==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 03-OCT-00 1FZP . COMPND 2 MOLECULE: 5'-D(P*AP*TP*AP*TP*AP*TP*A)-3'; . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.A.SCHUMACHER,B.HURLBURT,R.G.BRENNAN . 205 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15432.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 149 72.7 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 . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 117 57.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 1 0 0 4 1 0 0 0 0 1 0 1 0 0 1 2 1 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 2 D A 0 0 150 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 131.8 49.8 39.0 -9.3 2 3 D I - 0 0 97 1,-0.1 2,-0.1 3,-0.0 160,-0.0 0.433 360.0-161.6 -45.7-178.1 46.9 36.6 -9.5 3 4 D T S S- 0 0 87 3,-0.0 2,-1.3 93,-0.0 3,-0.2 0.170 77.1 -5.3-130.2-114.9 43.4 36.7 -10.9 4 5 D K S S+ 0 0 51 1,-0.2 88,-0.0 88,-0.1 -2,-0.0 -0.672 80.8 140.9 -93.2 74.0 40.6 34.3 -9.9 5 6 D I + 0 0 77 -2,-1.3 -1,-0.2 3,-0.0 2,-0.1 0.492 24.9 116.8-101.3 -1.2 42.8 32.2 -7.7 6 7 D N S S- 0 0 102 -3,-0.2 6,-0.1 1,-0.1 -2,-0.0 -0.439 83.3 -80.9 -64.4 139.2 40.3 31.5 -4.8 7 8 D D S S- 0 0 11 -2,-0.1 -1,-0.1 5,-0.1 4,-0.1 0.154 80.9 -35.4 -44.7 163.8 39.6 27.7 -4.7 8 9 D C > - 0 0 3 161,-0.1 4,-2.1 3,-0.1 5,-0.2 0.352 60.2-142.6 -20.1 136.3 37.2 25.9 -7.2 9 10 D F H > S+ 0 0 101 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.981 90.4 49.2 -86.2 -59.6 34.3 28.1 -7.9 10 11 D E H 4 S+ 0 0 101 1,-0.2 4,-0.2 2,-0.1 -1,-0.2 0.699 127.6 36.0 -54.5 -7.4 31.0 25.9 -8.1 11 12 D L H > S+ 0 0 10 2,-0.1 4,-2.0 3,-0.1 3,-0.4 0.832 116.0 44.3-105.6 -63.2 32.3 24.5 -4.9 12 13 D L H < S+ 0 0 14 -4,-2.1 -3,-0.2 1,-0.2 5,-0.2 0.734 105.5 69.4 -57.0 -26.4 34.0 27.2 -2.8 13 14 D S T >X S+ 0 0 56 -4,-2.2 4,-2.0 -5,-0.2 3,-1.0 0.974 108.6 30.9 -58.4 -58.2 31.1 29.4 -3.6 14 15 D M H 3> S+ 0 0 63 -3,-0.4 4,-2.6 -5,-0.3 5,-0.3 0.798 111.7 65.3 -71.8 -29.7 28.5 27.5 -1.5 15 16 D V H 3< S+ 0 0 7 -4,-2.0 -1,-0.3 2,-0.2 -2,-0.2 0.376 111.2 40.6 -73.9 8.3 31.2 26.5 1.0 16 17 D T H <> S+ 0 0 29 -3,-1.0 4,-2.0 -5,-0.2 -2,-0.2 0.683 116.1 42.5-112.3 -64.5 31.3 30.2 1.7 17 18 D Y H X S+ 0 0 58 -4,-2.0 4,-1.5 1,-0.2 5,-0.3 0.913 112.6 57.8 -51.4 -46.3 27.8 31.4 1.6 18 19 D A H