==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER COMPLEX (POLYMERASE/INHIBITOR) 02-JUN-98 1BGX . COMPND 2 MOLECULE: TAQ DNA POLYMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS AQUATICUS; . AUTHOR R.MURALI,D.J.SHARKEY,J.L.DAISS,H.M.KRISHNA MURTHY . 1247 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53749.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 673 54.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 179 14.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.6 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 . 120 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 80 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 233 18.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.2 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 11 0 1 6 4 0 2 3 2 0 2 1 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 13 6 8 1 8 1 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 5 3 7 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 T M 0 0 9 0, 0.0 715,-0.1 0, 0.0 139,-0.1 0.000 360.0 360.0 360.0 117.1 16.8 80.8 -30.9 2 2 T R + 0 0 4 713,-0.2 715,-0.2 710,-0.1 2,-0.1 0.602 360.0 107.2 26.5 162.4 14.9 82.5 -28.1 3 3 T G + 0 0 2 713,-0.5 -1,-0.1 714,-0.1 138,-0.1 -0.246 17.0 163.4 119.8 154.7 12.7 85.6 -28.6 4 4 T M S S+ 0 0 12 1,-0.4 713,-0.1 -2,-0.1 137,-0.0 0.206 73.0 38.7-167.3 -33.1 9.0 86.4 -28.8 5 5 T L S S- 0 0 21 45,-0.0 -1,-0.4 155,-0.0 154,-0.1 -0.991 86.5-102.8-135.0 140.5 8.8 90.2 -28.4 6 6 T P + 0 0 5 0, 0.0 2,-0.2 0, 0.0 44,-0.1 -0.106 58.2 114.9 -59.9 163.2 11.0 93.0 -29.8 7 7 T L - 0 0 12 11,-0.4 2,-0.2 43,-0.1 11,-0.2 -0.883 28.8-179.5 157.5-177.3 13.7 94.9 -27.8 8 8 T F + 0 0 11 -2,-0.2 10,-0.2 9,-0.2 7,-0.1 -0.905 25.9 102.1 166.8 163.1 17.5 95.4 -27.7 9 9 T E - 0 0 2 8,-1.7 8,-0.2 -2,-0.2 -1,-0.2 0.680 43.3-135.2 105.4 105.6 20.8 96.9 -26.2 10 10 T P + 0 0 4 0, 0.0 53,-1.1 0, 0.0 2,-0.2 0.304 25.5 163.1 -62.2-161.8 23.4 95.2 -23.9 11 11 T K > - 0 0 15 3,-0.3 3,-1.7 51,-0.2 2,-0.2 -0.525 54.5 -65.9 143.7 144.9 25.3 96.3 -20.6 12 12 T G T 3 S+ 0 0 4 1,-0.3 48,-0.5 -2,-0.2 49,-0.3 -0.474 120.2 4.1 -57.1 131.2 27.1 94.3 -18.0 13 13 T R T 3 S+ 0 0 116 122,-2.8 -1,-0.3 1,-0.3 2,-0.2 0.378 119.6 92.9 69.4 6.4 24.9 91.9 -16.0 14 14 T V S < S- 0 0 6 -3,-1.7 -1,-0.3 121,-0.3 -3,-0.3 -0.549 88.4 -64.6-117.9 179.3 22.0 93.0 -18.1 15 15 T L - 0 0 7 -5,-0.2 2,-0.3 -2,-0.2 -1,-0.1 -0.334 32.5-153.7 -63.2 144.7 20.3 91.8 -21.3 16 16 T L + 0 0 1 121,-0.8 -1,-0.1 -6,-0.2 46,-0.0 -0.527 34.3 165.4-121.1 66.0 22.3 91.8 -24.6 17 17 T V - 0 0 2 -2,-0.3 -8,-1.7 -8,-0.2 2,-0.3 -0.169 28.5-134.3 -82.5 169.3 19.4 92.1 -27.2 18 18 T D - 0 0 4 -11,-0.2 -11,-0.4 -10,-0.2 4,-0.2 -0.960 5.6-159.7-124.6 143.9 19.3 93.1 -30.9 19 19 T G + 0 0 5 -2,-0.3 48,-0.2 -13,-0.1 59,-0.1 -0.212 69.2 84.4-118.5 44.1 17.0 95.5 -32.8 20 20 T H S > S+ 0 0 6 46,-0.1 3,-0.8 56,-0.1 4,-0.5 0.823 99.9 20.9-104.2 -68.8 17.3 94.3 -36.4 21 21 T H T 3> S+ 0 0 40 1,-0.2 4,-1.1 2,-0.2 -2,-0.1 0.594 109.0 78.1 -80.7 -10.7 14.9 91.4 -37.1 22 22 T L H 3> S+ 0 0 4 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.542 92.7 50.9 -76.2 -7.2 12.6 92.2 -34.1 23 23 T A H <4 S+ 0 0 0 -3,-0.8 -1,-0.2 2,-0.2 -2,-0.2 0.726 109.6 50.2 -96.3 -28.6 11.0 95.1 -36.1 24 24 T Y H > S+ 0 0 107 -4,-0.5 4,-0.7 1,-0.1 3,-0.2 0.679 107.1 58.0 -80.5 -21.5 10.3 92.7 -39.0 25 25 T R H >< S+ 0 0 26 -4,-1.1 3,-0.6 1,-0.2 4,-0.3 0.938 104.6 45.2 -74.2 -53.5 8.7 90.2 -36.6 26 26 T T T 3< S+ 0 0 6 -4,-0.7 -1,-0.2 1,-0.2 -2,-0.1 0.368 107.5 61.0 -74.7 1.5 5.9 92.3 -35.1 27 27 T F T 34 S+ 0 0 34 -3,-0.2 -1,-0.2 -4,-0.1 -2,-0.2 0.715 105.3 45.4 -96.0 -29.2 4.9 93.6 -38.5 28 28 T H S << S+ 0 0 98 -4,-0.7 2,-0.3 -3,-0.6 -2,-0.2 0.420 121.3 43.7 -92.0 1.3 4.1 90.2 -39.9 29 29 T A