==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 09-OCT-05 2D45 . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.K.SAFO,T.-P.KO,F.N.MUSAYEV,Q.ZHAO,A.H.-J.WANG,G.L.ARCHER . 468 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26511.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 382 81.6 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 . 31 6.6 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 . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 24 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 79 16.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 227 48.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.7 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 7 1 2 5 0 1 4 0 4 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 5 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 5 A T 0 0 182 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 127.5 13.3 26.1 58.3 2 6 A Y - 0 0 158 49,-0.1 2,-0.2 50,-0.1 0, 0.0 -0.864 360.0-166.9-102.1 131.5 17.0 27.1 58.1 3 7 A E - 0 0 136 -2,-0.5 2,-0.6 0, 0.0 48,-0.0 -0.727 22.1-113.6-114.0 164.5 18.0 29.8 55.6 4 8 A I - 0 0 18 -2,-0.2 5,-0.1 4,-0.0 2,-0.1 -0.886 30.4-133.0-108.1 113.7 21.3 30.9 54.2 5 9 A S > - 0 0 46 -2,-0.6 4,-2.9 1,-0.1 3,-0.3 -0.276 16.1-120.4 -66.7 143.1 22.4 34.4 55.1 6 10 A S H > S+ 0 0 64 1,-0.3 4,-0.5 2,-0.2 -1,-0.1 0.755 117.3 51.1 -52.1 -31.1 23.8 36.9 52.6 7 11 A A H >> S+ 0 0 32 2,-0.2 3,-0.9 1,-0.2 4,-0.6 0.910 111.5 49.6 -73.1 -41.4 27.0 37.1 54.5 8 12 A E H >> S+ 0 0 7 -3,-0.3 3,-1.9 1,-0.2 4,-1.1 0.917 94.4 71.4 -62.5 -45.6 27.1 33.4 54.5 9 13 A W H 3X S+ 0 0 1 -4,-2.9 4,-2.0 1,-0.3 -1,-0.2 0.782 88.9 65.8 -40.6 -34.2 26.5 33.1 50.8 10 14 A E H X S+ 0 0 1 -4,-2.0 3,-1.5 -3,-0.4 4,-1.0 0.941 114.7 51.0 -77.8 -49.2 33.3 26.1 48.9 16 20 A W H 3< S+ 0 0 26 -4,-4.2 3,-0.4 1,-0.3 -2,-0.2 0.850 109.3 53.9 -54.1 -36.1 31.1 25.4 45.8 17 21 A X T 3< S+ 0 0 110 -4,-2.9 -1,-0.3 -5,-0.4 -2,-0.2 0.676 120.3 31.0 -76.6 -15.1 33.9 26.9 43.7 18 22 A K T <4 S- 0 0 67 -3,-1.5 2,-3.7 -4,-0.4 -2,-0.2 0.286 87.2-147.6-127.8 13.9 36.5 24.6 45.2 19 23 A K S < S+ 0 0 172 -4,-1.0 48,-0.7 -3,-0.4 2,-0.3 -0.217 86.6 37.2 55.7 -61.5 34.3 21.4 46.1 20 24 A Y E S+A 66 0A 86 -2,-3.7 2,-0.3 46,-0.1 46,-0.2 -0.782 78.7 168.7-110.6 154.2 36.5 20.7 49.1 21 25 A A E -A 65 0A 0 44,-0.8 44,-3.6 -2,-0.3 2,-0.1 -0.896 22.3-135.0-173.0 143.8 37.9 23.5 51.3 22 26 A S > - 0 0 12 -2,-0.3 4,-2.1 42,-0.2 5,-0.3 -0.466 33.9-101.7 -99.6 170.8 39.6 24.2 54.6 23 27 A A H >> S+ 0 0 18 40,-0.5 4,-1.6 1,-0.2 3,-1.1 0.962 125.7 24.0 -47.8 -75.0 39.2 26.7 57.4 24 28 A N H 3> S+ 0 0 85 1,-0.3 4,-2.7 2,-0.2 5,-0.3 0.815 113.1 71.1 -61.5 -36.8 42.0 28.9 56.2 25 29 A N H 3> S+ 0 0 64 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.824 107.2 39.6 -48.8 -37.4 41.7 27.7 52.6 26 30 A I H XX S+ 0 0 0 -4,-2.1 4,-1.3 -3,-1.1 3,-0.9 0.946 110.0 56.8 -77.3 -56.2 38.5 29.7 52.5 27 31 A I H >X S+ 0 0 3 -4,-1.6 4,-4.0 1,-0.3 3,-1.2 0.885 104.3 53.3 -41.8 -55.0 39.6 32.7 54.4 28 32 A E H 3< S+ 0 0 125 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.874 111.6 46.8 -50.3 -42.8 42.5 33.4 52.1 29 33 A E H << S+ 0 0 84 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.602 118.8 40.8 -74.6 -17.9 40.0 33.3 49.2 30 34 A I H XX S+ 0 0 0 -4,-1.3 2,-5.0 -3,-1.2 3,-2.6 0.832 95.3 77.4 -94.8 -48.1 37.5 35.6 51.0 31 35 A Q T 3< S+ 0 0 91 -4,-4.0 -1,-0.2 1,-0.3 4,-0.1 -0.232 97.9 49.4 -62.2 65.3 40.0 38.0 52.4 32 36 A X T 34 S+ 0 0 170 -2,-5.0 -1,-0.3 2,-0.2 -2,-0.1 0.172 114.1 36.9-168.7 -32.6 40.2 39.6 49.0 33 37 A Q T <4 S+ 0 0 100 -3,-2.6 2,-0.3 -4,-0.1 -2,-0.2 0.468 129.7 26.1-106.9 -12.5 36.6 40.1 48.0 34 38 A K S < S- 0 0 101 -4,-2.1 2,-0.4 2,-0.1 -2,-0.2 -0.895 70.5-131.5-144.2 172.5 35.7 41.0 51.5 35 39 A D + 0 0 145 -2,-0.3 2,-0.3 -4,-0.1 -4,-0.1 -0.732 49.0 127.8-134.2 85.5 37.2 42.4 54.7 36 40 A W - 0 0 66 -2,-0.4 -2,-0.1 -9,-0.1 -6,-0.0 -0.874 60.6 -89.0-131.0 169.3 36.4 40.4 57.8 37 41 A S > - 0 0 57 -2,-0.3 4,-2.6 1,-0.1 3,-0.4 -0.460 34.0-120.5 -76.2 148.4 38.4 38.8 60.6 38 42 A P H > S+ 0 0 50 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.689 119.6 51.6 -61.9 -10.5 39.6 35.3 60.1 39 43 A K H > S+ 0 0 146 2,-0.2 4,-1.6 3,-0.1 5,-0.1 0.794 105.4 51.7 -91.9 -33.7 37.5 34.7 63.2 40 44 A T H > S+ 0 0 67 -3,-0.4 4,-1.4 2,-0.2 -1,-0.1 0.874 112.1 48.4 -69.0 -38.0 34.4 36.3 61.8 41 45 A I H >X S+ 0 0 0 -4,-2.6 4,-1.2 2,-0.2 3,-1.0 0.979 106.9 53.7 -65.8 -55.8 34.7 34.2 58.7 42 46 A R H 3X S+ 0 0 77 -4,-1.3 4,-3.2 1,-0.3 