X S+ 0 0 9 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.924 103.2 53.2 -52.0 -48.7 26.9 28.3 3.6 19 20 D D H > S+ 0 0 43 -5,-0.3 4,-1.3 2,-0.2 3,-0.3 0.933 112.0 46.6 -49.4 -54.8 29.4 29.4 6.3 20 21 D K H >X S+ 0 0 65 -4,-2.0 3,-3.3 1,-0.2 4,-1.4 0.962 107.0 50.7 -48.9 -84.4 27.7 32.7 6.6 21 22 D L H 3X S+ 0 0 13 -4,-1.5 4,-1.2 1,-0.3 -1,-0.2 0.640 107.6 59.1 -31.1 -30.4 24.0 31.8 6.7 22 23 D K H 3X S+ 0 0 21 -4,-1.4 4,-1.2 -3,-0.3 -1,-0.3 0.906 107.0 43.7 -72.9 -41.6 24.9 29.4 9.5 23 24 D S H > S+ 0 0 95 -4,-0.0 3,-4.9 0, 0.0 4,-0.7 0.300 71.1 79.1-153.4 -43.8 22.9 27.4 17.5 32 33 D S H 3> S+ 0 0 23 1,-0.3 4,-2.6 2,-0.2 7,-0.2 0.561 89.5 65.8 -53.9 -7.1 21.9 23.7 17.2 33 34 D F H 3> S+ 0 0 6 2,-0.3 4,-0.8 1,-0.2 -1,-0.3 0.693 92.6 58.8 -84.8 -23.0 21.4 24.7 13.6 34 35 D E H <> S+ 0 0 55 -3,-4.9 4,-0.5 1,-0.2 -2,-0.2 0.685 120.1 29.3 -76.5 -19.4 25.2 25.2 13.5 35 36 D E H X S+ 0 0 42 -4,-0.7 4,-4.1 2,-0.2 -2,-0.3 0.686 102.3 77.0-108.4 -31.8 25.3 21.6 14.5 36 37 D F H < S+ 0 0 10 -4,-2.6 4,-0.3 -5,-0.2 -3,-0.2 0.793 106.3 40.3 -50.3 -28.3 22.1 20.4 12.9 37 38 D A H >< S+ 0 0 0 -4,-0.8 3,-1.8 2,-0.2 4,-0.5 0.931 117.8 42.5 -85.6 -55.9 24.2 20.5 9.7 38 39 D V H >X S+ 0 0 45 -4,-0.5 3,-1.3 1,-0.3 4,-0.8 0.783 103.9 72.3 -61.5 -23.8 27.5 19.1 10.9 39 40 D L G >< S+ 0 0 31 -4,-4.1 3,-0.5 1,-0.3 -1,-0.3 0.831 81.7 69.5 -59.9 -31.4 25.2 16.7 12.8 40 41 D T G <4 S+ 0 0 76 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.866 108.8 36.1 -54.9 -34.3 24.6 15.1 9.4 41 42 D Y G <4 S+ 0 0 188 -3,-1.3 2,-0.3 -4,-0.5 -1,-0.3 0.543 126.6 37.1 -95.4 -8.2 28.3 14.0 9.5 42 43 D I << - 0 0 86 -4,-0.8 -7,-0.0 -3,-0.5 -1,-0.0 -0.906 49.9-156.5-141.9 168.5 28.3 13.3 13.3 43 44 D S S > S+ 0 0 75 -2,-0.3 3,-3.7 2,-0.1 4,-0.4 0.661 85.9 76.8-111.0 -32.8 26.3 12.0 16.3 44 45 D E G >> S+ 0 0 143 1,-0.3 3,-0.9 2,-0.2 4,-0.7 0.781 87.9 65.0 -51.7 -27.0 28.0 13.8 19.2 45 46 D N G 34 S+ 0 0 33 1,-0.2 -1,-0.3 2,-0.1 4,-0.3 0.456 87.6 79.8 -75.5 0.3 26.1 16.9 18.0 46 47 D K G <> S+ 0 0 124 -3,-3.7 4,-1.3 2,-0.1 -1,-0.2 0.742 90.1 41.8 -84.9 -26.1 23.0 14.9 19.1 47 48 D E H <> S+ 0 0 102 -3,-0.9 4,-3.2 -4,-0.4 5,-0.4 0.961 107.0 53.9 -93.5 -45.4 22.9 15.3 22.7 48 49 D K H < S+ 0 0 148 -4,-0.7 4,-0.3 1,-0.2 5,-0.3 0.843 110.8 61.4 -44.9 -23.6 23.8 19.1 23.3 49 50 D E H > S+ 0 0 9 -4,-0.3 4,-2.7 3,-0.1 3,-0.4 0.983 116.5 20.3 -66.6 -62.5 20.9 19.2 20.9 50 51 D Y H X S+ 0 0 84 -4,-1.3 4,-0.7 2,-0.2 -2,-0.2 0.800 111.5 70.7 -82.5 -30.6 18.2 17.6 22.9 51 52 D Y H < S+ 0 0 147 -4,-3.2 -1,-0.2 -5,-0.2 -3,-0.2 0.717 124.0 15.4 -59.7 -13.0 19.7 18.1 26.4 52 53 D L H >4 S+ 0 0 106 -5,-0.4 3,-3.2 -3,-0.4 -2,-0.2 0.683 105.8 79.4-126.5 -39.8 18.8 21.7 25.7 53 54 D K H 3< S+ 0 0 62 -4,-2.7 -3,-0.2 1,-0.3 -2,-0.1 0.580 115.4 27.7 -52.4 -6.9 16.3 21.9 22.8 54 55 D D T 3< 0 0 115 -4,-0.7 -1,-0.3 -5,-0.1 -2,-0.1 0.031 360.0 360.0-140.0 19.7 13.7 20.9 25.5 55 56 D I < 0 0 136 -3,-3.2 -2,-0.2 0, 0.0 -4,-0.0 0.086 360.0 360.0-151.1 360.0 15.3 22.3 28.7 56 ! 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 57 67 D V > 0 0 160 0, 0.0 4,-1.7 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 -61.5 1.1 19.1 18.5 58 68 D V H > + 0 0 108 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.924 360.0 54.5 -78.4 -39.1 2.4 22.4 20.3 59 69 D K H 4 S+ 0 0 91 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.535 109.8 55.6 -69.3 0.0 6.1 21.6 20.1 60 70 D A H > S+ 0 0 42 -3,-0.4 4,-3.3 2,-0.2 -2,-0.2 0.864 110.4 36.8 -95.7 -52.9 5.2 21.3 16.5 61 71 D V H X S+ 0 0 99 -4,-1.7 4,-3.9 2,-0.2 5,-0.3 0.901 115.5 58.2 -67.3 -37.6 3.7 24.7 15.8 62 72 D K H X S+ 0 0 141 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.912 112.5 39.6 -56.1 -43.0 6.3 26.1 18.1 63 73 D I H > S+ 0 0 21 -4,-0.3 4,-0.9 -5,-0.2 -2,-0.2 0.940 116.5 49.0 -72.7 -48.1 9.0 24.6 15.9 64 74 D L H X S+ 0 0 103 -4,-3.3 4,-0.7 2,-0.2 3,-0.3 0.918 114.3 46.4 -58.5 -44.7 7.2 25.5 12.6 65 75 D S H >X S+ 0 0 50 -4,-3.9 4,-1.8 1,-0.2 3,-1.5 0.959 114.8 45.1 -62.1 -50.3 6.7 29.0 13.8 66 76 D Q H 3X S+ 0 0 54 -4,-2.1 4,-0.5 -5,-0.3 -1,-0.2 0.587 109.3 58.8 -70.0 -7.8 10.2 29.5 15.0 67 77 D E H 3X S+ 0 0 13 -4,-0.9 4,-0.7 -3,-0.3 -1,-0.3 0.600 106.2 47.7 -92.6 -14.2 11.2 27.8 11.7 68 78 D D H < S+ 0 0 99 -4,-2.6 3,-1.3 1,-0.2 4,-0.3 0.946 109.4 51.1 -70.9 -48.2 14.9 38.9 3.2 77 87 D H H >X>S+ 0 0 5 -4,-1.1 4,-1.9 1,-0.3 3,-1.0 0.632 84.8 89.1 -65.1 -12.8 18.6 39.1 3.6 78 88 D D T 3<5S+ 0 0 27 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.1 0.490 92.9 46.0 -63.7 -1.3 18.9 37.6 0.2 79 89 D E T <45S+ 0 0 