.6 0.861 129.0 60.6 -58.3 -39.1 -1.3 -4.7 -4.4 60 59 A T H <> S+ 0 0 16 -3,-1.0 4,-2.5 1,-0.2 -1,-0.3 0.902 99.4 56.7 -55.7 -39.1 2.5 -4.0 -4.4 61 60 A S H X S+ 0 0 0 -4,-2.5 3,-1.6 -5,-0.2 4,-1.4 0.936 109.3 53.3 -70.5 -45.6 6.6 -8.6 -5.3 65 64 A K H 3< S+ 0 0 129 -4,-2.8 3,-0.3 1,-0.3 -2,-0.2 0.870 107.5 52.3 -60.8 -36.0 5.6 -12.0 -4.1 66 65 A K T 3< S+ 0 0 153 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.558 116.5 39.0 -76.9 -8.5 5.1 -13.3 -7.6 67 66 A S T <4 S+ 0 0 44 -3,-1.6 2,-0.3 -4,-0.4 -1,-0.2 0.521 104.8 63.4-122.8 -7.0 8.6 -12.2 -8.7 68 67 A V < - 0 0 18 -4,-1.4 4,-0.1 -3,-0.3 -23,-0.1 -0.850 57.2-151.4-114.7 158.0 11.0 -12.8 -5.9 69 68 A S S S+ 0 0 91 -2,-0.3 3,-0.1 -24,-0.1 -1,-0.1 0.467 73.9 82.2-104.0 -3.1 12.1 -16.1 -4.2 70 69 A I S S- 0 0 15 1,-0.1 -17,-0.1 -17,-0.0 -2,-0.1 -0.513 100.9 -64.2 -94.6 168.2 12.9 -14.6 -0.8 71 70 A P - 0 0 17 0, 0.0 -17,-2.2 0, 0.0 2,-0.5 -0.296 49.8-168.7 -55.2 128.2 10.3 -13.9 2.0 72 71 A S E -c 54 0A 11 -19,-0.2 2,-0.4 -4,-0.1 -17,-0.2 -0.993 4.5-164.1-121.8 116.8 7.8 -11.2 0.9 73 72 A I E -c 55 0A 0 -19,-3.1 -17,-2.1 -2,-0.5 2,-0.5 -0.874 7.1-145.9-109.5 135.6 5.6 -9.9 3.8 74 73 A S E -c 56 0A 20 -2,-0.4 2,-0.5 -19,-0.2 -17,-0.2 -0.891 6.4-143.3-103.3 125.2 2.4 -8.0 3.1 75 74 A I E -c 57 0A 3 -19,-3.1 -17,-1.4 -2,-0.5 2,-0.3 -0.778 32.7-129.6 -75.9 122.4 1.2 -5.2 5.4 76 75 A K - 0 0 144 -2,-0.5 2,-0.4 -19,-0.1 99,-0.1 -0.649 7.4-126.2 -79.7 135.7 -2.6 -5.7 5.4 77 76 A V - 0 0 38 -2,-0.3 2,-0.2 90,-0.1 90,-0.1 -0.707 39.1-145.2 -72.2 125.5 -4.8 -2.7 4.6 78 77 A T > - 0 0 36 -2,-0.4 4,-1.9 1,-0.1 5,-0.1 -0.506 20.8-116.6 -99.3 167.2 -7.2 -2.7 7.6 79 78 A R H > S+ 0 0 75 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.904 118.3 48.8 -66.3 -39.5 -10.8 -1.8 8.1 80 79 A F H > S+ 0 0 4 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.879 106.9 55.7 -71.6 -35.3 -9.9 1.0 10.5 81 80 A D H > S+ 0 0 4 2,-0.2 4,-1.7 1,-0.2 85,-0.4 0.921 110.7 47.1 -56.2 -44.4 -7.3 2.3 8.0 82 81 A T H X S+ 0 0 2 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.932 110.7 50.1 -65.6 -45.1 -10.2 2.5 5.4 83 82 A M H X S+ 0 0 9 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.930 107.3 54.5 -61.1 -44.5 -12.6 4.2 7.8 84 83 A R H X S+ 0 0 65 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.910 110.6 47.2 -54.1 -42.4 -9.9 6.8 8.7 85 84 A A H X S+ 0 0 3 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.916 112.4 47.4 -68.9 -42.6 -9.6 7.6 5.0 86 85 A V H X S+ 0 0 0 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.921 110.7 53.1 -64.1 -44.6 -13.3 7.8 4.3 87 86 A Y H >< S+ 0 0 77 -4,-3.0 3,-0.5 -5,-0.2 4,-0.2 0.928 112.3 44.4 -54.3 -45.1 -13.8 10.0 7.3 88 87 A N H >< S+ 0 0 69 -4,-2.1 3,-1.6 -5,-0.2 -2,-0.2 0.891 108.0 58.6 -67.7 -37.6 -11.1 12.4 6.0 89 88 A A H >X S+ 0 0 0 -4,-2.5 3,-2.3 1,-0.3 4,-0.5 0.712 85.7 79.9 -66.5 -20.1 -12.5 12.3 2.5 90 89 A K G X< S+ 0 0 88 -4,-1.3 3,-0.5 -3,-0.5 -1,-0.3 0.710 75.1 74.6 -63.7 -18.6 -15.8 13.6 3.7 91 90 A R G <4 S+ 0 0 164 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.775 97.8 47.8 -64.1 -22.6 -14.4 17.1 3.8 92 91 A F G <4 S- 0 0 62 -3,-2.3 2,-0.3 1,-0.4 -1,-0.2 0.679 130.1 -61.5 -87.1 -23.3 -14.6 17.1 -0.0 93 92 A G << - 0 0 30 -4,-0.5 -1,-0.4 -3,-0.5 3,-0.0 -0.905 45.6 -94.5 158.4 177.5 -18.2 15.8 -0.2 94 93 A N S S+ 0 0 111 -2,-0.3 24,-3.1 -3,-0.1 2,-0.6 0.567 95.0 79.4-102.2 -10.0 -20.4 12.8 0.7 95 94 A E E +d 118 0B 61 22,-0.2 48,-0.5 -3,-0.1 49,-0.4 -0.887 62.3 167.8-105.2 118.9 -20.3 10.8 -2.5 96 95 A L E -d 119 0B 1 22,-2.9 24,-2.4 -2,-0.6 2,-0.5 -0.899 36.1-133.3-130.7 154.6 -17.1 8.8 -2.9 97 96 A A E -de 120 145B 0 47,-2.7 49,-2.9 -2,-0.3 2,-0.6 -0.946 19.7-159.9-102.1 128.1 -15.5 6.0 -5.0 98 97 A L E -de 121 146B 10 22,-2.3 24,-2.4 -2,-0.5 2,-0.6 -0.954 9.5-164.3-107.4 119.4 -13.7 3.4 -2.9 99 98 A I E +d 122 0B 4 47,-2.5 49,-0.4 -2,-0.6 2,-0.3 -0.907 10.5 178.8-111.6 120.9 -11.2 1.5 -5.0 100 99 A A E -d 123 0B 9 22,-2.4 24,-2.0 -2,-0.6 2,-0.6 -0.900 32.4-111.4-122.6 152.8 -9.8 -1.7 -3.7 101 100 A Y E S-d 124 0B 46 -2,-0.3 2,-2.9 22,-0.2 24,-0.2 -0.744 84.0 -40.8 -82.0 118.5 -7.4 -4.4 -5.0 102 101 A K S S+ 0 0 73 22,-3.2 2,-0.3 -2,-0.6 -1,-0.1 -0.245 127.6 29.9 65.3 -52.3 -9.2 -7.7 -5.8 103 102 A H S S- 0 0 145 -2,-2.9 -2,-0.2 21,-0.1 21,-0.1 -0.972 85.4 -98.3-141.1 148.7 -11.5 -7.7 -2.8 104 103 A S - 0 0 58 -2,-0.3 3,-0.1 1,-0.1 19,-0.0 -0.347 21.3-164.0 -59.4 143.4 -13.3 -5.4 -0.4 105 104 A I S S+ 0 0 58 1,-0.3 2,-0.4 -27,-0.1 -26,-0.2 0.797 79.8 21.3 -92.4 -46.9 -11.6 -4.7 3.0 106 105 A V S S- 0 0 3 -28,-0.1 2,-0.4 -27,-0.1 -1,-0.3 -0.914 96.6 -97.7-118.7 148.0 -14.6 -3.2 4.7 107 106 A D > - 0 0 88 -2,-0.4 4,-1.8 1,-0.2 3,-0.2 -0.581 30.3-143.7 -66.0 122.7 -18.2 -3.8 3.7 108 107 A K H > S+ 0 0 40 -2,-0.4 4,-2.2 1,-0.2 5,-0.2 0.892 98.7 52.3 -55.2 -45.8 -19.2 -0.7 1.7 109 108 A H H > S+ 0 0 121 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.849 