3,-0.4 0.835 106.1 54.5 -46.5 -40.7 35.2 30.9 60.6 43 47 A T H 3X S+ 0 0 61 -4,-1.6 4,-2.9 1,-0.3 -1,-0.3 0.894 102.9 56.8 -62.1 -39.5 32.0 31.6 62.5 44 48 A L H S+ 0 0 0 -4,-1.4 5,-2.9 1,-0.2 6,-1.1 0.736 110.3 59.8 -68.1 -22.4 26.6 26.9 58.0 49 53 A Y H <5S+ 0 0 78 -4,-2.4 -2,-0.2 -3,-0.3 -1,-0.2 0.943 111.4 39.4 -68.7 -45.5 28.0 23.8 59.5 50 54 A K H <5S+ 0 0 142 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.900 110.8 54.5 -70.5 -43.6 25.3 23.8 62.0 51 55 A K H <5S- 0 0 54 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.859 116.8-126.0 -60.8 -25.3 22.5 24.9 59.8 52 56 A G T <5S+ 0 0 36 -4,-0.8 -3,-0.2 -5,-0.3 -2,-0.1 0.963 72.0 129.0 84.0 54.8 23.8 22.0 58.0 53 57 A F S - 0 0 105 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.573 28.1-139.9 -73.9 122.7 23.3 21.2 45.3 71 75 A E H >> S+ 0 0 59 -2,-0.4 4,-2.5 1,-0.2 3,-1.5 0.937 99.3 33.5 -44.3 -81.8 24.4 24.7 44.2 72 76 A S H 3> S+ 0 0 24 1,-0.3 4,-2.1 2,-0.2 5,-0.4 0.840 114.6 61.6 -48.2 -35.8 22.2 25.5 41.2 73 77 A D H 3> S+ 0 0 81 1,-0.2 4,-0.9 2,-0.2 -1,-0.3 0.912 114.9 34.4 -57.5 -38.6 19.3 23.5 42.9 74 78 A I H X S+ 0 0 10 -4,-2.5 4,-3.0 2,-0.2 3,-0.5 0.974 109.4 48.8 -62.9 -50.9 20.3 29.2 43.9 76 80 A Y H 3X S+ 0 0 18 -4,-2.1 4,-2.4 1,-0.3 -1,-0.2 0.941 112.7 51.8 -51.3 -44.5 17.3 28.7 41.7 77 81 A K H 3X S+ 0 0 127 -4,-0.9 4,-0.8 -5,-0.4 -1,-0.3 0.807 111.2 44.6 -61.6 -36.9 15.4 28.1 44.9 78 82 A T H X S+ 0 0 5 -4,-3.0 3,-2.4 2,-0.2 4,-2.2 0.999 111.4 47.0 -58.6 -77.0 13.4 36.6 46.3 83 87 A I H 3X S+ 0 0 4 -4,-1.9 4,-0.7 1,-0.3 3,-0.2 0.894 108.6 58.8 -33.6 -55.6 11.8 37.7 43.0 84 88 A N H 3< S+ 0 0 20 -4,-1.0 376,-0.4 -5,-0.4 -1,-0.3 0.833 109.5 43.0 -47.8 -38.7 8.5 36.4 44.4 85 89 A K H << S+ 0 0 58 -3,-2.4 -1,-0.2 -4,-1.1 -2,-0.2 0.838 127.9 30.3 -76.9 -33.1 8.8 38.8 47.3 86 90 A V H < S+ 0 0 0 -4,-2.2 2,-0.4 -3,-0.2 -3,-0.2 0.965 114.0 47.7 -85.4 -79.6 10.0 41.7 45.1 87 91 A Y >< - 0 0 4 -4,-0.7 3,-0.7 1,-0.2 373,-0.2 -0.603 63.2-155.0 -73.8 122.7 8.6 41.6 41.5 88 92 A K T 3 S+ 0 0 34 -2,-0.4 373,-2.9 1,-0.2 2,-0.6 0.854 88.2 60.0 -65.1 -34.6 4.9 41.0 41.4 89 93 A G T 3> S- 0 0 9 1,-0.2 4,-1.7 372,-0.2 5,-0.3 -0.271 99.5-124.1 -93.2 49.7 5.2 39.5 37.9 90 94 A G H <> - 0 0 6 -3,-0.7 4,-0.7 -2,-0.6 -1,-0.2 0.179 63.3 -30.3 44.7-171.1 7.5 36.6 38.3 91 95 A F H >> S+ 0 0 14 1,-0.2 4,-2.0 2,-0.2 3,-0.9 0.822 135.7 54.1 -44.7 -50.3 10.8 36.0 36.4 92 96 A N H >> S+ 0 0 15 1,-0.2 4,-2.7 2,-0.2 3,-0.5 0.980 99.9 56.2 -51.3 -69.8 9.7 37.9 33.3 93 97 A S H 3< S+ 0 0 41 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.683 110.5 51.9 -36.4 -24.4 8.6 41.2 34.9 94 98 A L H XX S+ 0 0 3 -3,-0.9 3,-2.0 -4,-0.7 4,-0.8 0.938 107.4 46.7 -80.3 -54.3 12.2 41.1 36.2 95 99 A V H XX S+ 0 0 7 -4,-2.0 3,-1.6 -3,-0.5 4,-1.6 0.918 109.3 56.7 -53.3 -44.2 13.9 40.6 32.8 96 100 A L H 3X S+ 0 0 76 -4,-2.7 4,-0.9 1,-0.3 -1,-0.3 0.751 104.6 54.9 -59.5 -20.3 11.7 43.3 31.5 97 101 A N H <> S+ 0 0 19 -3,-2.0 4,-0.6 -5,-0.4 -1,-0.3 0.610 101.1 56.7 -90.0 -12.9 13.2 45.5 34.2 98 102 A F H <<>S+ 0 0 0 -3,-1.6 5,-3.1 -4,-0.8 6,-0.2 0.850 110.6 42.2 -82.0 -40.5 16.8 44.9 33.2 99 103 A V H ><5S+ 0 0 40 -4,-1.6 3,-2.0 3,-0.2 -2,-0.2 0.803 105.9 63.1 -75.5 -29.9 16.3 46.1 29.7 100 104 A E H 3<5S+ 0 0 138 -4,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.859 111.2 40.4 -61.4 -34.1 14.2 49.0 30.9 101 105 A K T 3<5S- 0 0 59 -4,-0.6 -1,-0.3 91,-0.1 -2,-0.2 -0.134 114.2-125.9-105.0 31.7 17.4 50.1 32.7 102 106 A E T < 5 + 0 0 174 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.706 55.9 153.3 24.6 52.7 19.4 49.1 29.7 103 107 A D < + 0 0 46 -5,-3.1 2,-0.5 -6,-0.0 -1,-0.2 0.234 49.0 91.4 -87.0 16.5 21.6 46.9 31.8 104 108 A L - 0 0 26 -6,-0.2 2,-0.4 -5,-0.1 -2,-0.0 -0.948 60.0-158.2-121.8 128.5 22.2 44.9 28.6 105 109 A S >> - 0 0 54 -2,-0.5 4,-2.8 1,-0.1 3,-1.8 -0.782 32.5-118.0 -97.9 141.4 24.8 45.2 25.9 106 110 A Q H 3> S+ 0 0 128 -2,-0.4 4,-1.2 1,-0.3 5,-0.1 0.777 116.0 60.5 -47.6 -30.2 24.1 43.8 22.4 107 111 A D H 3> S+ 0 0 150 2,-0.2 4,-1.0 1,-0.2 -1,-0.3 0.887 114.1 35.2 -67.3 -35.1 27.0 41.4 22.9 108 112 A E H <> S+ 0 0 87 -3,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.909 110.7 58.8 -83.6 -46.4 25.3 39.9 25.9 109 113 A I H X S+ 0 0 15 -4,-2.8 4,-1.0 1,-0.2 -3,-0.2 0.806 104.0 58.2 -53.1 -29.2 21.6 40.2 24.7 110 114 A E H >X S+ 0 0 89 -4,-1.2 4,-1.3 -5,-0.4 3,-0.8 0.978 99.4 54.1 -65.7 -55.7 22.8 38.0 21.9 111 115 A E H 3< S+ 0 0 101 -4,-1.0 -2,-0.2 1,-0.2 -1,-0.2 0.835 98.8 65.3 -47.9 -40.5 24.0 35.2 24.1 112 116 A L H >X S+ 0 0 8 -4,-1.5 3,-2.6 1,-0.2 4,-1.7 0.915 98.6 50.8 -51.7 -52.2 20.6 34.9 25.9 113 117 A R H X< S+ 0 0 47 -4,-1.0 3,-1.4 -3,-0.8 -1,-0.2 0.958 110.7 48.9 -50.0 -54.3 18.8 33.8 22.7 114 118 A N T 3< S+ 0 0 111 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.314 111.8 52.4 -70.0 10.9 21.4 31.1 22.3 115 119 A I T <4 S+ 0 0 41 -3,-2.6 -1,-0.3 -5,-0.2 -2,-0.3 0.508 99.7 58.9-114.7 -23.9 20.7 30.4 25.9 116 120 A L << 0 0 12 -4,-1.7 -2,-0.2 -3,-1.4 -3,-0.1 0.193 360.0 360.0 -90.7 19.3 17.0 30.1 25.4 117 121 A N 0 0 124 -5,-0.2 -3,-0.1 -4,-0.0 -2,-0.1 0.421 360.0 360.0-139.1 360.0 17.9 27.3 22.9 118 !