S S+ 0 0 26 -4,-0.3 694,-0.1 1,-0.1 13,-0.0 -0.871 102.2 31.4-139.9 165.0 2.2 89.4 -36.7 30 30 T L > + 0 0 18 -2,-0.3 3,-1.0 1,-0.1 -1,-0.1 0.673 66.8 156.3 54.3 29.6 -0.3 91.1 -34.3 31 31 T K T 3 + 0 0 147 1,-0.3 -1,-0.1 -3,-0.1 11,-0.1 0.586 53.1 77.6 -58.5 -19.5 -1.7 93.0 -37.4 32 32 T G T 3 + 0 0 59 10,-0.1 2,-0.7 1,-0.0 -1,-0.3 0.190 68.7 103.6 -81.1 18.9 -5.1 93.6 -35.7 33 33 T L < + 0 0 18 -3,-1.0 8,-1.3 0, 0.0 2,-0.3 -0.891 42.1 138.3-109.4 108.0 -3.8 96.4 -33.4 34 34 T T B -A 40 0A 96 -2,-0.7 2,-0.1 6,-0.2 -2,-0.0 -0.930 45.3-107.8-140.4 161.3 -4.8 100.0 -34.5 35 35 T T - 0 0 18 4,-1.7 242,-0.1 -2,-0.3 241,-0.0 -0.298 33.6-104.9 -85.3 174.1 -6.0 103.2 -32.9 36 36 T S S S+ 0 0 102 1,-0.2 -1,-0.1 2,-0.1 241,-0.0 0.658 118.0 47.1 -72.9 -17.7 -9.5 104.9 -33.0 37 37 T R S S- 0 0 159 2,-0.1 -1,-0.2 0, 0.0 -3,-0.0 0.869 122.7 -91.4 -88.1 -52.1 -8.2 107.5 -35.5 38 38 T G S S+ 0 0 63 1,-0.2 -2,-0.1 0, 0.0 -4,-0.0 0.525 76.5 133.3 141.4 26.0 -6.4 105.4 -38.1 39 39 T E - 0 0 67 2,-0.0 -4,-1.7 237,-0.0 -1,-0.2 -0.900 55.3-121.1-104.1 129.1 -2.7 105.3 -37.0 40 40 T P B +A 34 0A 40 0, 0.0 -6,-0.2 0, 0.0 -9,-0.0 -0.515 38.6 161.9 -70.5 134.7 -1.0 101.9 -37.0 41 41 T V + 0 0 2 -8,-1.3 4,-0.4 -2,-0.2 -7,-0.1 -0.121 34.5 115.3-145.9 38.0 0.4 100.8 -33.6 42 42 T Q S S+ 0 0 19 1,-0.1 -10,-0.1 2,-0.1 -8,-0.1 0.616 91.9 26.3 -85.7 -14.6 1.0 97.0 -34.0 43 43 T A S S+ 0 0 7 -10,-0.1 3,-0.4 2,-0.1 -1,-0.1 0.489 113.1 64.1-122.1 -14.7 4.8 97.2 -33.6 44 44 T V S > S+ 0 0 11 1,-0.2 3,-0.8 2,-0.1 -2,-0.1 0.654 92.0 70.5 -83.5 -16.2 5.1 100.4 -31.5 45 45 T Y T 3 S+ 0 0 25 -4,-0.4 3,-0.3 1,-0.2 4,-0.3 0.684 79.1 75.3 -74.8 -21.4 3.2 98.6 -28.7 46 46 T G T 3> S+ 0 0 9 -3,-0.4 4,-0.8 1,-0.2 5,-0.3 0.365 78.0 75.9 -79.3 9.7 6.1 96.2 -27.8 47 47 T F H <> S+ 0 0 20 -3,-0.8 4,-1.2 1,-0.1 -1,-0.2 0.936 94.2 41.8 -84.9 -51.8 8.2 98.7 -26.0 48 48 T A H 4 S+ 0 0 26 -3,-0.3 -1,-0.1 1,-0.2 -2,-0.1 0.451 119.3 45.3 -79.0 0.5 6.5 99.2 -22.6 49 49 T K H > S+ 0 0 37 -4,-0.3 4,-1.5 3,-0.1 -1,-0.2 0.792 112.4 42.6-108.5 -46.0 5.8 95.5 -22.1 50 50 T S H X S+ 0 0 0 -4,-0.8 4,-1.3 2,-0.2 5,-0.1 0.914 115.0 47.7 -70.2 -46.8 9.0 93.6 -23.0 51 51 T L H < S+ 0 0 17 -4,-1.2 4,-0.5 -5,-0.3 -1,-0.2 0.643 112.4 54.3 -69.4 -15.2 11.5 95.9 -21.3 52 52 T L H 4 S+ 0 0 27 2,-0.2 4,-0.2 -5,-0.2 3,-0.2 0.842 101.8 55.3 -83.8 -39.7 9.1 95.7 -18.2 53 53 T K H >< S+ 0 0 80 -4,-1.5 3,-0.5 1,-0.2 -2,-0.2 0.818 111.3 45.5 -63.4 -32.9 9.2 91.9 -18.2 54 54 T A G >X S+ 0 0 3 -4,-1.3 4,-1.7 1,-0.2 3,-1.1 0.696 97.6 71.5 -84.2 -22.5 13.0 92.0 -17.9 55 55 T L G 34 S+ 0 0 61 -4,-0.5 -1,-0.2 1,-0.2 -2,-0.2 0.482 84.9 69.2 -73.5 -4.7 13.1 94.7 -15.3 56 56 T K G <4 S+ 0 0 121 -3,-0.5 -1,-0.2 -4,-0.2 -2,-0.1 0.713 110.2 33.5 -81.9 -27.0 11.8 92.2 -12.7 57 57 T E T <4 S+ 0 0 80 -3,-1.1 -2,-0.2 -4,-0.2 -1,-0.1 0.721 106.2 175.5 -93.1 -33.1 15.2 90.4 -12.9 58 58 T D < - 0 0 81 -4,-1.7 2,-0.2 2,-0.0 -2,-0.1 0.455 20.7-180.0 46.6 173.6 17.0 93.7 -13.5 59 59 T G - 0 0 23 1,-0.2 -45,-0.1 -4,-0.1 -46,-0.1 -0.756 45.2 -58.3-167.1-142.2 20.6 94.9 -13.8 60 60 T D S S- 0 0 46 -48,-0.5 201,-0.4 1,-0.3 2,-0.2 0.925 87.5 -43.1 -89.0 -73.2 22.6 98.1 -14.4 61 61 T A - 0 0 7 -49,-0.3 2,-0.3 199,-0.1 -1,-0.3 -0.716 39.6-127.6-147.3-171.9 21.7 99.8 -17.7 62 62 T V - 0 0 14 45,-0.2 47,-2.1 -2,-0.2 -51,-0.2 -0.962 15.1-161.9-149.5 136.5 20.8 99.5 -21.5 63 63 T I - 0 0 14 -53,-1.1 2,-0.3 -2,-0.3 47,-0.2 -0.178 19.4-125.2-100.7-163.5 22.3 101.3 -24.5 64 64 T V + 0 0 0 -2,-0.1 47,-2.3 44,-0.1 2,-0.3 -0.927 26.7 170.9-154.2 128.9 20.7 101.6 -28.1 65 65 T V - 0 0 11 -2,-0.3 2,-0.2 45,-0.2 47,-0.2 -0.892 14.0-150.0-133.2 165.0 21.9 100.7 -31.7 66 66 T F - 0 0 22 -2,-0.3 47,-0.2 45,-0.2 2,-0.1 -0.605 28.7 -88.9-123.1-178.4 20.4 100.5 -35.2 67 67 T D - 0 0 4 -2,-0.2 