150 -3,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.534 117.3 42.4-111.3 -22.7 18.8 41.2 -0.9 80 90 D R T X45S+ 0 0 122 -3,-1.0 3,-1.1 -4,-0.3 -2,-0.2 0.924 118.6 38.5 -88.8 -66.1 21.3 42.4 1.8 81 91 D T T >X5S+ 0 0 29 -4,-1.9 3,-2.8 1,-0.3 4,-0.7 0.707 93.0 97.6 -56.8 -14.3 24.0 39.8 1.7 82 92 D V H 3>< + 0 0 41 -5,-0.7 4,-1.3 1,-0.3 -1,-0.3 0.391 62.4 78.5 -56.4 6.0 23.2 40.0 -2.0 83 93 D L H <> S+ 0 0 118 -3,-1.1 4,-3.8 2,-0.2 -1,-0.3 0.871 93.1 49.6 -78.6 -38.2 26.3 42.3 -2.1 84 94 D I H <> S+ 0 0 47 -3,-2.8 4,-4.7 2,-0.2 5,-0.3 0.892 104.4 57.5 -63.5 -45.3 28.3 39.1 -2.0 85 95 D L H X S+ 0 0 71 -4,-0.7 4,-2.1 1,-0.2 -1,-0.2 0.956 120.6 29.6 -52.7 -53.6 26.4 37.5 -4.8 86 96 D V H X S+ 0 0 58 -4,-1.3 4,-3.2 2,-0.2 -2,-0.2 0.895 117.8 60.7 -73.2 -37.5 27.3 40.3 -7.0 87 97 D N H < S+ 0 0 80 -4,-3.8 5,-0.4 2,-0.2 -2,-0.2 0.890 110.3 40.6 -56.0 -42.0 30.5 40.8 -5.1 88 98 D A H X S+ 0 0 30 -4,-4.7 4,-0.8 1,-0.2 5,-0.3 0.997 122.8 38.8 -65.5 -63.7 31.6 37.2 -6.1 89 99 D Q H X S+ 0 0 98 -4,-2.1 4,-1.1 -5,-0.3 5,-0.5 0.705 109.5 82.0 -56.9 -25.9 30.3 37.5 -9.6 90 100 D Q H >X S- 0 0 75 -4,-3.2 4,-3.0 -6,-0.3 3,-1.0 0.783 108.0 -2.4 -51.2-127.4 31.6 41.1 -9.6 91 101 D R H 34 S+ 0 0 190 1,-0.3 4,-0.3 3,-0.2 -1,-0.2 0.628 127.5 70.5 -45.0 -17.8 35.3 41.9 -10.2 92 102 D K H 3X S+ 0 0 72 -4,-0.8 4,-1.4 -5,-0.4 -1,-0.3 0.981 109.8 28.2 -68.7 -55.8 35.8 38.1 -10.5 93 103 D K H X S+ 0 0 46 -4,-1.4 3,-3.4 -3,-0.3 4,-0.8 0.927 104.3 58.0 -70.8 -45.9 37.6 37.5 -16.6 97 107 D L H 3X S+ 0 0 78 -4,-3.0 4,-2.1 1,-0.3 -1,-0.2 0.768 93.3 70.8 -55.2 -23.2 36.5 40.4 -18.7 98 108 D L H 3< S+ 0 0 99 -4,-0.7 -1,-0.3 -5,-0.3 -2,-0.2 0.852 97.0 50.2 -58.1 -32.3 40.0 41.6 -18.0 99 109 D S H <4 S+ 0 0 94 -3,-3.4 -1,-0.3 -4,-0.4 -2,-0.3 0.802 99.6 64.3 -73.7 -30.9 40.7 38.7 -20.4 100 110 D R H < 0 0 217 -4,-0.8 -2,-0.2 1,-0.1 -1,-0.2 0.971 360.0 360.0 -56.4 -53.5 38.1 40.2 -22.8 101 111 D V < 0 0 143 -4,-2.1 -2,-0.2 0, 0.0 -3,-0.2 0.985 360.0 360.0 -71.3 360.0 40.4 43.1 -23.2 102 !