* 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 0.0 119 3 B N 0 0 223 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 141.7 28.4 56.6 57.3 120 4 B K - 0 0 192 2,-0.0 2,-0.4 0, 0.0 0, 0.0 -0.935 360.0-177.4-110.6 110.8 24.8 55.1 57.7 121 5 B T - 0 0 134 -2,-0.5 2,-0.5 0, 0.0 0, 0.0 -0.910 16.0-145.3-106.0 138.3 23.2 53.3 54.5 122 6 B Y - 0 0 142 -2,-0.4 2,-0.2 49,-0.1 -2,-0.0 -0.895 10.7-162.7-116.1 129.1 19.5 52.0 54.7 123 7 B E - 0 0 137 -2,-0.5 2,-0.7 1,-0.0 48,-0.0 -0.546 22.1-118.5-101.3 167.2 17.9 49.0 53.2 124 8 B I - 0 0 18 -2,-0.2 5,-0.1 49,-0.0 44,-0.0 -0.900 33.3-126.3-108.6 115.4 14.4 48.0 52.7 125 9 B S > - 0 0 47 -2,-0.7 4,-3.2 1,-0.1 43,-0.0 -0.252 13.0-123.2 -61.1 144.7 13.4 44.8 54.5 126 10 B S T 4 S+ 0 0 60 1,-0.3 4,-0.5 2,-0.2 -1,-0.1 0.760 117.8 49.7 -58.5 -28.0 11.8 41.9 52.6 127 11 B A T >> S+ 0 0 30 2,-0.2 3,-1.5 1,-0.1 4,-0.6 0.936 110.5 49.9 -74.9 -46.7 8.9 42.1 54.9 128 12 B E H >> S+ 0 0 2 1,-0.3 3,-2.0 2,-0.2 4,-1.0 0.889 93.3 75.7 -56.8 -41.9 8.8 45.8 54.3 129 13 B W H 3X S+ 0 0 4 -4,-3.2 4,-2.3 1,-0.3 -1,-0.3 0.766 85.2 64.3 -40.0 -36.9 8.8 45.2 50.5 130 14 B E H <> S+ 0 0 17 -3,-1.5 4,-0.8 -4,-0.5 -1,-0.3 0.927 101.6 51.6 -55.8 -45.0 5.2 44.1 50.7 131 15 B V H XX S+ 0 0 0 -3,-2.0 3,-2.4 -4,-0.6 4,-2.3 0.973 107.5 48.0 -54.9 -63.3 4.3 47.6 51.8 132 16 B X H 3X S+ 0 0 0 -4,-1.0 4,-2.9 1,-0.3 5,-0.5 0.919 103.5 63.4 -45.9 -48.7 6.1 49.5 49.0 133 17 B N H 3< S+ 0 0 12 -4,-2.3 4,-0.5 1,-0.2 -1,-0.3 0.794 108.6 41.6 -49.3 -32.3 4.5 47.2 46.5 134 18 B I H X S+ 0 0 0 -4,-2.3 3,-3.5 1,-0.2 4,-2.1 0.999 114.3 46.8 -60.3 -69.4 2.2 52.1 47.9 136 20 B W H 3< S+ 0 0 19 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.735 111.1 56.2 -39.2 -34.0 3.9 51.9 44.6 137 21 B X H 34 S+ 0 0 110 -4,-0.5 -1,-0.3 -5,-0.5 -2,-0.2 0.682 121.7 25.7 -77.9 -22.5 0.7 50.3 43.4 138 22 B K H << S- 0 0 80 -3,-3.5 2,-4.1 -4,-1.2 -2,-0.2 0.394 84.9-152.2-121.6 1.6 -1.5 53.1 44.5 139 23 B K S < S+ 0 0 166 -4,-2.1 48,-0.6 -5,-0.1 2,-0.4 -0.189 87.3 50.4 61.9 -55.1 1.1 56.0 44.3 140 24 B Y E S+D 186 0C 97 -2,-4.1 2,-0.3 46,-0.1 46,-0.2 -0.835 78.9 171.3-105.8 144.2 -0.9 57.8 47.1 141 25 B A E -D 185 0C 0 44,-0.8 44,-3.3 -2,-0.4 2,-0.1 -0.903 20.1-148.2-163.7 132.5 -1.7 55.6 50.1 142 26 B S E > -D 184 0C 8 42,-0.3 4,-1.3 -2,-0.3 42,-0.2 -0.305 37.4 -92.6 -94.4 179.6 -3.2 55.9 53.6 143 27 B A H >> S+ 0 0 17 40,-0.6 4,-1.0 2,-0.2 3,-1.0 0.977 123.1 19.9 -48.9 -79.5 -2.6 54.2 56.9 144 28 B N H 3> S+ 0 0 71 1,-0.3 4,-2.4 2,-0.2 5,-0.4 0.874 108.6 79.0 -62.2 -41.1 -5.2 51.5 56.7 145 29 B N H 3> S+ 0 0 56 1,-0.3 4,-1.2 2,-0.2 -1,-0.3 0.846 101.8 42.8 -37.8 -40.8 -5.6 51.8 52.9 146 30 B I H X S+ 0 0 3 -4,-1.0 4,-3.9 1,-0.2 3,-1.8 0.942 106.2 52.6 -52.4 -54.8 -3.4 47.3 55.6 148 32 B E H 3< S+ 0 0 114 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.932 112.3 48.3 -46.3 -48.7 -6.7 46.4 54.0 149 33 B E H 3< S+ 0 0 84 -4,-1.2 -1,-0.3 -5,-0.4 4,-0.3 0.525 117.1 40.2 -70.1 -13.2 -4.6 45.7 50.8 150 34 B I H XX S+ 0 0 0 -3,-1.8 2,-4.3 -4,-0.9 4,-1.7 0.750 94.2 83.2-102.2 -36.6 -2.0 43.5 52.7 151 35 B Q T 3< S+ 0 0 98 -4,-3.9 -1,-0.1 1,-0.3 4,-0.1 -0.104 97.4 41.6 -63.5 48.9 -4.6 41.8 54.9 152 36 B X T 34 S+ 0 0 143 -2,-4.3 -1,-0.3 -3,-0.1 -2,-0.1 0.218 115.4 43.5-157.6 -41.2 -5.3 39.3 52.1 153 37 B Q T <4 S+ 0 0 51 -3,-1.1 2,-0.3 -4,-0.3 -2,-0.2 0.450 129.5 19.1 -91.9 -3.6 -1.9 38.5 50.7 154 38 B K < - 0 0 107 -4,-1.7 2,-0.2 2,-0.1 -4,-0.0 -0.931 65.4-132.2-153.5 177.8 -0.6 38.3 54.3 155 39 B D + 0 0 149 -2,-0.3 2,-0.2 -4,-0.1 -4,-0.1 -0.653 50.5 125.9-141.1 78.0 -1.6 37.8 57.9 156 40 B W - 0 0 80 -2,-0.2 -2,-0.1 -9,-0.1 -6,-0.0 -0.527 63.5 -85.7-118.2-171.6 0.0 40.4 60.2 157 41 B S > - 0 0 48 -2,-0.2 4,-2.5 1,-0.1 5,-0.3 -0.811 31.5-119.2-100.4 144.2 -1.5 42.7 62.7 158 42 B P H > S+ 0 0 51 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.632 120.8 49.1 -54.9 -7.4 -2.7 46.1 61.6 159 43 B K H > S+ 0 0 146 2,-0.2 4,-2.4 3,-0.1 5,-0.2 0.849 104.7 54.3 -94.7 -48.2 -0.1 47.3 64.1 160 44 B T H > S+ 0 0 59 1,-0.2 4,-1.4 2,-0.2 -1,-0.0 0.917 114.3 44.8 -49.6 -46.3 2.7 45.2 62.9 161 45 B I H >X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 3,-1.0 0.971 105.3 56.0 -66.4 -55.7 2.1 46.6 59.5 162 46 B R H 3X S+ 0 0 75 -4,-1.0 4,-2.7 1,-0.3 -1,-0.2 0.865 106.4 56.0 -44.2 -38.4 1.7 50.2 60.5 163 47 B T H 3X S+ 0 0 64 -4,-2.4 4,-3.4 1,-0.2 5,-0.3 0.909 102.7 53.7 -58.4 -47.2 5.2 49.8 62.0 164 48 B L H X S+ 0 0 41 -4,-2.7 4,-2.5 1,-0.3 3,-0.7 0.905 111.0 50.1 -39.6 -64.2 6.8 53.9 59.9 167 51 B R H 3X S+ 0 0 139 -4,-3.4 4,-2.8 1,-0.3 5,-0.4 0.940 111.2 50.8 -43.2 -53.3 10.1 52.2 59.7 168 52 B L H 3X>S+ 0 0 0 -4,-2.2 5,-1.7 -5,-0.3 4,-1.0 0.867 110.2 51.9 -53.7 -34.5 10.0 52.8 55.9 169 53 B Y H <<5S+ 0 0 71 -4,-2.4 -1,-0.2 -3,-0.7 -2,-0.2 0.940 112.1 42.4 -68.9 -45.0 9.2 56.4 56.7 170 54 B K H <5S+ 0 0 169 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.785 111.1 55.7 -71.7 -27.3 12.1 56.9 59.0 171 55 B K H <5S- 0 0 62 -4,-2.8 -1,-0.2 -5,-0.4 -2,-0.2 0.803 115.6-126.1 -72.0 -25.8 14.4 55.0 56.6 172 56 B G T <5S+ 0 0 36 -4,-1.0 -3,-0.2 -5,-0.4 -2,-0.1 0.978 74.5 121.7 80.3 59.1 13.2 57.6 54.2 173 57 B F S - 0 0 107 -2,-0.2 4,-2.0 1,-0.1 5,-0.2 -0.710 25.1-137.6 -83.8 125.5 11.6 55.4 42.0 191 75 B E H >> S+ 0 0 66 -2,-0.5 3,-2.6 1,-0.2 4,-2.1 0.904 99.7 35.8 -40.6 -91.9 10.3 51.8 41.7 192 76 B S H 3> S+ 0 0 24 1,-0.3 4,-1.9 2,-0.2 5,-0.3 0.805 115.6 60.8 -34.9 -40.7 12.1 50.4 38.6 193 77 B D H 3> S+ 0 0 91 1,-0.2 4,-0.8 2,-0.2 -1,-0.3 0.879 114.4 32.5 -53.7 -44.3 15.1 52.5 39.8 194 78 B I H X S+ 0 0 12 -4,-2.3 4,-2.9 2,-0.2 3,-1.6 0.977 109.4 48.7 -57.6 -68.7 21.2 40.1 45.2 203 87 B I H 3X S+ 0 0 4 -4,-2.8 4,-0.9 1,-0.3 -1,-0.2 0.897 109.3 55.0 -43.5 -51.0 22.5 38.4 42.1 204 88 B N H 3< S+ 0 0 92 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.743 111.9 43.4 -55.1 -30.3 26.0 39.5 43.0 205 89 B K H << S+ 0 0 60 -3,-1.6 -1,-0.2 -4,-0.9 -2,-0.2 0.823 129.6 27.7 -83.7 -35.6 25.8 37.9 46.4 206 90 B V H < S+ 0 0 0 -4,-2.9 2,-0.3 1,-0.2 -3,-0.2 0.934 116.1 47.4 -89.4 -78.1 24.2 34.8 45.0 207 91 B Y >< - 0 0 2 -4,-0.9 3,-0.7 1,-0.1 -1,-0.2 -0.524 60.7-158.8 -70.5 127.3 25.1 34.1 41.4 208 92 B K T 3 S+ 0 0 86 -2,-0.3 2,-0.2 1,-0.2 -1,-0.1 0.881 87.9 55.3 -73.9 -33.8 28.8 34.3 40.7 209 93 B G T 3> S- 0 0 43 1,-0.2 4,-1.4 2,-0.1 3,-0.3 -0.137 102.4-124.0 -91.9 37.6 28.3 34.8 37.0 210 94 B G H <> - 0 0 30 -3,-0.7 4,-0.9 -2,-0.2 -1,-0.2 0.119 61.7 -29.2 55.4-172.2 26.0 37.8 36.9 211 95 B F H >> S+ 0 0 21 1,-0.2 4,-1.8 2,-0.2 3,-0.7 0.808 134.8 55.8 -45.5 -45.3 22.6 38.1 35.2 212 96 B N H >> S+ 0 0 35 -3,-0.3 4,-2.2 1,-0.2 3,-0.8 0.986 100.1 54.7 -51.8 -74.7 23.4 35.5 32.6 213 97 B S H 3X S+ 0 0 44 -4,-1.4 4,-0.8 1,-0.3 -1,-0.2 0.668 109.4 54.8 -34.0 -25.1 24.4 32.7 34.9 214 98 B L H XX S+ 0 0 1 -4,-0.9 4,-1.5 -3,-0.7 3,-0.6 0.954 105.0 46.1 -79.3 -54.8 20.9 33.2 36.4 215 99 B V H S+ 0 0 2 -4,-1.5 5,-2.4 -3,-0.2 -1,-0.2 0.874 110.7 44.6 -81.4 -33.4 16.1 29.1 35.4 219 103 B V H ><5S+ 0 0 39 -4,-1.7 3,-2.2 3,-0.2 -2,-0.2 0.833 105.7 59.7 -78.7 -30.2 16.0 27.2 32.1 220 104 B E T 3<5S+ 0 0 159 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.752 111.7 44.0 -66.2 -18.8 18.1 24.4 33.5 221 105 B K T 3 5S- 0 0 36 -4,-0.4 -1,-0.3 -5,-0.1 -2,-0.2 0.098 113.5-127.8-108.8 19.8 15.2 24.2 36.0 222 106 B E T < 5 + 0 0 79 -3,-2.2 -3,-0.2 1,-0.2 100,-0.1 0.847 53.9 153.7 33.7 59.5 12.7 24.5 33.1 223 107 B D < + 0 0 18 -5,-2.4 2,-0.4 2,-0.0 -1,-0.2 0.157 49.8 78.8 -96.7 21.0 11.0 27.3 34.8 224 108 B L - 0 0 10 -6,-0.2 2,-0.3 -5,-0.1 103,-0.0 -0.983 63.5-149.5-135.8 137.9 9.8 28.7 31.5 225 109 B S >> - 0 0 1 -2,-0.4 4,-2.7 1,-0.1 3,-2.2 -0.756 32.8-116.8 -98.6 147.5 7.1 27.8 29.0 226 110 B Q H 3> S+ 0 0 42 96,-0.4 4,-1.4 -2,-0.3 5,-0.2 0.797 118.2 64.8 -55.3 -21.2 7.6 28.4 25.3 227 111 B D H 3> S+ 0 0 85 99,-1.8 4,-1.1 98,-0.2 -1,-0.3 0.914 113.4 32.3 -64.7 -36.9 4.7 30.9 25.7 228 112 B E H <> S+ 0 0 52 -3,-2.2 4,-1.8 98,-0.4 -2,-0.2 0.909 111.3 59.5 -82.5 -50.9 7.1 32.9 27.9 229 113 B I H X S+ 0 0 14 -4,-2.7 4,-1.0 1,-0.2 -3,-0.2 0.813 104.7 57.1 -50.8 -28.6 10.4 32.1 26.4 230 114 B E H >X S+ 0 0 97 -4,-1.4 4,-1.4 -5,-0.4 3,-1.0 0.990 99.9 54.7 -65.7 -58.7 8.8 33.7 23.3 231 115 B E H 3< S+ 0 0 86 -4,-1.1 4,-0.3 1,-0.3 5,-0.2 0.844 99.9 63.9 -41.2 -45.7 8.0 37.0 25.0 232 116 B L H >X S+ 0 0 9 -4,-1.8 3,-1.7 1,-0.2 4,-1.1 0.899 100.8 48.5 -49.0 -52.8 11.7 37.3 26.0 233 117 B R H XX S+ 0 0 49 -4,-1.0 3,-1.8 -3,-1.0 4,-0.7 0.961 110.6 49.8 -54.0 -52.8 12.9 37.6 22.5 234 118 B N H 3< S+ 0 0 105 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.471 113.0 50.9 -65.7 2.0 10.3 40.2 21.6 235 119 B I H <4 S+ 0 0 43 -3,-1.7 -1,-0.3 -5,-0.3 -2,-0.3 0.517 102.4 58.2-110.1 -17.6 11.6 41.8 24.7 236 120 B L H << 0 0 14 -3,-1.8 -2,-0.2 -4,-1.1 -3,-0.1 0.467 360.0 360.0 -88.9 -4.8 15.2 41.5 23.6 237 121 B N < 0 0 137 -4,-0.7 -3,-0.1 -5,-0.2 -2,-0.1 0.482 360.0 360.0-129.9 360.0 14.3 43.6 20.4 238 !