50,-0.1 -48,-0.2 -1,-0.1 -0.456 24.5-175.6 -90.3 165.6 21.0 98.5 -38.4 68 68 T A + 0 0 22 -2,-0.1 47,-0.2 46,-0.1 49,-0.1 -0.033 39.6 127.7-151.6 30.5 23.4 99.4 -41.2 69 69 T K S S- 0 0 67 2,-0.1 3,-0.3 47,-0.1 7,-0.1 -0.246 72.0-100.3 -83.8 175.0 22.8 96.7 -43.8 70 70 T A S S+ 0 0 77 1,-0.2 2,-0.8 16,-0.1 -1,-0.1 0.807 113.7 48.0 -70.6 -37.6 22.0 97.3 -47.5 71 71 T P S S+ 0 0 71 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 -0.726 81.1 122.3-108.1 82.7 18.2 96.8 -47.3 72 72 T S + 0 0 0 -2,-0.8 14,-0.5 -3,-0.3 16,-0.1 -0.741 12.1 111.3-147.2 97.3 17.1 99.0 -44.3 73 73 T F S S+ 0 0 81 -2,-0.2 -1,-0.1 12,-0.2 7,-0.1 0.408 97.7 42.3-126.6 -28.9 14.6 101.9 -44.2 74 74 T R S S+ 0 0 34 2,-0.1 3,-0.2 3,-0.1 -2,-0.1 0.767 119.0 43.6 -88.6 -34.4 12.2 99.8 -42.2 75 75 T H S > S+ 0 0 21 1,-0.2 3,-0.6 2,-0.1 -3,-0.1 0.949 117.4 39.3 -78.5 -56.0 14.8 98.3 -39.8 76 76 T E G > S+ 0 0 7 1,-0.2 3,-1.0 -10,-0.1 -1,-0.2 0.125 82.4 105.8 -86.4 24.2 17.0 101.3 -39.0 77 77 T A G > + 0 0 3 1,-0.2 3,-1.0 -3,-0.2 -1,-0.2 0.515 56.5 85.5 -79.1 -6.1 14.1 103.8 -38.7 78 78 T Y G < S+ 0 0 25 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.469 105.6 26.3 -71.6 -5.5 14.5 103.7 -34.9 79 79 T G G <> S+ 0 0 0 -3,-1.0 4,-1.9 5,-0.1 3,-0.3 -0.147 75.3 133.8-153.1 48.3 17.1 106.5 -35.4 80 80 T G T <4 S+ 0 0 27 -3,-1.0 -2,-0.1 1,-0.2 4,-0.1 0.838 79.5 47.9 -68.4 -36.5 16.3 108.3 -38.6 81 81 T Y T 4 S+ 0 0 188 -4,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.580 117.6 46.1 -79.7 -12.1 16.7 111.7 -37.1 82 82 T K T 4 S- 0 0 50 -3,-0.3 2,-0.3 1,-0.2 -2,-0.2 0.914 121.4 -51.5 -92.6 -71.2 20.0 110.6 -35.6 83 83 T A S < S+ 0 0 43 -4,-1.9 -1,-0.2 -7,-0.2 -2,-0.1 -0.952 83.2 66.2-171.4 149.9 22.0 108.7 -38.4 84 84 T G + 0 0 33 -2,-0.3 2,-0.3 -4,-0.1 -1,-0.1 0.269 35.7 177.5 105.4 136.1 21.7 105.9 -40.9 85 85 T R + 0 0 110 2,-0.0 -12,-0.2 -17,-0.0 -1,-0.1 -0.949 9.6 152.9-170.6 143.5 19.7 105.2 -44.1 86 86 T A - 0 0 16 -14,-0.5 2,-0.4 -2,-0.3 -16,-0.1 -0.919 45.9 -77.7-158.9 174.0 19.2 102.6 -46.9 87 87 T P + 0 0 104 0, 0.0 -14,-0.1 0, 0.0 -13,-0.0 -0.738 59.1 117.5-102.1 138.2 16.4 101.6 -49.3 88 88 T T - 0 0 46 -2,-0.4 -2,-0.1 -16,-0.1 -16,-0.1 -0.916 63.3 -41.5-170.5 166.4 13.2 99.4 -48.7 89 89 T P > - 0 0 76 0, 0.0 3,-0.5 0, 0.0 -16,-0.1 0.124 40.9-131.6 -42.1 153.9 9.3 99.9 -48.7 90 90 T E T 3 S+ 0 0 156 1,-0.2 4,-0.2 2,-0.1 0, 0.0 0.513 86.6 82.8 -87.5 -6.4 7.4 103.0 -47.4 91 91 T D T 3 S+ 0 0 98 1,-0.1 -1,-0.2 2,-0.1 4,-0.1 0.711 98.1 35.5 -74.4 -20.7 4.6 101.3 -45.3 92 92 T F S X> S+ 0 0 3 -3,-0.5 3,-1.6 1,-0.1 4,-0.8 0.802 91.9 79.2-107.5 -29.0 6.7 100.8 -42.1 93 93 T P T 34 S+ 0 0 31 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.538 87.8 63.9 -61.1 -2.0 9.2 103.8 -41.6 94 94 T R T >4 S+ 0 0 99 -4,-0.2 3,-0.6 2,-0.1 -2,-0.1 0.781 96.9 55.3 -88.4 -29.6 6.4 106.0 -40.2 95 95 T Q G X4 S+ 0 0 2 -3,-1.6 3,-1.1 1,-0.2 4,-0.2 0.864 99.1 56.9 -72.1 -40.7 5.7 103.8 -37.1 96 96 T L G 3X S+ 0 0 3 -4,-0.8 4,-0.9 1,-0.3 3,-0.4 0.431 85.0 84.3 -74.2 0.1 9.3 103.8 -35.7 97 97 T A G <4 S+ 0 0 23 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.387 86.9 56.5 -82.2 3.0 9.3 107.6 -35.6 98 98 T L T <> S+ 0 0 23 -3,-1.1 4,-0.6 2,-0.1 -1,-0.2 0.619 102.1 50.9-106.4 -21.2 7.5 107.4 -32.2 99 99 T I H > S+ 0 0 10 -3,-0.4 4,-0.7 -4,-0.2 -2,-0.2 0.777 91.5 75.4 -89.0 -27.9 10.0 105.2 -30.3 100 100 T K H < S+ 0 0 13 -4,-0.9 4,-0.4 1,-0.2 -1,-0.2 0.715 101.4 42.4 -57.1 -26.0 13.2 107.2 -31.1 101 101 T E H >> S+ 0 0 64 -3,-0.2 4,-0.6 2,-0.1 3,-0.5 0.843 107.6 58.5 -88.9 -36.3 12.2 109.9 -28.5 102 102 T L H 3X S+ 0 0 2 -4,-0.6 4,-0.5 1,-0.2 -2,-0.2 0.504 92.4 76.2 -72.5 -4.4 11.0 107.5 -25.8 103 103 T V H ><>S+ 0 0 3 -4,-0.7 5,-1.0 1,-0.2 3,-0.7 0.959 99.8 36.0 -69.3 -55.6 14.6 106.0 -25.9 104 