105.9 55.1 -63.4 -35.4 -22.7 -0.6 3.1 110 109 A E H > S+ 0 0 48 -3,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.912 108.5 46.6 -64.2 -42.7 -21.4 -0.7 6.6 111 110 A I H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 6,-0.3 0.877 110.1 54.0 -71.3 -32.8 -19.2 2.4 6.1 112 111 A E H X>S+ 0 0 40 -4,-2.2 4,-1.4 1,-0.2 5,-0.8 0.943 113.1 43.9 -59.8 -46.8 -22.1 4.2 4.4 113 112 A A H <5S+ 0 0 60 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.893 118.2 43.2 -62.9 -43.1 -24.2 3.5 7.5 114 113 A M H <5S+ 0 0 16 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.744 126.1 28.7 -80.4 -27.5 -21.5 4.4 10.0 115 114 A L H <5S- 0 0 12 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.415 101.2-119.2-117.1 -1.5 -20.1 7.6 8.4 116 115 A G T <5 + 0 0 57 -4,-1.4 2,-0.3 -5,-0.3 -3,-0.2 0.911 68.7 126.5 66.2 44.0 -23.1 8.9 6.5 117 116 A V < - 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0 0 20 -5,-2.9 2,-0.4 -6,-0.2 -1,-0.3 -0.540 67.0-101.0-100.4 168.2 -10.5 14.4 -9.0 161 160 A Y E -f 144 0B 125 -18,-3.1 -16,-2.7 -2,-0.2 2,-0.4 -0.761 39.0-160.3 -84.5 142.9 -9.9 14.6 -5.2 162 161 A G E -f 145 0B 17 -2,-0.4 2,-0.5 -18,-0.2 -16,-0.2 -0.982 14.4-173.7-128.7 131.9 -7.8 11.7 -3.8 163 162 A E E -f 146 0B 24 -18,-2.7 -16,-1.4 -2,-0.4 2,-0.3 -0.967 21.8-140.8-127.6 115.5 -7.6 10.5 -0.3 164 163 A T E -f 147 0B 27 -2,-0.5 2,-0.6 -18,-0.2 -16,-0.2 -0.536 10.2-128.5 -80.9 137.5 -5.0 7.8 0.3 165 164 A I - 0 0 10 -18,-2.5 -16,-0.3 -2,-0.3 -83,-0.1 -0.773 37.1-160.7 -82.3 121.7 -5.6 4.9 2.7 166 165 A N - 0 0 74 -2,-0.6 2,-0.3 -85,-0.4 -81,-0.1 -0.314 12.2-134.7 -99.5 178.4 -2.6 4.9 5.0 167 166 A S - 0 0 11 -2,-0.1 2,-0.2 -90,-0.1 -152,-0.1 -0.849 21.6-146.1-126.7 164.6 -1.0 2.3 7.3 168 167 A G > - 0 0 17 -2,-0.3 4,-1.8 -154,-0.0 5,-0.1 -0.608 30.2 -85.8-128.4-174.9 0.2 2.9 10.8 169 168 A E H > S+ 0 0 96 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.886 118.9 52.5 -60.8 -45.8 2.8 1.9 13.3 170 169 A E H > S+ 0 0 90 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.927 109.2 50.5 -63.3 -41.2 1.1 -1.2 14.7 171 170 A S H > S+ 0 0 11 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.901 112.3 47.4 -60.6 -41.0 0.6 -2.7 11.2 172 171 A L H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.926 110.2 51.8 -71.3 -39.9 4.3 -2.1 10.4 173 172 A R H X S+ 0 0 65 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.910 109.9 50.2 -59.0 -42.2 5.5 -3.6 