* 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 0.0 103 2 B A 0 0 152 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 161.9 5.5 11.7 16.0 104 3 B I + 0 0 93 1,-0.1 -44,-0.0 3,-0.1 4,-0.0 0.418 360.0 167.7 -38.4 178.3 7.6 14.0 13.7 105 4 B T S S+ 0 0 77 0, 0.0 -1,-0.1 0, 0.0 92,-0.1 0.062 84.6 4.0-159.8 -66.2 7.3 14.5 10.0 106 5 B K S S+ 0 0 104 3,-0.0 2,-3.3 1,-0.0 -2,-0.1 0.245 81.2 132.9-116.8 6.8 9.3 17.5 8.9 107 6 B I + 0 0 42 1,-0.2 -3,-0.1 2,-0.0 -47,-0.0 -0.355 46.6 98.5 -62.7 78.8 10.8 18.5 12.3 108 7 B N S S- 0 0 95 -2,-3.3 -1,-0.2 -4,-0.0 6,-0.1 -0.245 77.8-129.0-164.3 54.6 14.1 18.8 10.5 109 8 B D + 0 0 7 5,-0.1 2,-0.0 4,-0.0 -2,-0.0 -0.317 61.6 22.9 -55.1 130.4 14.6 22.5 9.8 110 9 B C - 0 0 8 -43,-0.1 5,-0.2 -4,-0.0 -43,-0.0 0.692 40.6-165.2-134.4-169.1 15.3 23.5 7.2 111 10 B F S > S+ 0 0 137 3,-0.2 4,-0.9 2,-0.1 5,-0.4 0.927 90.1 24.7 -80.4 -89.4 15.3 22.7 3.4 112 11 B E H > S+ 0 0 94 1,-0.3 4,-1.3 2,-0.2 5,-0.2 0.897 128.8 44.1 -42.4 -58.5 17.5 24.9 1.2 113 12 B L H > S+ 0 0 21 2,-0.1 4,-1.9 3,-0.1 -1,-0.3 0.912 110.8 63.2 -57.8 -39.3 20.0 25.8 4.0 114 13 B L H > S+ 0 0 18 1,-0.2 4,-1.8 2,-0.2 3,-0.5 0.945 107.1 29.7 -49.6 -89.4 19.9 22.1 5.1 115 14 B S H X S+ 0 0 37 -4,-0.9 4,-4.5 -5,-0.2 5,-0.4 0.766 114.8 66.1 -47.5 -31.3 21.3 19.9 2.3 116 15 B M H X S+ 0 0 57 -4,-1.3 4,-2.6 -5,-0.4 5,-0.2 0.985 105.4 39.8 -55.2 -61.3 23.5 22.8 1.2 117 16 B V H X S+ 0 0 0 -4,-1.9 4,-5.1 -3,-0.5 5,-0.2 0.924 122.5 43.6 -52.6 -49.7 25.6 22.8 4.3 118 17 B T H X S+ 0 0 32 -4,-1.8 4,-1.0 2,-0.3 -2,-0.2 0.950 114.5 47.4 -62.2 -53.8 25.6 19.0 4.4 119 18 B Y H X S+ 0 0 67 -4,-4.5 4,-1.2 1,-0.2 -1,-0.2 0.835 120.8 42.1 -57.5 -29.4 26.3 18.5 0.7 120 19 B A H X S+ 0 0 8 -4,-2.6 4,-1.8 -5,-0.4 -2,-0.3 0.940 108.2 55.2 -81.5 -50.2 29.0 21.1 1.3 121 20 B D H X S+ 0 0 42 -4,-5.1 4,-0.6 -5,-0.2 -2,-0.2 0.599 108.0 59.4 -57.4 -10.1 30.3 19.7 4.6 122 21 B K H X S+ 0 0 92 -4,-1.0 4,-2.3 -5,-0.2 -1,-0.2 0.940 108.4 33.7 -84.4 -61.8 30.7 16.6 2.5 123 22 B L H X S+ 0 0 5 -4,-1.2 4,-1.6 2,-0.2 -2,-0.2 0.641 110.9 68.0 -72.4 -13.3 33.1 17.5 -0.4 124 23 B K H X S+ 0 0 12 -4,-1.8 4,-0.6 2,-0.2 -1,-0.2 0.955 111.2 31.5 -66.4 -49.9 34.9 19.8 2.0 125 24 B S H X S+ 0 0 41 -4,-0.6 4,-2.2 -5,-0.2 5,-0.3 0.858 112.7 63.1 -75.0 -41.5 36.2 16.8 4.0 126 25 B L H X S+ 0 0 37 -4,-2.3 4,-1.5 1,-0.3 -1,-0.2 0.896 110.8 39.2 -51.6 -45.1 36.3 14.5 1.0 127 26 B I H X S+ 0 0 0 -4,-1.6 4,-1.0 2,-0.2 -1,-0.3 0.707 109.8 66.3 -75.6 -24.4 39.0 16.7 -0.6 128 27 B K H < S+ 0 0 54 -4,-0.6 3,-0.3 2,-0.2 -2,-0.2 0.974 109.3 31.4 -62.6 -56.6 40.5 17.2 2.9 129 28 B K H < S+ 0 0 186 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.1 0.955 117.8 54.8 -66.8 -52.5 41.6 13.6 3.4 130 29 B E H < S- 0 0 122 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.666 130.7 -27.4 -57.3 -20.3 42.4 12.8 -0.2 131 30 B F S < S+ 0 0 55 -4,-1.0 -3,-0.0 1,-0.3 -4,-0.0 -0.453 105.5 2.9-157.5-130.3 44.7 15.9 -0.4 132 31 B S - 0 0 39 -2,-0.1 -1,-0.3 1,-0.1 0, 0.0 0.662 44.3-149.6 -49.5-143.9 45.3 19.3 1.1 133 32 B I >> + 0 0 93 -4,-0.0 3,-1.5 0, 0.0 4,-0.9 0.218 69.2 102.4-173.2 -17.3 43.3 20.8 3.9 134 33 B S H 3> S+ 0 0 15 1,-0.3 4,-6.2 2,-0.2 5,-0.3 0.707 74.3 75.3 -54.3 -15.2 43.3 24.6 3.3 135 34 B F H 3> S+ 0 0 0 2,-0.3 4,-2.0 1,-0.2 -1,-0.3 0.896 91.4 47.3 -64.8 -46.0 39.8 23.9 2.1 136 35 B E H <> S+ 0 0 61 -3,-1.5 4,-0.6 -12,-0.2 -1,-0.2 0.762 123.9 40.3 -65.9 -21.3 38.2 23.5 5.5 137 36 B E H X S+ 0 0 55 -4,-0.9 4,-3.6 2,-0.2 3,-0.3 0.926 112.7 48.6 -88.3 -60.1 40.2 26.7 6.2 138 37 B F H X S+ 0 0 30 -4,-6.2 4,-0.9 1,-0.2 -3,-0.2 0.889 108.1 57.8 -49.5 -47.0 39.8 28.7 3.0 139 38 B A H >< S+ 0 0 2 -4,-2.0 3,-0.5 -5,-0.3 -1,-0.2 0.919 117.8 31.2 -52.2 -49.6 36.0 28.1 3.1 140 39 B V H >X S+ 0 0 45 -4,-0.6 3,-1.7 -3,-0.3 4,-0.7 0.834 100.6 87.1 -77.1 -32.1 35.7 29.6 6.6 141 40 B L H 3< S+ 0 0 35 -4,-3.6 -1,-0.2 1,-0.3 -2,-0.2 0.715 71.0 74.2 -36.6 -35.0 38.6 32.0 5.9 142 41 B T T << S+ 0 0 64 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.1 0.370 110.5 30.7 -67.6 11.1 36.1 34.5 4.3 143 42 B Y T <4 S+ 0 0 144 -3,-1.7 2,-0.4 1,-0.3 -2,-0.2 0.483 119.9 47.6-139.8 -23.4 35.1 35.1 8.0 144 43 B I < - 0 0 94 -4,-0.7 -1,-0.3 -7,-0.2 4,-0.1 -0.974 54.1-158.1-132.5 143.2 38.3 34.6 10.0 145 44 B S S S+ 0 0 88 -2,-0.4 3,-0.2 1,-0.1 4,-0.1 0.429 81.9 63.7 -96.9 -2.4 41.9 35.7 9.7 146 45 B E S > S+ 0 0 117 1,-0.2 3,-3.2 2,-0.2 4,-0.4 0.830 82.0 72.7-100.1 -13.3 43.9 33.3 11.6 147 46 B N T 3> S+ 0 0 27 1,-0.3 4,-0.8 2,-0.2 -1,-0.2 0.807 91.2 70.7 -57.3 -21.3 43.2 30.1 9.7 148 47 B K H 3> S+ 0 0 77 -3,-0.2 4,-2.2 3,-0.2 5,-0.4 0.657 80.0 78.2 -67.9 -17.9 45.5 32.0 7.4 149 48 B E H <> S+ 0 0 96 -3,-3.2 4,-2.2 1,-0.2 3,-0.5 0.982 107.7 20.8 -67.1 -74.8 48.5 31.4 9.7 150 49 B K H > S+ 0 0 130 -4,-0.4 4,-1.8 1,-0.2 5,-0.4 0.821 116.3 81.5 -62.6 -12.2 49.6 27.8 9.0 151 50 B E H X S+ 0 0 21 -4,-0.8 4,-2.7 -5,-0.3 3,-0.5 0.963 106.2 21.4 -49.2 -63.3 47.7 28.6 5.8 152 51 B Y H < S+ 0 0 117 -4,-2.2 5,-0.4 -3,-0.5 4,-0.3 0.784 117.5 67.3 -79.0 -24.9 50.6 30.4 4.2 153 52 B Y H < S+ 0 0 146 -4,-2.2 4,-0.4 -5,-0.4 -1,-0.2 0.731 116.6 28.3 -64.2 -21.3 53.0 28.7 6.6 154 53 B L H < S+ 0 0 87 -4,-1.8 -2,-0.2 -3,-0.5 -1,-0.2 0.786 104.4 72.8-106.4 -43.4 52.1 25.5 4.7 155 54 B K S < S+ 0 0 63 -4,-2.7 -2,-0.1 -5,-0.4 -3,-0.1 0.435 119.6 20.5 -57.9 6.8 51.1 26.8 1.2 156 55 B D 0 0 124 -4,-0.3 -1,-0.2 -5,-0.1 -2,-0.1 0.529 360.0 360.0-138.5 -48.6 54.8 27.4 0.6 157 56 B I 0 0 143 -5,-0.4 -2,-0.1 -4,-0.4 -1,-0.1 -0.710 360.0 360.0-103.1 360.0 56.8 25.3 3.1 158 ! 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 0.0 159 67 B V > 0 0 153 0, 0.0 4,-1.4 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -32.6 53.9 31.6 -13.4 160 68 B V H > + 0 0 123 1,-0.2 4,-1.5 2,-0.2 5,-0.2 0.992 360.0 34.8 -76.3 -57.3 55.7 28.6 -11.8 161 69 B K H > S+ 0 0 96 2,-0.2 4,-2.8 3,-0.2 5,-0.2 0.726 114.0 68.6 -65.0 -17.3 53.5 28.1 -8.7 162 70 B A H >> S+ 0 0 47 2,-0.2 4,-3.5 1,-0.2 3,-0.5 0.996 105.7 31.8 -61.7 -76.8 50.7 29.3 -11.0 163 71 B V H 3X S+ 0 0 105 -4,-1.4 4,-1.9 1,-0.3 -1,-0.2 0.744 118.9 59.3 -55.1 -22.4 50.4 26.3 -13.3 164 72 B K H 3X S+ 0 0 162 -4,-1.5 4,-1.0 -5,-0.2 -1,-0.3 0.939 113.0 36.4 -71.0 -45.5 51.5 24.2 -10.3 165 73 B I H S+ 0 0 46 -5,-0.4 4,-1.0 -4,-0.3 3,-0.3 0.784 100.0 44.1 -68.4 -26.6 38.1 19.7 -9.9 174 82 B K H X S+ 0 0 106 -4,-1.4 4,-2.2 -3,-0.5 5,-0.3 0.869 105.9 58.5 -85.1 -40.8 37.7 16.4 -11.6 175 83 B K H < S+ 0 0 56 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.350 107.5 51.6 -71.8 6.5 36.9 14.3 -8.5 176 84 B R H > S+ 0 0 24 -3,-0.3 4,-1.1 -4,-0.1 -1,-0.2 0.761 112.3 39.9-104.9 -49.1 33.9 16.7 -7.9 177 85 B N H < S+ 0 0 88 -4,-1.0 -2,-0.2 2,-0.2 -3,-0.1 0.791 123.1 46.6 -69.3 -28.5 32.2 16.6 -11.3 178 86 B E T >< S+ 0 0 116 -4,-2.2 3,-1.5 1,-0.2 -3,-0.2 0.917 112.5 45.9 -77.6 -49.7 33.0 12.9 -11.2 179 87 B H G >4 S+ 0 0 41 1,-0.3 3,-1.3 -5,-0.3 -2,-0.2 0.662 97.5 76.3 -70.2 -14.1 31.8 12.3 -7.7 180 88 B D G 3< S+ 0 0 49 -4,-1.1 3,-0.3 1,-0.3 -1,-0.3 0.521 79.1 72.4 -73.4 -7.8 28.7 14.3 -8.5 181 89 B E G < S+ 0 0 154 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.602 