104 T D H <45S+ 0 0 72 -3,-0.5 3,-0.2 -4,-0.4 161,-0.2 0.536 107.7 70.0 -79.4 -8.4 16.3 108.8 -24.0 105 105 T L H 3<5S+ 0 0 12 -4,-0.6 160,-1.6 1,-0.2 -1,-0.2 0.684 94.2 52.3 -83.3 -23.1 13.3 109.3 -21.7 106 106 T L T <<5S- 0 0 54 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.1 0.485 124.1 -99.3 -90.1 -3.8 13.6 106.0 -19.8 107 107 T G T 5S+ 0 0 2 1,-0.3 155,-1.6 -3,-0.2 2,-0.3 0.788 74.4 146.2 90.4 32.9 17.3 106.8 -19.0 108 108 T L < - 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0 0 19 -4,-2.5 3,-1.5 3,-0.1 -1,-0.3 -0.850 57.1-151.5-158.0 116.1 -1.1 79.4 -19.5 382 382 T P T 3 S+ 0 0 2 0, 0.0 -4,-0.1 0, 0.0 3,-0.1 0.428 90.1 77.3 -68.9 -1.0 -3.2 76.4 -20.7 383 383 T S T 3 S+ 0 0 30 -6,-0.2 2,-1.3 1,-0.2 711,-0.2 0.733 79.3 75.7 -79.4 -22.2 -1.9 74.3 -17.8 384 384 T N < + 0 0 7 -3,-1.5 -1,-0.2 -7,-0.3 -3,-0.1 -0.647 48.8 135.0 -93.8 78.9 -4.3 76.1 -15.5 385 385 T T + 0 0 2 -2,-1.3 183,-0.3 -3,-0.1 -1,-0.2 -0.046 52.8 82.7-113.5 30.7 -7.7 74.4 -16.4 386 386 T T S > S- 0 0 0 709,-0.1 4,-1.2 708,-0.1 5,-0.2 -0.972 73.2-135.9-135.5 148.6 -8.9 73.9 -12.7 387 387 T P T 4 S+ 0 0 4 0, 0.0 4,-0.4 0, 0.0 710,-0.1 0.692 113.3 46.8 -75.3 -15.2 -10.5 76.1 -10.0 388 388 T E T > S+ 0 0 1 708,-0.3 4,-2.4 2,-0.1 5,-0.2 0.837 107.2 53.9 -88.2 -44.2 -8.0 74.6 -7.6 389 389 T G H > S+ 0 0 7 1,-0.2 4,-0.8 2,-0.2 5,-0.2 0.698 105.4 52.9 -66.2 -25.9 -4.9 75.1 -9.8 390 390 T V H X S+ 0 0 0 -4,-1.2 4,-1.2 2,-0.1 -1,-0.2 0.825 114.0 44.4 -78.0 -32.3 -5.4 78.8 -10.3 391 391 T A H > S+ 0 0 0 -4,-0.4 4,-1.5 -5,-0.2 -2,-0.2 0.965 113.9 44.9 -75.3 -55.6 -5.7 79.3 -6.6 392 392 T R H < S+ 0 0 62 -4,-2.4 -1,-0.2 3,-0.2 4,-0.2 0.696 117.1 45.7 -63.2 -25.4 -2.8 77.2 -5.3 393 393 T R H < S+ 0 0 135 -4,-0.8 -1,-0.2 -5,-0.2 -2,-0.2 0.889 119.3 36.8 -86.6 -44.2 -0.3 78.5 -7.9 394 394 T Y H < S- 0 0 78 -4,-1.2 -2,-0.2 -5,-0.2 -3,-0.1 0.538 132.5 -72.0 -88.4 -6.2 -1.1 82.3 -7.7 395 395 T G S < S+ 0 0 33 -4,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.630 93.1 59.9 112.7 89.1 -1.7 82.4 -3.9 396 396 T G - 0 0 26 -4,-0.2 2,-0.3 -8,-0.1 -1,-0.2 -0.960 60.8-107.1 159.4-171.3 -4.8 80.9 -2.3 397 397 T E - 0 0 92 -2,-0.3 2,-0.5 7,-0.1 706,-0.1 -0.940 15.0-127.4-147.0 163.7 -6.8 77.7 -1.7 398 398 T W + 0 0 13 704,-0.4 2,-0.1 -2,-0.3 706,-0.1 -0.959 33.7 179.2-121.3 106.5 -10.1 76.0 -2.8 399 399 T T - 0 0 10 -2,-0.5 702,-0.1 2,-0.3 0, 0.0 -0.207 39.4-112.9 -93.4-174.2 -12.4 74.9 0.1 400 400 T E S S+ 0 0 101 -2,-0.1 2,-0.3 -90,-0.0 701,-0.1 0.563 89.6 88.6 -97.0 -13.7 -15.8 73.2 0.3 401 401 T E S > S- 0 0 53 1,-0.1 4,-1.0 -91,-0.1 3,-0.5 -0.682 71.0-142.1 -89.6 140.0 -17.6 76.3 1.8 402 402 T A H > S+ 0 0 0 -2,-0.3 4,-1.4 1,-0.2 -77,-0.2 0.754 95.2 65.1 -71.0 -28.3 -19.1 79.0 -0.4 403 403 T G H > S+ 0 0 1 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.804 107.1 39.8 -65.9 -33.5 -18.0 81.9 1.9 404 404 T E H 4 S+ 0 0 81 -3,-0.5 4,-0.4 2,-0.2 -1,-0.2 0.728 113.9 54.5 -86.4 -27.0 -14.3 81.3 1.4 405 405 T R H X S+ 0 0 15 -4,-1.0 4,-1.1 2,-0.2 -54,-0.3 0.711 105.0 52.9 -78.1 -25.5 -14.7 80.6 -2.4 406 406 T A H X S+ 0 0 0 -4,-1.4 4,-0.6 1,-0.2 -1,-0.2 0.864 108.5 50.3 -75.9 -38.7 -16.5 83.8 -3.1 407 407 T A H X S+ 0 0 4 -4,-0.7 4,-0.7 1,-0.2 -2,-0.2 0.639 105.8 59.0 -72.2 -17.9 -13.7 85.8 -1.4 408 408 T L H > S+ 0 0 0 -4,-0.4 4,-2.3 1,-0.2 3,-0.3 0.856 96.2 59.2 -78.9 -38.5 -11.2 83.9 -3.6 409 409 T S H < S+ 0 0 0 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.714 101.8 56.3 -63.1 -24.8 -12.7 85.0 -6.9 410 410 T E H X S+ 0 0 43 -4,-0.6 4,-1.4 -104,-0.2 3,-0.3 0.870 112.1 40.3 -74.9 -39.2 -12.1 88.7 -5.9 411 411 T R H X S+ 0 0 21 -4,-0.7 4,-1.4 -3,-0.3 -2,-0.2 0.809 110.0 56.8 -79.8 -35.5 -8.4 88.2 -5.4 412 412 T L H X S+ 0 0 1 -4,-2.3 4,-0.6 2,-0.2 -1,-0.2 0.534 108.7 50.7 -73.5 -8.4 -7.8 85.8 -8.4 413 413 T F H > S+ 0 0 30 -3,-0.3 4,-2.3 -5,-0.2 5,-0.3 0.854 106.2 53.5 -91.6 -43.7 -9.2 88.7 -10.5 414 414 T A H < S+ 0 0 58 -4,-1.4 4,-0.5 1,-0.2 -2,-0.2 0.772 115.6 39.3 -59.9 -32.6 -6.9 91.3 -9.0 415 415 T N H X S+ 0 0 13 -4,-1.4 4,-0.6 2,-0.1 -1,-0.2 0.838 120.3 40.9 -88.7 -37.6 -3.8 89.3 -9.8 416 416 T L H X S+ 0 0 1 -4,-0.6 4,-0.7 -5,-0.2 -2,-0.2 0.720 108.7 59.0 -85.2 -25.4 -4.7 87.9 -13.2 417 417 T W H X S+ 0 0 65 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.843 102.1 55.5 -72.7 -32.7 -6.3 91.1 -14.7 418 418 T G H 4 S+ 0 0 20 -4,-0.5 4,-0.5 -5,-0.3 -1,-0.2 0.857 109.9 45.2 -67.1 -35.4 -3.1 93.0 -14.1 419 419 T R H < S+ 0 0 92 -4,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.645 113.7 51.4 -80.5 -17.8 -1.2 90.4 -16.2 420 420 T L H >< S+ 0 0 0 -4,-0.7 3,-1.3 1,-0.1 -2,-0.2 0.705 97.1 65.6 -91.0 -24.6 -3.9 90.5 -18.9 421 421 T E T 3< S+ 0 0 74 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.1 0.738 98.1 55.0 -68.8 -24.6 -4.0 94.3 -19.3 422 422 T G T 3 S+ 0 0 6 -4,-0.5 2,-0.5 1,-0.2 -1,-0.3 0.416 100.2 71.8 -86.1 -0.3 -0.5 94.2 -20.7 423 423 T E <> + 0 0 33 -3,-1.3 4,-1.0 1,-0.1 3,-0.3 -0.892 53.6 174.0-120.4 98.7 -1.8 91.7 -23.2 424 424 T E H > S+ 0 0 63 -2,-0.5 4,-0.9 1,-0.2 -1,-0.1 0.742 80.6 59.4 -72.7 -27.3 -4.0 93.2 -25.9 425 425 T R H > S+ 0 0 34 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.771 109.3 43.4 -72.3 -27.9 -4.2 90.0 -27.9 426 426 T L H > S+ 0 0 0 -3,-0.3 4,-0.5 -6,-0.2 -2,-0.2 0.700 106.7 60.2 -89.9 -23.0 -5.7 88.1 -24.9 427 427 T L H X S+ 0 0 12 -4,-1.0 4,-1.6 2,-0.2 5,-0.2 0.765 104.6 50.7 -73.1 -27.4 -8.1 91.0 -24.0 428 428 T W H X>S+ 0 0 115 -4,-0.9 4,-1.8 1,-0.2 5,-0.5 0.830 110.5 49.5 -76.1 -35.0 -9.7 90.6 -27.5 429 429 T L H <>S+ 0 0 0 -4,-0.6 5,-2.7 3,-0.2 -2,-0.2 0.585 113.6 46.6 -79.0 -12.2 -10.1 86.9 -26.8 430 430 T Y H <>S+ 0 0 1 -4,-0.5 5,-1.7 3,-0.2 -2,-0.2 0.773 119.6 35.7 -98.4 -32.5 -11.7 87.6 -23.4 431 431 T R H <5S+ 0 0 141 -4,-1.6 -2,-0.2 3,-0.1 -3,-0.2 0.850 130.2 28.0 -89.8 -39.6 -14.2 90.3 -24.5 432 432 T E T <5S+ 0 0 96 -4,-1.8 -3,-0.2 -5,-0.2 -2,-0.1 0.731 135.0 20.1 -96.1 -25.3 -15.2 89.0 -27.9 433 433 T V T >> S+ 0 0 1 -3,-0.8 4,-1.0 -4,-0.3 3,-0.7 0.888 110.2 48.3 -83.7 -44.8 -24.1 80.1 -25.2 441 441 T L H 3X S+ 0 0 0 -4,-2.2 4,-1.0 1,-0.2 123,-0.3 0.739 105.0 62.0 -67.3 -26.2 -22.8 76.9 -23.4 442 442 T A H 3X S+ 0 0 2 -4,-0.7 4,-1.0 -5,-0.2 -1,-0.2 0.790 104.3 47.6 -70.6 -29.6 -25.1 77.7 -20.4 443 443 T H H <> S+ 0 0 65 -3,-0.7 4,-1.7 -4,-0.4 5,-0.4 0.739 106.7 54.7 -84.0 -26.2 -28.2 77.3 -22.7 444 444 T M H X S+ 0 0 5 -4,-1.0 4,-0.7 2,-0.2 118,-0.4 0.760 113.4 43.1 -76.7 -27.6 -27.1 74.0 -24.3 445 445 T E H < S+ 0 0 2 -4,-1.0 -2,-0.2 116,-0.2 -1,-0.2 0.774 114.7 50.0 -86.4 -32.0 -26.7 72.4 -20.9 446 446 T A H < S+ 0 0 11 -4,-1.0 -2,-0.2 -5,-0.1 -3,-0.1 0.856 121.3 31.1 -76.0 -39.2 -29.9 73.8 -19.5 447 447 T T H < S- 0 0 41 -4,-1.7 112,-0.2 -5,-0.1 -3,-0.2 0.950 91.1-178.8 -84.0 -61.1 -32.2 72.8 -22.4 448 448 T G < - 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0 0 101 -5,-2.1 2,-0.4 -6,-0.1 -1,-0.2 -0.457 57.3 -83.9-103.2 173.8 -12.0 71.9 -56.3 637 637 T D > - 0 0 58 -2,-0.2 4,-1.8 1,-0.1 3,-0.2 -0.684 26.7-154.6 -82.6 132.3 -11.1 68.8 -54.3 638 638 T I H > S+ 0 0 1 -2,-0.4 4,-1.4 1,-0.2 5,-0.2 0.887 92.5 54.8 -74.0 -37.2 -7.8 69.0 -52.3 639 639 T H H > S+ 0 0 23 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.682 113.4 43.5 -71.1 -18.5 -7.1 65.2 -52.2 640 640 T T H > S+ 0 0 28 -3,-0.2 4,-0.8 2,-0.1 -2,-0.2 0.863 111.5 50.7 -92.3 -44.3 -7.3 65.0 -56.0 641 641 T E H X S+ 0 0 5 -4,-1.8 4,-1.2 1,-0.2 -2,-0.2 0.724 106.5 56.9 -66.9 -24.7 -5.3 68.2 -56.9 642 642 T T H X S+ 0 0 0 -4,-1.4 4,-0.9 1,-0.2 3,-0.4 0.956 106.8 46.9 -71.3 -49.2 -2.4 67.1 -54.6 