13.7 174 173 A R H X S+ 0 0 117 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.889 109.5 50.4 -63.5 -40.1 3.4 -6.7 13.0 175 174 A A H X S+ 0 0 3 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.888 109.6 50.9 -66.3 -37.5 4.9 -7.0 9.5 176 175 A I H X S+ 0 0 4 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.937 109.4 50.7 -64.1 -45.4 8.4 -6.8 11.0 177 176 A E H X S+ 0 0 127 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.921 111.4 48.5 -56.1 -46.0 7.6 -9.5 13.5 178 177 A E H X S+ 0 0 87 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.928 112.1 48.9 -61.5 -43.2 6.3 -11.7 10.7 179 178 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.924 109.8 50.6 -63.3 -46.4 9.4 -11.1 8.6 180 179 A L H X S+ 0 0 41 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.895 111.7 48.9 -61.6 -37.7 11.8 -11.8 11.4 181 180 A N H X S+ 0 0 88 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.911 111.4 48.8 -66.5 -41.5 9.9 -15.1 12.1 182 181 A L H X S+ 0 0 69 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.878 109.9 51.7 -65.9 -39.9 10.1 -16.1 8.4 183 182 A I H X S+ 0 0 4 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.937 109.7 49.7 -62.5 -46.0 13.8 -15.3 8.2 184 183 A E H < S+ 0 0 149 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.889 112.1 48.0 -59.3 -42.1 14.5 -17.5 11.2 185 184 A V H < S+ 0 0 119 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.932 111.2 49.9 -65.6 -46.7 12.4 -20.4 9.7 186 185 A R H < 0 0 142 -4,-2.7 -2,-0.2 -5,-0.1 -1,-0.2 0.854 360.0 360.0 -59.3 -36.5 14.2 -20.1 6.3 187 186 A N < 0 0 134 -4,-2.2 -4,-0.0 -5,-0.2 0, 0.0 -0.543 360.0 360.0 -79.3 360.0 17.6 -20.1 8.0 188 !* 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 0.0 189 0 D S 0 0 146 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 150.2 -5.0 -40.0 16.8 190 1 D L + 0 0 177 2,-0.1 2,-0.2 0, 0.0 0, 0.0 0.520 360.0 105.0 -89.0 -10.0 -4.4 -38.0 13.6 191 2 D S - 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0 0 11 -4,-0.8 -45,-0.2 -3,-0.3 3,-0.1 -0.919 66.5-135.9-135.0 161.7 -7.2 -31.0 22.6 240 51 D D S S- 0 0 41 -47,-2.6 2,-0.3 -2,-0.3 -46,-0.2 0.702 85.0 -3.6 -88.9 -26.7 -4.4 -29.7 20.4 241 52 D A E -h 194 0C 0 -48,-1.0 -46,-2.2 17,-0.1 2,-0.4 -0.981 58.5-136.4-160.5 161.9 -5.0 -26.0 20.9 242 53 D I E -hi 195 260C 0 17,-2.2 19,-3.0 -2,-0.3 2,-0.4 -0.969 13.0-161.9-125.1 135.9 -7.3 -23.4 22.6 243 54 D I E +hi 196 261C 0 -48,-3.1 -46,-2.5 -2,-0.4 