* 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 0.0 239 5 C T 0 0 179 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 133.3 19.9 11.8 33.6 240 6 C Y - 0 0 170 49,-0.1 2,-0.2 50,-0.0 0, 0.0 -0.846 360.0-161.7-102.6 131.5 17.7 9.2 35.2 241 7 C E - 0 0 133 -2,-0.5 2,-0.6 0, 0.0 48,-0.1 -0.621 20.4-119.5-107.6 169.2 13.9 9.5 35.3 242 8 C I - 0 0 20 -2,-0.2 2,-0.2 49,-0.0 5,-0.0 -0.938 33.1-140.0-109.6 110.6 11.1 7.9 37.3 243 9 C S >> - 0 0 46 -2,-0.6 4,-1.5 1,-0.1 3,-0.7 -0.494 21.9-108.8 -80.7 142.4 8.6 6.1 35.0 244 10 C S T 34 S+ 0 0 64 1,-0.3 4,-0.5 2,-0.2 -1,-0.1 0.632 120.3 51.4 -31.8 -34.9 4.8 6.2 35.5 245 11 C A T >4 S+ 0 0 29 2,-0.2 3,-2.1 1,-0.2 4,-0.4 0.964 107.4 52.6 -71.9 -57.0 4.9 2.6 36.6 246 12 C E T X> S+ 0 0 1 -3,-0.7 3,-3.3 1,-0.3 4,-1.3 0.849 93.9 71.0 -44.7 -44.4 7.5 3.3 39.1 247 13 C W H 3X S+ 0 0 1 -4,-1.5 4,-2.4 1,-0.3 -1,-0.3 0.795 88.0 64.4 -46.9 -34.7 5.6 6.2 40.7 248 14 C E H <> S+ 0 0 14 -3,-2.1 4,-0.8 -4,-0.5 -1,-0.3 0.826 104.1 48.4 -59.9 -28.3 3.2 3.6 42.1 249 15 C V H <> S+ 0 0 0 -3,-3.3 4,-1.7 -4,-0.4 -2,-0.2 0.902 109.9 48.8 -76.5 -48.7 6.1 2.4 44.1 250 16 C X H X S+ 0 0 0 -4,-1.3 4,-3.6 1,-0.2 5,-0.4 0.939 107.4 53.2 -59.4 -51.9 7.4 5.7 45.4 251 17 C N H X S+ 0 0 1 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.871 108.5 51.2 -53.6 -34.1 4.1 6.9 46.6 252 18 C I H X S+ 0 0 7 -4,-0.8 4,-0.8 -5,-0.3 -1,-0.2 0.912 116.4 43.9 -66.4 -39.6 3.7 3.6 48.6 253 19 C I H >X S+ 0 0 0 -4,-1.7 4,-1.0 -3,-0.2 3,-0.8 0.931 113.0 45.9 -69.9 -55.9 7.1 4.3 50.0 254 20 C W H 3< S+ 0 0 20 -4,-3.6 3,-0.2 1,-0.3 -1,-0.2 0.843 109.7 59.9 -59.5 -30.8 6.7 8.0 50.8 255 21 C X H 3< S+ 0 0 113 -4,-1.7 -1,-0.3 -5,-0.4 -2,-0.2 0.835 120.0 24.6 -66.8 -31.0 3.4 7.1 52.3 256 22 C K H << S- 0 0 64 -4,-0.8 2,-5.2 -3,-0.8 -1,-0.2 0.277 88.0-150.3-115.8 10.1 5.0 4.8 54.8 257 23 C K S < S+ 0 0 164 -4,-1.0 48,-0.8 -3,-0.2 2,-0.4 -0.123 86.7 48.8 54.3 -57.9 8.5 6.4 54.9 258 24 C Y E S+F 304 0D 96 -2,-5.2 2,-0.3 46,-0.2 46,-0.2 -0.845 79.5 173.0-104.5 141.6 9.9 3.0 55.7 259 25 C A E -F 303 0D 0 44,-1.6 44,-3.1 -2,-0.4 2,-0.2 -0.987 23.5-136.6-157.8 148.4 8.7 0.0 53.5 260 26 C S E > -F 302 0D 10 -2,-0.3 4,-1.6 42,-0.3 5,-0.2 -0.617 30.8-110.9-101.5 159.2 9.3 -3.7 52.8 261 27 C A H >> S+ 0 0 14 40,-0.7 4,-1.4 -2,-0.2 3,-1.2 0.965 121.6 25.2 -47.7 -72.0 9.6 -5.6 49.5 262 28 C N H 3> S+ 0 0 88 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.875 111.3 71.1 -61.1 -40.0 6.3 -7.4 50.0 263 29 C N H 3> S+ 0 0 57 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.798 104.7 46.1 -47.0 -29.4 4.9 -4.7 52.3 264 30 C I H X S+ 0 0 8 -4,-1.4 4,-3.3 1,-0.3 3,-1.7 0.857 105.5 57.3 -41.3 -45.9 3.3 -5.4 46.8 266 32 C E H 3< S+ 0 0 132 -4,-2.9 -1,-0.3 1,-0.3 3,-0.2 0.968 107.9 45.4 -49.6 -60.1 0.4 -5.8 49.2 267 33 C E H 3< S+ 0 0 105 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.460 118.1 44.9 -65.6 -1.2 -0.5 -2.1 49.0 268 34 C I H XX S+ 0 0 2 -3,-1.7 2,-2.4 -4,-0.8 4,-2.0 0.711 92.3 75.6-111.0 -32.2 -0.2 -2.2 45.3 269 35 C Q T 3< S+ 0 0 90 -4,-3.3 -1,-0.1 -5,-0.3 4,-0.1 -0.224 99.3 49.5 -76.2 52.0 -2.0 -5.4 44.4 270 36 C X T 34 S+ 0 0 171 -2,-2.4 -1,-0.2 -3,-0.2 -2,-0.1 0.271 116.2 35.5-151.6 -37.6 -5.3 -3.6 45.1 271 37 C Q T <4 S+ 0 0 103 -3,-0.9 2,-0.3 -4,-0.2 -2,-0.2 0.476 129.8 29.2-100.8 -7.5 -5.0 -0.4 43.1 272 38 C K < - 0 0 103 -4,-2.0 2,-0.3 2,-0.1 -1,-0.0 -0.905 66.8-131.4-145.6 173.0 -3.1 -2.4 40.4 273 39 C D + 0 0 147 -2,-0.3 2,-0.3 -4,-0.1 -4,-0.1 -0.678 51.1 127.3-129.9 77.6 -2.6 -5.7 38.7 274 40 C W - 0 0 74 -2,-0.3 -2,-0.1 -9,-0.1 -6,-0.0 -0.811 59.4 -94.0-127.7 168.4 1.1 -6.8 38.4 275 41 C S >> - 0 0 57 -2,-0.3 4,-2.5 1,-0.1 3,-0.8 -0.557 31.6-118.1 -83.5 147.1 3.1 -9.8 39.4 276 42 C P H 3> S+ 0 0 59 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.569 121.7 47.7 -58.8 -2.9 4.9 -9.9 42.7 277 43 C K H 3> S+ 0 0 149 2,-0.1 4,-1.4 3,-0.1 5,-0.1 0.685 105.4 54.6-107.0 -27.9 7.9 -10.2 40.4 278 44 C T H <> S+ 0 0 68 -3,-0.8 4,-1.6 2,-0.2 -4,-0.0 0.918 113.4 44.8 -69.0 -44.9 7.1 -7.3 38.1 279 45 C