643 643 T A H X S+ 0 0 0 -4,-0.6 4,-1.3 1,-0.2 6,-0.4 0.654 107.3 61.3 -66.6 -18.2 -1.9 63.7 -56.4 644 644 T S H X>S+ 0 0 8 -4,-0.8 4,-1.2 1,-0.2 5,-0.9 0.907 107.8 39.3 -75.1 -45.6 -2.0 65.6 -59.7 645 645 T W H <5S+ 0 0 85 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.567 114.5 57.4 -82.2 -10.0 1.0 67.8 -59.1 646 646 T M H <5S+ 0 0 13 -4,-0.9 -2,-0.2 -5,-0.1 -3,-0.1 0.933 118.7 23.4 -84.7 -54.8 3.0 65.0 -57.4 647 647 T F H <5S- 0 0 71 -4,-1.3 -2,-0.2 2,-0.1 -3,-0.1 0.727 106.7-115.1 -85.7 -25.5 3.1 62.3 -60.1 648 648 T G T <5S+ 0 0 66 -4,-1.2 -3,-0.2 1,-0.3 -4,-0.1 0.769 70.6 127.2 93.2 32.1 2.5 64.6 -63.1 649 649 T V < - 0 0 48 -5,-0.9 -1,-0.3 -6,-0.4 -2,-0.1 -0.750 61.6 -96.9-114.8 160.4 -0.9 63.3 -64.2 650 650 T P > - 0 0 73 0, 0.0 3,-1.1 0, 0.0 4,-0.2 -0.336 34.4-107.1 -77.8 165.8 -4.1 65.2 -64.9 651 651 T R T 3 S+ 0 0 97 1,-0.2 3,-0.4 2,-0.2 -8,-0.1 0.730 118.3 50.4 -60.4 -25.4 -7.0 65.6 -62.4 652 652 T E T 3 S+ 0 0 156 1,-0.2 -1,-0.2 -8,-0.0 -8,-0.0 0.591 102.8 57.9 -89.5 -16.6 -9.2 63.2 -64.3 653 653 T A S < S+ 0 0 57 -3,-1.1 2,-0.5 2,-0.1 -1,-0.2 0.259 77.2 119.6 -97.5 10.4 -6.7 60.4 -64.7 654 654 T V - 0 0 28 -3,-0.4 -10,-0.1 -4,-0.2 -3,-0.0 -0.699 49.0-160.7 -82.1 117.7 -6.3 60.1 -60.9 655 655 T D > - 0 0 73 -2,-0.5 4,-1.7 1,-0.0 3,-0.5 -0.430 35.6 -95.5 -91.4 169.6 -7.3 56.6 -59.7 656 656 T P T 4 S+ 0 0 117 0, 0.0 4,-0.4 0, 0.0 -2,-0.0 0.561 120.1 61.3 -64.5 -5.8 -8.3 55.5 -56.1 657 657 T L T > S+ 0 0 112 2,-0.2 4,-1.3 3,-0.1 5,-0.1 0.882 108.4 38.8 -84.7 -44.1 -4.7 54.4 -55.4 658 658 T M H > S+ 0 0 33 -3,-0.5 4,-1.1 1,-0.2 5,-0.1 0.793 113.1 55.8 -76.3 -31.2 -3.0 57.8 -55.9 659 659 T R H X S+ 0 0 85 -4,-1.7 4,-1.1 2,-0.2 -1,-0.2 0.755 107.5 51.5 -71.4 -26.4 -5.9 59.7 -54.1 660 660 T R H > S+ 0 0 148 -4,-0.4 4,-1.4 -5,-0.2 -2,-0.2 0.878 107.3 51.4 -75.3 -41.6 -5.4 57.4 -51.1 661 661 T A H < S+ 0 0 4 -4,-1.3 4,-0.4 1,-0.2 -2,-0.2 0.752 112.2 47.1 -66.8 -28.8 -1.7 58.1 -51.0 662 662 T A H X S+ 0 0 1 -4,-1.1 4,-2.0 -23,-0.2 3,-0.2 0.770 106.2 58.4 -83.2 -29.6 -2.4 61.9 -51.1 663 663 T K H X S+ 0 0 104 -4,-1.1 4,-1.0 1,-0.2 -2,-0.2 0.813 101.8 54.9 -69.7 -32.2 -5.1 61.7 -48.4 664 664 T T H X S+ 0 0 30 -4,-1.4 4,-0.7 2,-0.2 -1,-0.2 0.744 111.6 43.9 -73.4 -25.2 -2.6 60.1 -45.9 665 665 T I H > S+ 0 0 13 -4,-0.4 4,-2.0 -3,-0.2 -2,-0.2 0.842 110.3 54.6 -87.0 -37.2 -0.2 63.1 -46.3 666 666 T N H < S+ 0 0 1 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.1 0.697 116.2 38.5 -68.7 -23.2 -3.0 65.7 -46.2 667 667 T F H >< S+ 0 0 125 -4,-1.0 3,-0.5 -5,-0.1 4,-0.3 0.685 115.3 55.0 -96.4 -25.2 -4.2 64.3 -42.8 668 668 T G H >< S+ 0 0 2 -4,-0.7 3,-1.2 1,-0.2 4,-0.5 0.770 92.2 69.2 -78.3 -26.4 -0.6 63.7 -41.7 669 669 T V T 3< S+ 0 0 17 -4,-2.0 -1,-0.2 1,-0.2 -3,-0.1 0.700 84.6 73.6 -65.3 -19.1 0.6 67.3 -42.2 670 670 T L T < S+ 0 0 5 -3,-0.5 -1,-0.2 1,-0.2 83,-0.2 0.815 117.5 17.2 -63.0 -36.1 -1.6 68.4 -39.3 671 671 T Y S < S- 0 0 47 -3,-1.2 2,-1.3 -4,-0.3 -1,-0.2 0.183 109.8-117.5-121.2 11.2 0.8 66.8 -36.8 672 672 T G - 0 0 32 -4,-0.5 -4,-0.1 77,-0.2 -2,-0.1 -0.420 40.7-159.7 87.5 -62.8 3.8 66.6 -39.3 673 673 T M - 0 0 33 -2,-1.3 2,-0.3 -4,-0.1 -8,-0.0 0.048 8.4-112.9 69.5 174.0 4.2 62.8 -39.3 674 674 T S > - 0 0 22 1,-0.0 4,-1.7 0, 0.0 5,-0.1 -0.896 21.4-108.1-137.8 168.8 7.3 60.8 -40.4 675 675 T A H > S+ 0 0 4 -2,-0.3 4,-0.7 1,-0.2 14,-0.1 0.658 119.6 53.6 -71.7 -18.3 8.4 58.4 -43.2 676 676 T H H > S+ 0 0 104 2,-0.2 4,-0.5 1,-0.1 -1,-0.2 0.827 110.5 44.5 -83.1 -36.9 8.3 55.5 -40.7 677 677 T R H > S+ 0 0 106 1,-0.2 4,-1.0 2,-0.2 3,-0.2 0.791 112.6 52.4 -76.6 -30.3 4.8 56.2 -39.6 678 678 T L H X S+ 0 0 7 -4,-1.7 4,-1.4 1,-0.2 6,-0.2 0.783 104.6 56.8 -75.7 -27.3 3.6 56.8 -43.2 679 679 T S H < S+ 0 0 23 -4,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.686 