112.2 25.6 -82.4 -11.7 27.4 11.3 -10.4 182 90 B R S < S+ 0 0 194 -3,-1.3 3,-0.3 -4,-0.1 -1,-0.2 0.088 94.2 90.4-140.3 24.5 26.7 9.4 -7.2 183 91 B T > + 0 0 20 -3,-0.3 3,-0.9 1,-0.2 4,-0.2 0.300 58.9 101.4 -99.6 5.4 26.3 12.2 -4.6 184 92 B V T 3> + 0 0 75 1,-0.2 4,-1.7 2,-0.1 5,-0.4 0.387 46.5 103.7 -69.8 3.0 22.6 12.0 -5.4 185 93 B L H 3> S+ 0 0 107 -3,-0.3 4,-3.7 3,-0.2 5,-0.3 0.931 79.0 49.9 -50.1 -51.0 22.1 10.0 -2.2 186 94 B I H <> S+ 0 0 53 -3,-0.9 4,-3.7 2,-0.2 5,-0.3 0.964 113.6 34.7 -49.6 -88.3 20.7 13.0 -0.4 187 95 B L H > S+ 0 0 104 -4,-0.2 4,-1.5 1,-0.2 6,-0.2 0.785 125.4 47.4 -41.2 -40.6 18.0 14.6 -2.6 188 96 B V H X>S+ 0 0 33 -4,-1.7 4,-5.2 2,-0.3 5,-0.6 0.971 114.9 40.7 -68.4 -61.6 17.1 11.0 -3.7 189 97 B N H <5S+ 0 0 78 -4,-3.7 -2,-0.2 -5,-0.4 -1,-0.2 0.818 121.4 48.1 -56.7 -26.7 17.0 9.5 -0.3 190 98 B A H X5S+ 0 0 33 -4,-3.7 4,-3.1 -5,-0.3 -2,-0.3 0.817 111.4 48.4 -79.6 -34.7 15.3 12.8 0.4 191 99 B Q H X5S+ 0 0 110 -4,-1.5 4,-2.9 -5,-0.3 -2,-0.2 0.976 117.5 39.3 -67.8 -52.7 13.1 12.2 -2.6 192 100 B Q H X5S+ 0 0 95 -4,-5.2 4,-0.6 1,-0.2 -1,-0.2 0.783 111.8 65.4 -66.7 -19.0 12.3 8.8 -1.4 193 101 B R H >>X S+ 0 0 111 -4,-3.1 4,-5.9 1,-0.3 3,-0.9 0.960 110.5 60.7 -61.8 -42.0 9.3 12.6 1.0 195 103 B K H 3<>S+ 0 0 106 -4,-2.9 5,-0.8 1,-0.3 -1,-0.3 0.749 97.7 62.1 -56.7 -20.0 7.9 9.5 -0.6 196 104 B I H <<5S+ 0 0 87 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.937 126.0 10.9 -75.0 -38.3 8.2 8.1 2.9 197 105 B E H >5S+ 0 0 75 1,-0.2 3,-4.1 2,-0.2 4,-1.8 0.970 124.1 59.7 -59.3 -52.8 2.4 9.1 -0.4 200 108 B L H 3> S+ 0 0 138 -3,-4.1 4,-5.7 -4,-0.5 5,-0.4 0.655 112.1 64.0 -84.6 -21.9 -2.2 9.4 1.6 203 111 B V H X S+ 0 0 64 -4,-1.8 4,-1.8 2,-0.3 -2,-0.2 0.998 111.5 28.3 -60.6 -68.6 -1.3 6.0 3.0 204 112 B N H < S+ 0 0 105 -4,-2.9 -1,-0.2 1,-0.2 -3,-0.2 0.617 126.2 58.0 -66.4 -6.9 -2.5 6.6 6.5 205 113 B K H >4 S+ 0 0 73 -5,-0.4 3,-3.9 -6,-0.3 -2,-0.3 0.964 100.5 47.4 -82.0 -66.5 -4.9 9.0 4.6 206 114 B R H 3< S+ 0 0 158 -4,-5.7 -2,-0.2 1,-0.3 -3,-0.2 0.824 103.0 66.6 -44.4 -37.4 -6.6 6.6 2.1 207 115 B I T 3< 0 0 143 -4,-1.8 -1,-0.3 -5,-0.4 -2,-0.2 0.739 360.0 360.0 -62.2 -16.5 -7.1 4.3 5.1 208 116 B T < 0 0 122 -3,-3.9 -1,-0.3 -6,-0.2 -2,-0.2 0.577 360.0 360.0 -95.6 360.0 -9.4 7.2 6.3