I H >X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 3,-0.9 0.984 106.7 56.1 -61.0 -61.5 6.7 -5.1 41.0 280 46 C R H 3X S+ 0 0 78 -4,-0.5 4,-2.7 -5,-0.3 -1,-0.2 0.853 106.9 53.0 -40.1 -42.3 9.9 -6.2 42.8 281 47 C T H 3X S+ 0 0 64 -4,-1.4 4,-3.5 2,-0.2 -1,-0.3 0.908 102.6 56.1 -64.9 -41.7 11.7 -5.3 39.6 282 48 C L H S+ 0 0 0 -4,-2.5 5,-2.9 1,-0.3 4,-1.7 0.833 110.1 56.1 -46.0 -36.6 14.4 2.5 41.3 287 53 C Y H <5S+ 0 0 70 -4,-2.7 -1,-0.3 3,-0.2 -2,-0.2 0.963 113.0 38.3 -62.7 -51.3 17.0 1.1 43.6 288 54 C K H <5S+ 0 0 162 -4,-3.1 -2,-0.2 -3,-0.4 -1,-0.2 0.926 111.5 56.0 -68.8 -42.1 19.7 1.2 41.0 289 55 C K H <5S- 0 0 55 -4,-3.3 -1,-0.2 -5,-0.3 -2,-0.2 0.866 117.7-121.3 -55.8 -32.2 18.5 4.6 39.5 290 56 C G T <5S+ 0 0 34 -4,-1.7 -3,-0.2 -5,-0.4 -2,-0.1 0.868 75.3 125.0 94.7 44.4 19.1 5.6 43.0 291 57 C F S - 0 0 108 -2,-0.3 4,-1.3 1,-0.1 5,-0.2 -0.670 29.6-141.2 -80.9 119.2 12.4 14.6 48.9 309 75 C E H >> S+ 0 0 64 -2,-0.6 3,-3.3 1,-0.2 4,-1.9 0.907 95.9 35.8 -39.7 -86.9 8.8 14.0 47.8 310 76 C S H 3> S+ 0 0 23 1,-0.3 4,-2.1 2,-0.2 5,-0.3 0.805 112.9 62.0 -38.9 -41.2 7.4 17.5 47.2 311 77 C D H 3> S+ 0 0 68 1,-0.2 4,-0.8 2,-0.2 -1,-0.3 0.781 112.9 34.9 -64.0 -22.7 10.8 18.6 45.9 312 78 C I H X S+ 0 0 10 -4,-2.6 4,-2.3 1,-0.2 3,-1.4 0.942 109.1 53.0 -51.5 -61.7 5.3 17.9 32.1 321 87 C I H 3X S+ 0 0 2 -4,-3.7 4,-0.8 1,-0.3 -1,-0.2 0.902 111.8 46.7 -41.6 -53.3 3.4 21.1 32.1 322 88 C N H 3< S+ 0 0 23 -4,-2.3 -96,-0.4 -5,-0.3 -1,-0.3 0.722 109.6 52.3 -66.1 -23.1 5.9 22.8 29.9 323 89 C K H << S+ 0 0 63 -4,-1.5 -1,-0.2 -3,-1.4 -2,-0.2 0.867 126.9 24.0 -77.0 -36.5 6.1 19.9 27.4 324 90 C V H < S+ 0 0 0 -4,-2.3 2,-0.3 -5,-0.2 -2,-0.2 0.908 115.0 52.1 -90.5 -84.2 2.3 20.0 27.1 325 91 C Y >< - 0 0 5 -4,-0.8 3,-0.7 1,-0.2 -98,-0.2 -0.411 65.8-150.6 -64.8 123.6 0.7 23.3 28.0 326 92 C K T 3 S+ 0 0 51 -2,-0.3 -99,-1.8 1,-0.3 2,-0.8 0.928 91.7 50.0 -57.2 -44.9 2.3 26.2 26.1 327 93 C G T 3> S- 0 0 14 1,-0.2 4,-1.9 -100,-0.2 5,-0.3 -0.448 101.2-124.6-100.0 62.0 1.5 28.6 28.9 328 94 C G H <> - 0 0 12 -2,-0.8 4,-0.8 -3,-0.7 -1,-0.2 0.373 64.7 -25.7 32.3-165.0 2.8 27.0 32.1 329 95 C F H >> S+ 0 0 13 2,-0.2 3,-2.0 1,-0.2 4,-1.9 0.871 134.3 55.3 -40.2 -58.2 0.8 26.4 35.2 330 96 C N H 3> S+ 0 0 23 1,-0.3 4,-2.1 2,-0.2 5,-0.4 0.936 103.2 53.0 -43.5 -72.1 -1.8 29.1 34.6 331 97 C S H 3< S+ 0 0 53 -4,-1.9 -1,-0.3 1,-0.2 4,-0.2 0.656 110.6 53.5 -42.4 -16.2 -2.8 27.9 31.1 332 98 C L H XX S+ 0 0 0 -3,-2.0 3,-2.4 -4,-0.8 4,-0.8 0.952 106.3 45.0 -85.6 -57.9 -3.4 24.6 32.8 333 99 C V H >X S+ 0 0 4 -4,-1.9 3,-1.9 -3,-0.3 4,-1.6 0.915 110.4 56.7 -52.5 -41.9 -5.7 25.5 35.6 334 100 C L H 3X S+ 0 0 74 -4,-2.1 4,-1.5 1,-0.3 -1,-0.3 0.793 103.6 57.4 -59.2 -23.4 -7.6 27.6 33.2 335 101 C N H <> S+ 0 0 23 -3,-2.4 4,-0.6 -5,-0.4 -1,-0.3 0.638 102.2 52.4 -81.3 -17.4 -7.9 24.3 31.3 336 102 C F H <<>S+ 0 0 3 -3,-1.9 5,-3.0 -4,-0.8 6,-0.2 0.815 109.6 48.3 -84.6 -34.3 -9.6 22.5 34.1 337 103 C V H ><5S+ 0 0 44 -4,-1.6 3,-2.4 3,-0.2 -2,-0.2 0.902 105.6 56.8 -70.8 -44.4 -12.3 25.1 34.6 338 104 C E H 3<5S+ 0 0 153 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.881 111.3 45.2 -54.5 -36.6 -13.1 25.2 30.9 339 105 C K T 3<5S- 0 0 58 -4,-0.6 -1,-0.3 -5,-0.1 -2,-0.2 -0.135 111.5-129.0 -99.0 34.7 -13.7 21.5 31.3 340 106 C E T < 5 + 0 0 172 -3,-2.4 -3,-0.2 1,-0.2 -2,-0.1 0.661 54.6 152.4 20.0 52.0 -15.7 22.2 34.4 341 107 C D < + 0 0 47 -5,-3.0 2,-0.4 2,-0.0 -1,-0.2 0.178 47.3 85.8 -90.1 22.5 -13.7 19.6 36.4 342 108 C L - 0 0 32 -6,-0.2 2,-0.3 -5,-0.2 -2,-0.0 -0.977 60.7-153.4-133.0 134.5 -14.3 21.6 39.6 343 109 C S >> - 0 0 51 -2,-0.4 4,-2.9 1,-0.1 3,-1.3 -0.742 31.5-118.2 -97.4 144.6 -17.1 21.7 42.2 344 110 C Q H 3> S+ 0 0 115 -2,-0.3 4,-1.0 1,-0.3 5,-0.1 0.728 114.1 65.0 -53.0 -24.0 -17.8 24.8 44.3 345 111 C D H 3> S+ 0 0 141 2,-0.2 4,-0.9 1,-0.1 -1,-0.3 0.925 114.0 29.4 -64.7 -43.8 -17.0 22.6 47.4 346 112 C E H <> S+ 0 0 97 -3,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.845 110.1 65.2 -87.6 -35.3 -13.4 22.3 46.2 347 113 C I H X S+ 0 0 20 -4,-2.9 4,-1.0 1,-0.2 -1,-0.2 0.819 101.0 57.9 -55.5 -29.4 -13.1 25.6 44.3 348 114 C E H >X S+ 0 0 96 -4,-1.0 4,-1.2 -5,-0.3 3,-1.0 0.995 98.0 55.3 -62.4 -64.4 -13.5 27.1 47.8 349 115 C E H 3< S+ 0 0 100 -4,-0.9 4,-0.3 1,-0.3 5,-0.2 0.838 98.6 66.6 -38.1 -44.8 -10.5 25.3 49.4 350 116 C L H >X S+ 0 0 8 -4,-1.6 3,-2.9 1,-0.2 4,-1.8 0.914 98.4 48.5 -47.1 -57.7 -8.3 26.8 46.6 351 117 C R H X< S+ 0 0 49 -3,-1.0 3,-1.3 -4,-1.0 -1,-0.2 0.945 112.5 48.4 -47.2 -56.4 -8.7 30.4 47.7 352 118 C N T 3< S+ 0 0 120 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.440 113.5 50.3 -64.9 0.2 -7.9 29.3 51.3 353 119 C I T <4 S+ 0 0 48 -3,-2.9 -1,-0.3 -4,-0.3 -2,-0.3 0.556 100.2 60.7-108.5 -19.6 -5.0 27.5 49.8 354 120 C L << 0 0 12 -4,-1.8 -2,-0.2 -3,-1.3 -3,-0.1 0.186 360.0 360.0 -92.4 20.9 -3.8 30.5 47.8 355 121 C N 0 0 114 -5,-0.2 -2,-0.2 -201,-0.0 -3,-0.2 0.449 360.0 360.0-149.0 360.0 -3.4 32.0 51.2 356 !