104.9 52.2 -76.6 -21.5 5.1 53.4 -44.2 680 680 T Q H < S+ 0 0 143 -4,-0.5 -1,-0.2 -3,-0.2 -2,-0.2 0.789 109.2 47.8 -84.4 -31.5 3.0 51.6 -41.6 681 681 T E H < S+ 0 0 103 -4,-1.0 -2,-0.2 3,-0.0 2,-0.2 0.827 118.0 38.9 -77.4 -35.9 -0.3 53.1 -42.8 682 682 T L S < S- 0 0 18 -4,-1.4 -21,-0.0 2,-0.2 0, 0.0 -0.532 83.1-115.9-109.2 176.2 0.3 52.3 -46.5 683 683 T A S S+ 0 0 97 -2,-0.2 -4,-0.1 2,-0.0 -3,-0.1 0.386 79.8 114.7 -91.0 1.1 1.8 49.4 -48.5 684 684 T I - 0 0 29 -6,-0.2 -2,-0.2 1,-0.1 5,-0.1 -0.526 67.9-116.2 -75.9 134.0 4.6 51.8 -49.7 685 685 T P > - 0 0 73 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 -0.017 23.8-102.2 -64.8 175.0 8.2 51.0 -48.6 686 686 T Y H > S+ 0 0 79 1,-0.2 4,-0.7 2,-0.2 -485,-0.1 0.920 120.0 42.5 -65.6 -49.2 10.6 53.1 -46.3 687 687 T E H 4 S+ 0 0 111 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.750 116.0 49.7 -71.8 -25.1 12.8 54.4 -49.2 688 688 T E H >> S+ 0 0 99 1,-0.2 4,-0.8 2,-0.2 3,-0.5 0.758 100.8 64.2 -84.5 -25.8 9.8 55.2 -51.4 689 689 T A H 3X S+ 0 0 0 -4,-1.5 4,-0.6 1,-0.2 -2,-0.2 0.766 94.2 60.5 -68.5 -28.8 7.9 57.0 -48.6 690 690 T Q H 3X S+ 0 0 17 -4,-0.7 4,-1.1 1,-0.2 3,-0.3 0.797 100.1 54.9 -68.7 -32.1 10.5 59.8 -48.5 691 691 T A H <> S+ 0 0 43 -3,-0.5 4,-2.1 -4,-0.4 -1,-0.2 0.800 100.8 59.4 -71.6 -30.9 9.9 60.7 -52.1 692 692 T F H < S+ 0 0 18 -4,-0.8 4,-0.3 1,-0.2 -1,-0.2 0.738 106.2 47.7 -69.4 -25.8 6.2 61.2 -51.4 693 693 T I H X S+ 0 0 47 -4,-0.6 4,-1.0 -3,-0.3 -1,-0.2 0.768 111.7 50.9 -84.7 -29.5 7.0 63.9 -48.8 694 694 T E H X S+ 0 0 35 -4,-1.1 4,-1.4 2,-0.2 -2,-0.2 0.864 105.7 53.1 -74.8 -39.4 9.4 65.6 -51.2 695 695 T R H X S+ 0 0 104 -4,-2.1 4,-0.9 1,-0.2 -1,-0.2 0.697 106.9 56.1 -67.6 -20.6 6.9 65.8 -54.1 696 696 T Y H > S+ 0 0 3 -4,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.836 110.2 43.0 -78.0 -36.8 4.6 67.5 -51.6 697 697 T F H < S+ 0 0 26 -4,-1.0 7,-0.2 2,-0.2 -2,-0.2 0.650 109.8 56.8 -83.4 -19.4 7.1 70.2 -50.9 698 698 T Q H < S+ 0 0 141 -4,-1.4 -1,-0.2 1,-0.1 -2,-0.2 0.804 113.9 39.8 -78.9 -32.3 8.1 70.7 -54.6 699 699 T S H < S+ 0 0 16 -4,-0.9 -2,-0.2 1,-0.3 -3,-0.1 0.818 125.7 37.6 -83.5 -35.4 4.4 71.4 -55.4 700 700 T F X + 0 0 0 -4,-1.5 4,-0.7 1,-0.1 -1,-0.3 -0.860 68.2 169.5-119.7 91.5 3.8 73.5 -52.3 701 701 T P H >> S+ 0 0 65 0, 0.0 4,-1.3 0, 0.0 3,-0.6 0.901 73.9 53.0 -69.0 -46.7 7.0 75.5 -51.5 702 702 T K H 3> S+ 0 0 87 1,-0.2 4,-1.0 2,-0.2 -77,-0.1 0.637 99.6 65.0 -66.0 -16.4 5.7 77.9 -48.8 703 703 T V H 3> S+ 0 0 0 -3,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.863 101.9 48.0 -74.7 -35.8 4.4 74.9 -46.7 704 704 T R H >S+ 0 0 16 -4,-0.4 2,-2.6 1,-0.2 4,-1.5 0.955 113.7 46.4 -76.5 -66.2 11.6 78.4 -35.3 713 713 T E H <5S+ 0 0 37 -4,-2.6 -1,-0.2 1,-0.2 8,-0.2 -0.323 119.5 40.7 -76.7 62.7 8.6 79.9 -33.4 714 714 T G H >5S+ 0 0 1 -2,-2.6 4,-1.6 -3,-0.4 -1,-0.2 0.113 110.8 46.0-166.7 -58.8 8.3 76.9 -31.1 715 715 T R H <5S+ 0 0 23 -4,-1.0 -713,-0.2 -3,-0.2 -2,-0.2 0.711 130.1 30.6 -72.4 -20.2 11.7 75.6 -29.9 716 716 T R T <5S+ 0 0 7 -4,-1.5 -713,-0.5 -715,-0.1 -3,-0.2 0.772 120.6 48.9-105.8 -38.1 12.6 79.3 -29.3 717 717 T R T 4 + 0 0 17 -12,-2.1 3,-0.5 -2,-0.6 -12,-0.1 -0.908 21.2 174.6-139.1 105.5 5.5 73.7 -23.6 731 731 T P G > + 0 0 55 0, 0.0 3,-0.6 0, 0.0 -12,-0.1 0.327 63.6 95.1 -92.3 8.4 9.2 73.7 -22.7 732 732 T D G 3 + 0 0 13 1,-0.2 3,-0.2 -14,-0.1 12,-0.2 0.570 55.4 91.2 -72.3 -13.8 9.6 70.1 -24.0 733 733 T L G < S+ 0 0 6 -3,-0.5 -1,-0.2 1,-0.2 2,-0.1 0.338 85.9 51.3 -68.5 8.4 10.8 71.3 -27.4 734 734 T E S < S+ 0 0 13 -3,-0.6 2,-0.3 -563,-0.1 -1,-0.2 -0.644 80.1 142.5-146.6 75.9 14.4 71.1 -26.1 735 735 T A - 0 0 14 -3,-0.2 6,-0.1 -2,-0.1 -3,-0.0 -0.864 50.5-135.0-119.7 160.2 15.0 67.6 -24.6 736 736 T R S S+ 0 0 182 -2,-0.3 2,-0.1 4,-0.0 -1,-0.1 0.901 82.3 75.3 -79.7 -45.7 