2,-0.3 -0.961 25.1 144.2-115.1 138.9 -8.7 -20.2 21.0 244 55 D S E - i 0 262C 0 17,-2.0 19,-3.0 -2,-0.4 2,-0.4 -0.897 36.4-110.0-158.4-179.5 -10.1 -17.4 23.1 245 56 D R E >> - i 0 263C 36 -48,-0.4 3,-0.9 -2,-0.3 4,-0.8 -0.942 54.6 -36.8-128.5 150.4 -10.2 -13.6 23.1 246 57 D G H >> S+ 0 0 24 17,-1.5 4,-0.9 -2,-0.4 3,-0.7 -0.066 120.4 2.5 53.5-133.3 -8.9 -10.7 25.0 247 58 D A H >> S+ 0 0 13 1,-0.3 4,-1.9 2,-0.2 3,-0.9 0.874 129.6 59.5 -59.6 -39.0 -8.5 -10.9 28.8 248 59 D T H <> S+ 0 0 16 -3,-0.9 4,-2.5 1,-0.2 -1,-0.3 0.891 99.4 57.5 -56.1 -39.2 -9.7 -14.5 28.8 249 60 D S H X S+ 0 0 0 -4,-2.5 3,-1.7 -5,-0.2 4,-1.4 0.947 109.3 52.9 -71.5 -46.5 -5.7 -19.3 29.6 253 64 D K H 3< S+ 0 0 129 -4,-2.1 3,-0.2 1,-0.3 -1,-0.2 0.861 107.8 52.2 -59.6 -36.3 -2.2 -18.8 28.4 254 65 D K T 3< S+ 0 0 150 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.565 116.5 39.4 -76.6 -7.8 -0.8 -18.5 32.0 255 66 D S T <4 S+ 0 0 43 -3,-1.7 2,-0.3 -4,-0.4 -1,-0.2 0.531 104.9 63.7-122.0 -8.4 -2.5 -21.7 33.1 256 67 D V < - 0 0 18 -4,-1.4 4,-0.1 -3,-0.2 -23,-0.1 -0.837 57.1-151.7-115.0 156.7 -2.1 -24.2 30.2 257 68 D S S S+ 0 0 90 -2,-0.3 3,-0.1 -24,-0.1 -1,-0.1 0.383 74.3 81.4-106.1 3.6 0.9 -25.8 28.6 258 69 D I S S- 0 0 15 1,-0.1 -17,-0.1 0, 0.0 -2,-0.1 -0.587 100.8 -64.4-101.8 166.9 -0.6 -26.3 25.2 259 70 D P - 0 0 19 0, 0.0 -17,-2.2 0, 0.0 2,-0.5 -0.286 49.4-168.6 -56.7 130.7 -1.0 -23.7 22.4 260 71 D S E -i 242 0C 8 -19,-0.2 2,-0.4 -4,-0.1 -17,-0.2 -0.992 4.4-163.5-124.2 115.6 -3.3 -20.8 23.4 261 72 D I E -i 243 0C 0 -19,-3.0 -17,-2.0 -2,-0.5 2,-0.5 -0.853 6.8-146.2-106.8 135.4 -4.3 -18.5 20.6 262 73 D S E -i 244 0C 19 -2,-0.4 2,-0.6 -19,-0.2 -17,-0.2 -0.901 6.0-145.0-103.9 126.6 -5.7 -15.1 21.2 263 74 D I E -i 245 0C 3 -19,-3.0 -17,-1.5 -2,-0.5 2,-0.3 -0.779 32.7-132.1 -77.9 122.2 -8.3 -13.5 18.9 264 75 D K - 0 0 146 -2,-0.6 2,-0.4 95,-0.2 99,-0.1 -0.660 7.9-122.5 -82.9 139.1 -7.3 -9.8 19.1 265 76 D V - 0 0 40 -2,-0.3 2,-0.2 90,-0.1 90,-0.1 -0.679 39.8-144.9 -70.4 125.2 -10.0 -7.2 19.7 266 77 D T > - 0 0 35 -2,-0.4 4,-1.9 1,-0.1 5,-0.1 -0.512 20.0-117.1 -98.0 166.0 -9.6 -4.8 16.7 267 78 D R H > S+ 0 0 72 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.897 118.1 49.2 -64.8 -39.7 -10.0 -1.1 16.2 268 79 D F H > S+ 0 0 3 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.881 106.8 55.5 -69.8 -37.0 -12.9 -1.6 13.9 269 80 D D H > S+ 0 0 3 2,-0.2 4,-1.7 1,-0.2 85,-0.4 0.926 110.7 47.2 -56.4 -44.5 -14.6 -4.0 16.4 270 81 D T H X S+ 0 0 1 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.934 110.8 50.1 -64.8 -45.0 -14.4 -1.2 18.9 271 82 D M H X S+ 0 0 10 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.911 107.6 54.4 -62.1 -41.7 -15.7 1.5 16.5 272 83 D R H X S+ 0 0 68 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.910 110.4 46.4 -56.1 -44.8 -18.7 -0.8 15.7 273 84 D A H X S+ 0 0 4 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.909 112.9 47.9 -67.0 -42.4 -19.5 -1.0 19.4 274 85 D V H X S+ 0 0 1 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.927 110.4 53.6 -63.8 -43.6 -19.2 2.7 20.0 275 86 D Y H >< S+ 0 0 81 -4,-3.0 3,-0.5 -5,-0.2 4,-0.2 0.929 112.2 43.8 -55.0 -44.6 -21.3 3.4 17.0 276 87 D N H >< S+ 0 0 70 -4,-2.1 3,-1.6 1,-0.2 -1,-0.2 0.890 107.7 59.2 -67.3 -37.9 -24.1 1.1 18.3 277 88 D A H >X S+ 0 0 0 -4,-2.4 3,-2.0 1,-0.3 4,-0.5 0.695 85.1 80.2 -68.8 -16.8 -23.8 2.5 21.9 278 89 D K T << S+ 0 0 82 -4,-1.2 3,-0.5 -3,-0.5 -1,-0.3 0.701 75.4 74.4 -64.7 -18.8 -24.6 6.0 20.6 279 90 D R T <4 S+ 0 0 162 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.769 97.7 47.5 -64.9 -21.8 -28.3 5.0 20.6 280 91 D F T <4 S- 0 0 62 -3,-2.0 2,-0.3 1,-0.4 -1,-0.2 0.677 130.1 -61.7 -87.7 -22.5 -28.2 5.3 24.3 281 92 D G < - 0 0 29 -4,-0.5 -1,-0.4 -3,-0.5 3,-0.0 -0.912 45.7 -93.9 157.6 179.4 -26.5 8.7 24.6 282 93 D N S S+ 0 0 109 -2,-0.3 24,-3.3 -3,-0.1 2,-0.6 0.370 95.0 78.2-111.5 2.0 -23.2 10.4 23.7 283 94 D E E +j 306 0D 60 22,-0.2 48,-0.5 -5,-0.1 49,-0.4 -0.967 63.0 168.8-114.0 120.5 -21.2 10.0 26.9 284 95 D L E -j 307 0D 1 22,-2.8 24,-2.5 -2,-0.6 2,-0.5 -0.888 35.7-132.2-131.4 154.2 -19.7 6.6 27.3 285 96 D A E -jk 308 333D 0 47,-2.7 49,-3.0 -2,-0.3 2,-0.6 -0.951 19.7-160.2-101.4 126.7 -17.2 4.6 29.3 286 97 D L E -jk 309 334D 12 22,-2.3 24,-2.5 -2,-0.5 2,-0.5 -0.956 9.5-165.3-107.0 120.4 -14.8 2.5 27.2 287 98 D I E +j 310 0D 3 47,-2.4 49,-0.4 -2,-0.6 2,-0.3 -0.927 9.9 178.3-114.2 121.9 -13.2 -0.2 29.3 288 99 D A E -j 311 0D 7 22,-2.3 24,-2.1 -2,-0.5 2,-0.6 -0.899 32.5-111.5-124.3 151.2 -10.2 -2.1 28.0 289 100 D Y E S-j 312 0D 43 -2,-0.3 2,-2.9 22,-0.2 24,-0.2 -0.747 85.6 -37.4 -82.9 118.2 -8.0 -4.8 29.4 290 101 D K S S+ 0 0 92 22,-3.2 2,-0.3 -2,-0.6 -1,-0.1 -0.233 128.2 22.0 65.8 -52.0 -4.4 -3.5 30.2 291 102 D H S S- 0 0 133 -2,-2.9 -2,-0.2 21,-0.1 21,-0.1 -0.989 85.9 -89.9-145.9 157.5 -4.2 -1.1 27.2 292 103 D S - 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