* 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 0.0 357 7 D E 0 0 187 0, 0.0 2,-0.6 0, 0.0 48,-0.0 0.000 360.0 360.0 360.0 163.5 -0.9 6.7 24.2 358 8 D I - 0 0 19 49,-0.0 2,-0.1 4,-0.0 5,-0.1 -0.928 360.0-129.8-110.5 114.3 0.7 9.9 22.9 359 9 D S > - 0 0 46 -2,-0.6 4,-2.7 1,-0.1 3,-0.2 -0.332 13.9-119.9 -68.7 142.7 4.4 10.1 23.7 360 10 D S H > S+ 0 0 62 1,-0.3 4,-0.6 2,-0.2 -1,-0.1 0.749 117.1 47.6 -45.7 -36.2 6.1 13.1 25.2 361 11 D A H >4 S+ 0 0 33 2,-0.2 3,-1.1 1,-0.2 4,-0.4 0.912 110.8 52.0 -76.1 -42.2 8.3 13.5 22.1 362 12 D E H >> S+ 0 0 5 1,-0.2 3,-2.7 -3,-0.2 4,-1.2 0.919 94.1 72.6 -59.2 -40.0 5.3 13.1 19.9 363 13 D W H 3X S+ 0 0 3 -4,-2.7 4,-2.2 1,-0.3 -1,-0.2 0.830 85.4 68.8 -40.7 -40.4 3.5 15.9 21.8 364 14 D E H S+ 0 0 0 -3,-2.7 4,-2.4 -4,-0.4 3,-0.9 0.962 107.4 55.1 -72.2 -54.4 4.2 17.6 16.8 366 16 D X H 3X S+ 0 0 1 -4,-1.2 4,-3.3 1,-0.3 5,-0.3 0.864 104.3 57.7 -46.4 -40.3 0.6 17.7 17.9 367 17 D N H 3X S+ 0 0 9 -4,-2.2 4,-1.4 1,-0.2 -1,-0.3 0.924 107.9 47.5 -56.6 -44.0 1.3 21.1 19.3 368 18 D I H X S+ 0 0 0 -4,-2.4 3,-2.0 1,-0.2 4,-1.9 0.980 113.4 47.9 -60.4 -57.1 -0.6 20.7 14.2 370 20 D W H 3< S+ 0 0 25 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.743 110.3 56.4 -52.2 -27.6 -3.1 22.1 16.7 371 21 D X H 3< S+ 0 0 111 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.767 121.5 26.3 -73.4 -31.4 -1.3 25.4 16.3 372 22 D K H << S- 0 0 77 -3,-2.0 2,-4.1 -4,-1.4 -2,-0.2 0.400 84.3-152.5-114.1 0.7 -1.9 25.2 12.6 373 23 D K S < S+ 0 0 169 -4,-1.9 48,-0.6 -5,-0.1 2,-0.3 -0.222 87.3 44.6 60.6 -62.4 -5.2 23.1 12.3 374 24 D Y E S+I 420 0F 79 -2,-4.1 2,-0.3 46,-0.1 46,-0.2 -0.708 81.1 177.4-101.5 159.4 -4.0 21.9 8.9 375 25 D A E -I 419 0F 3 44,-0.8 44,-2.9 -2,-0.3 2,-0.2 -0.885 18.7-144.6-170.7 137.4 -0.4 20.9 8.4 376 26 D S E > -I 418 0F 10 -2,-0.3 4,-2.2 42,-0.2 5,-0.2 -0.645 33.4-102.5-107.2 160.8 2.0 19.5 5.9 377 27 D A H >> S+ 0 0 20 40,-0.7 4,-1.3 -2,-0.2 3,-1.0 0.900 121.0 22.2 -35.3 -81.8 5.0 17.2 6.0 378 28 D N H 3> S+ 0 0 82 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.871 113.6 71.4 -60.2 -39.6 7.7 19.7 5.9 379 29 D N H 3> S+ 0 0 62 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.808 103.3 45.1 -49.7 -32.1 5.5 22.5 7.2 380 30 D I H X S+ 0 0 4 -4,-1.3 4,-3.6 1,-0.2 3,-2.2 0.864 105.8 52.7 -39.7 -58.5 9.4 20.1 10.4 382 32 D E H 3< S+ 0 0 121 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.935 110.2 47.7 -48.3 -53.5 10.3 23.8 9.7 383 33 D E H 3< S+ 0 0 95 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.519 118.1 43.9 -69.6 -2.2 8.3 24.9 12.7 384 34 D I H XX S+ 0 0 2 -3,-2.2 2,-3.0 -4,-0.6 3,-1.2 0.746 92.4 78.3-107.3 -39.4 10.0 22.2 14.8 385 35 D Q T 3< S+ 0 0 89 -4,-3.6 -1,-0.1 1,-0.2 4,-0.1 -0.207 99.0 44.3 -69.8 52.0 13.6 22.6 13.7 386 36 D X T 34 S+ 0 0 163 -2,-3.0 -1,-0.2 -3,-0.1 -2,-0.1 0.239 113.8 43.3-159.1 -33.8 14.1 25.6 15.9 387 37 D Q T <4 S+ 0 0 62 -3,-1.2 2,-0.3 -4,-0.1 -2,-0.2 0.365 129.8 18.3-103.0 1.2 12.5 24.6 19.2 388 38 D K < - 0 0 100 -4,-1.1 2,-0.2 2,-0.1 -4,-0.0 -0.932 69.0-130.8-157.4 174.7 14.1 21.2 18.8 389 39 D D + 0 0 150 -2,-0.3 2,-0.2 -4,-0.1 -4,-0.1 -0.654 48.5 129.7-140.7 82.0 16.9 19.4 17.0 390 40 D W - 0 0 71 -2,-0.2 -2,-0.1 -6,-0.0 -6,-0.0 -0.728 60.5 -87.2-121.8 176.6 15.9 16.2 15.3 391 41 D S > - 0 0 57 -2,-0.2 4,-2.7 1,-0.1 3,-0.4 -0.626 32.6-121.6 -86.6 143.8 16.3 14.7 11.9 392 42 D P H > S+ 0 0 49 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.782 118.9 50.2 -52.8 -23.7 13.7 15.5 9.3 393 43 D K H > S+ 0 0 143 2,-0.2 4,-2.0 3,-0.1 5,-0.1 0.858 105.3 53.3 -82.6 -37.5 13.3 11.8 9.1 394 44 D T H > S+ 0 0 57 -3,-0.4 4,-1.8 2,-0.2 3,-0.2 0.969 112.2 47.7 -57.5 -53.2 13.0 11.3 12.9 395 45 D I H >X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.3 3,-1.7 0.972 106.8 53.2 -49.8 -66.7 10.2 13.9 12.8 396 46 D R H 3X S+ 0 0 81 -4,-1.8 4,-2.6 1,-0.3 -1,-0.3 0.832 106.8 56.4 -38.6 -41.4 8.4 12.4 9.9 397 47 D T H 3X S+ 0 0 62 -4,-2.0 4,-2.9 1,-0.2 -1,-0.3 0.901 102.1 54.2 -61.8 -42.4 8.5 9.1 11.9 398 48 D L H S+ 0 0 0 -4,-2.4 5,-2.1 1,-0.3 4,-1.5 0.869 111.7 52.0 -55.7 -40.1 0.6 9.5 15.4 403 53 D Y H <5S+ 0 0 83 -4,-3.3 -1,-0.3 1,-0.2 -2,-0.2 0.940 114.0 44.9 -59.8 -44.5 -1.2 8.8 12.1 404 54 D K H <5S+ 0 0 161 -4,-3.2 -2,-0.2 -5,-0.3 -1,-0.2 0.817 109.9 52.3 -67.2 -37.7 -1.0 5.1 13.0 405 55 D K H <5S- 0 0 86 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.769 116.5-120.6 -70.6 -24.6 -2.1 5.6 16.6 406 56 D G T <5S+ 0 0 37 -4,-1.5 -3,-0.2 -5,-0.3 -2,-0.1 0.859 78.0 121.4 88.5 38.1 -5.0 7.5 15.1 407 57 D F S - 0 0 105 -2,-0.3 4,-1.2 1,-0.1 3,-0.3 -0.650 26.7-139.6 -80.3 123.9 -10.0 17.5 20.3 425 75 D E H >> S+ 0 0 66 -2,-0.5 3,-2.9 1,-0.2 4,-2.2 0.937 96.8 37.9 -42.0 -84.9 -7.1 19.4 22.0 426 76 D S H 3> S+ 0 0 27 1,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.711 113.8 61.3 -46.9 -22.2 -8.5 20.7 25.3 427 77 D D H 3> S+ 0 0 89 -3,-0.3 4,-0.7 2,-0.1 -1,-0.3 0.811 112.8 35.5 -75.6 -28.9 -10.4 17.4 25.5 428 78 D I H X S+ 0 0 14 -4,-2.4 4,-2.7 2,-0.2 3,-1.7 0.980 108.0 44.7 -53.8 -73.0 -0.8 12.1 35.2 437 87 D I H 3X S+ 0 0 4 -4,-2.7 4,-1.4 1,-0.3 -1,-0.2 0.915 112.8 57.2 -39.9 -48.8 -1.6 13.9 38.4 438 88 D N H 3< S+ 0 0 100 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.768 108.8 43.5 -53.5 -36.7 -3.3 10.6 39.4 439 89 D K H << S+ 0 0 64 -3,-1.7 -1,-0.2 -4,-1.3 -2,-0.2 0.815 131.0 24.6 -81.1 -32.7 -0.1 8.6 39.0 440 90 D V H < S+ 0 0 0 -4,-2.7 2,-0.5 1,-0.2 -2,-0.2 0.933 113.7 54.3 -96.2 -68.2 2.0 11.3 40.7 441 91 D Y < - 0 0 2 -4,-1.4 3,-0.5 -5,-0.2 -1,-0.2 -0.602 63.6-156.5 -73.8 120.1 0.0 13.5 43.1 442 92 D K S S+ 0 0 83 -2,-0.5 2,-0.9 1,-0.3 -1,-0.2 0.872 87.2 54.0 -63.7 -38.6 -1.9 11.4 45.7 443 93 D G S > S- 0 0 36 1,-0.3 4,-1.9 2,-0.1 5,-0.3 -0.477 103.2-118.4 -99.9 66.5 -4.4 14.1 46.3 444 94 D G T 4 - 0 0 33 -2,-0.9 4,-0.4 -3,-0.5 -1,-0.3 0.296 66.9 -31.7 34.1-165.1 -5.8 15.0 43.0 445 95 D F T >> S+ 0 0 20 1,-0.2 3,-2.0 2,-0.2 4,-1.9 0.863 134.6 59.6 -47.6 -47.3 -5.5 18.5 41.4 446 96 D N H >> S+ 0 0 34 1,-0.3 4,-2.2 2,-0.2 3,-0.5 0.959 97.1 55.6 -46.0 -75.1 -5.5 20.2 44.8 447 97 D S H 3< S+ 0 0 43 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.541 109.7 53.8 -40.0 -10.4 -2.5 18.6 46.2 448 98 D L H X> S+ 0 0 1 -3,-2.0 4,-1.9 -4,-0.4 3,-1.4 0.887 104.8 46.3 -91.0 -58.0 -0.7 19.9 43.1 449 99 D V H XX S+ 0 0 6 -4,-1.9 4,-1.8 -3,-0.5 3,-0.5 0.928 112.4 56.4 -49.3 -41.6 -1.6 23.6 43.2 450 100 D L H 3X S+ 0 0 66 -4,-2.2 4,-1.3 1,-0.3 -1,-0.3 0.813 103.8 52.6 -58.9 -32.5 -0.5 23.2 46.8 451 101 D N H <> S+ 0 0 18 -3,-1.4 4,-0.5 -5,-0.4 -1,-0.3 0.818 106.2 54.2 -75.0 -29.2 2.8 21.9 45.7 452 102 D F H <<>S+ 0 0 2 -4,-1.9 5,-3.0 -3,-0.5 6,-0.3 0.847 108.5 46.1 -75.1 -32.6 3.3 24.9 43.4 453 103 D V H ><5S+ 0 0 43 -4,-1.8 3,-1.8 3,-0.2 -1,-0.2 0.861 106.8 58.8 -75.5 -34.6 2.8 27.5 46.1 454 104 D E H 3<5S+ 0 0 148 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.651 111.8 40.8 -70.3 -16.8 5.0 25.7 48.6 455 105 D K T 3<5S- 0 0 40 -4,-0.5 -1,-0.3 -3,-0.2 -2,-0.2 0.070 114.3-125.7-114.5 19.2 7.9 26.0 46.0 456 106 D E T < 5 + 0 0 66 -3,-1.8 -3,-0.2 1,-0.2 -372,-0.1 0.863 55.5 152.7 39.3 62.9 6.7 29.5 45.3 457 107 D D < + 0 0 16 -5,-3.0 2,-0.5 1,-0.1 -1,-0.2 0.284 50.2 81.3-102.8 15.9 6.3 29.0 41.6 458 108 D L - 0 0 10 -6,-0.3 2,-0.3 -5,-0.2 -1,-0.1 -0.955 63.1-152.2-129.5 125.8 3.7 31.7 41.5 459 109 D S >> - 0 0 3 -2,-0.5 4,-2.7 1,-0.1 3,-2.2 -0.647 31.2-117.9 -90.4 147.0 3.9 35.5 41.3 460 110 D Q H 3> S+ 0 0 43 -376,-0.4 4,-1.8 1,-0.3 5,-0.2 0.803 118.8 62.9 -54.8 -25.3 1.2 37.6 42.7 461 111 D D H 3> S+ 0 0 93 -373,-2.9 4,-1.1 1,-0.2 -1,-0.3 0.910 114.4 36.4 -62.2 -35.1 0.7 38.9 39.2 462 112 D E H <> S+ 0 0 49 -3,-2.2 4,-1.5 -374,-0.5 -2,-0.3 0.882 111.0 55.1 -81.3 -49.7 -0.1 35.3 38.5 463 113 D I H X S+ 0 0 14 -4,-2.7 4,-1.2 1,-0.2 -3,-0.2 0.837 104.9 60.6 -58.5 -28.6 -1.9 34.2 41.6 464 114 D E H >X S+ 0 0 104 -4,-1.8 4,-1.0 -5,-0.4 3,-1.0 0.995 97.7 53.6 -61.0 -63.1 -4.2 37.1 40.8 465 115 D E H 3< S+ 0 0 89 -4,-1.1 4,-0.2 1,-0.3 -1,-0.2 0.812 101.0 65.6 -39.7 -40.7 -5.3 35.9 37.4 466 116 D L H >X S+ 0 0 5 -4,-1.5 3,-2.7 2,-0.2 4,-1.7 0.941 97.7 50.2 -50.0 -57.9 -6.3 32.6 39.1 467 117 D R H X< S+ 0 0 55 -4,-1.2 3,-2.8 -3,-1.0 4,-0.4 0.961 111.9 46.4 -47.9 -61.8 -9.1 34.1 41.2 468 118 D N T 3< S+ 0 0 119 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.472 112.3 54.3 -62.2 3.5 -10.7 35.9 38.3 469 119 D I T <4 S+ 0 0 31 -3,-2.7 -1,-0.3 -5,-0.3 -2,-0.3 0.547 103.6 55.3-104.3 -23.3 -10.2 32.4 36.6 470 120 D L << 0 0 14 -3,-2.8 -2,-0.2 -4,-1.7 -3,-0.1 0.321 360.0 360.0 -90.5 3.4 -12.0 30.9 39.4 471 121 D N 0 0 143 -4,-0.4 -3,-0.2 -5,-0.2 -2,-0.1 0.353 360.0 360.0-145.1 360.0 -15.1 33.2 38.9