17.8 65.0 -24.5 737 737 T V S > S- 0 0 87 1,-0.1 4,-1.6 2,-0.0 3,-0.5 -0.441 76.9-134.5 -73.4 142.3 15.9 61.8 -25.3 738 738 T K H > S+ 0 0 109 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.785 104.2 55.5 -66.5 -28.7 14.8 61.1 -28.9 739 739 T S H > S+ 0 0 72 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.722 108.1 46.6 -78.7 -23.2 11.3 60.1 -27.7 740 740 T V H > S+ 0 0 31 -3,-0.5 4,-0.8 2,-0.2 -2,-0.2 0.844 112.8 47.2 -87.9 -37.0 10.6 63.3 -25.8 741 741 T R H X S+ 0 0 22 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.846 111.3 50.7 -72.6 -35.5 11.7 65.8 -28.5 742 742 T E H X S+ 0 0 31 -4,-1.3 4,-1.4 1,-0.2 -1,-0.2 0.843 110.2 49.8 -70.3 -36.1 9.8 64.0 -31.3 743 743 T A H < S+ 0 0 26 -4,-0.6 4,-0.4 1,-0.2 -1,-0.2 0.725 110.4 52.3 -74.1 -23.7 6.6 64.0 -29.3 744 744 T A H X S+ 0 0 9 -4,-0.8 4,-0.8 -12,-0.2 3,-0.5 0.830 106.6 50.3 -79.9 -39.0 7.1 67.7 -28.6 745 745 T E H X S+ 0 0 12 -4,-1.6 4,-1.1 1,-0.2 3,-0.4 0.852 104.0 60.6 -67.6 -34.6 7.5 68.7 -32.2 746 746 T R H < S+ 0 0 47 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.743 107.8 45.0 -63.4 -25.6 4.3 66.8 -33.0 747 747 T M H > S+ 0 0 39 -3,-0.5 4,-0.7 -4,-0.4 3,-0.5 0.630 101.3 70.5 -93.8 -16.0 2.5 69.2 -30.7 748 748 T A H >< S+ 0 0 1 -4,-0.8 3,-0.8 -3,-0.4 -2,-0.2 0.982 107.3 30.3 -65.4 -63.1 4.1 72.4 -32.0 749 749 T F T 3< S+ 0 0 19 -4,-1.1 -1,-0.2 1,-0.2 -77,-0.2 0.181 109.8 73.7 -85.5 21.1 2.5 72.6 -35.5 750 750 T N T 3> S+ 0 0 15 -3,-0.5 4,-1.7 -79,-0.1 5,-0.2 0.654 89.7 55.3-103.9 -24.0 -0.7 71.0 -34.2 751 751 T M H S+ 0 0 0 -83,-0.2 4,-1.3 3,-0.1 -2,-0.2 0.904 124.8 30.9 -94.6 -59.0 -4.1 74.3 -37.2 754 754 T Q H < S+ 0 0 47 -4,-1.7 4,-0.5 -84,-0.2 -3,-0.2 0.686 120.8 53.9 -76.2 -21.4 -6.6 72.6 -34.8 755 755 T G T X S+ 0 0 0 -4,-1.4 4,-1.6 -5,-0.2 3,-0.2 0.904 109.4 42.7 -80.1 -46.4 -6.8 75.7 -32.5 756 756 T T H > S+ 0 0 3 -5,-0.4 4,-1.7 -4,-0.3 5,-0.2 0.857 111.1 57.8 -67.9 -34.5 -7.6 78.4 -35.0 757 757 T A H < S+ 0 0 0 -4,-1.3 -1,-0.2 1,-0.2 4,-0.2 0.784 111.3 43.1 -64.2 -28.8 -10.1 76.0 -36.6 758 758 T A H > S+ 0 0 6 -4,-0.5 4,-2.0 -3,-0.2 -1,-0.2 0.732 109.2 56.7 -86.8 -29.4 -11.8 75.8 -33.2 759 759 T D H X S+ 0 0 2 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.755 101.5 56.3 -73.5 -27.6 -11.5 79.6 -32.6 760 760 T L H < S+ 0 0 1 -4,-1.7 4,-0.5 2,-0.2 -1,-0.2 0.698 110.4 46.8 -74.2 -22.0 -13.4 80.3 -35.8 761 761 T M H > S+ 0 0 1 -4,-0.2 4,-2.1 -3,-0.2 -2,-0.2 0.855 110.1 52.2 -83.3 -41.5 -16.2 78.1 -34.4 762 762 T K H < S+ 0 0 2 -4,-2.0 4,-0.5 1,-0.2 -2,-0.2 0.823 111.7 46.1 -63.1 -35.9 -16.0 79.8 -31.0 763 763 T L T X S+ 0 0 5 -4,-1.7 4,-1.1 2,-0.2 -1,-0.2 0.732 111.2 54.1 -79.5 -23.8 -16.4 83.3 -32.7 764 764 T A H > S+ 0 0 0 -4,-0.5 4,-1.7 1,-0.2 -2,-0.2 0.871 101.5 56.8 -77.1 -38.5 -19.3 82.0 -34.8 765 765 T M H X S+ 0 0 0 -4,-2.1 4,-0.8 1,-0.2 -1,-0.2 0.706 106.2 52.5 -64.3 -24.4 -21.3 80.7 -31.8 766 766 T V H 4 S+ 0 0 31 -4,-0.5 -1,-0.2 2,-0.2 -2,-0.2 0.873 112.5 42.3 -78.5 -43.5 -21.2 84.2 -30.4 767 767 T K H < S+ 0 0 82 -4,-1.1 4,-0.4 1,-0.2 -2,-0.2 0.690 113.7 52.6 -77.5 -21.5 -22.5 85.9 -33.6 768 768 T L H X S+ 0 0 2 -4,-1.7 4,-1.0 1,-0.2 3,-0.5 0.766 91.9 76.0 -86.7 -24.0 -25.2 83.2 -34.2 769 769 T F H X S+ 0 0 44 -4,-0.8 4,-1.1 1,-0.2 3,-0.3 0.826 93.5 49.1 -59.5 -34.8 -26.7 83.4 -30.6 770 770 T P H > S+ 0 0 73 0, 0.0 4,-0.6 0, 0.0 -1,-0.2 0.852 110.5 52.7 -74.3 -30.2 -28.6 86.7 -31.3 771 771 T R H > S+ 0 0 75 -3,-0.5 4,-0.9 -4,-0.4 -2,-0.2 0.640 103.8 55.5 -75.8 -19.4 -30.1 85.3 -34.5 772 772 T L H X>S+ 0 0 4 -4,-1.0 5,-2.2 -3,-0.3 4,-1.3 0.831 99.2 60.1 -82.9 -33.3 -31.4 82.1 -32.9 773 773 T E H <5S+ 0 0 125 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.775 110.5 40.7 -64.9 -30.3 -33.5 83.8 -30.2 774 774 T E H <5S+ 0 0 136 -4,-0.6 -1,-0.2 1,-0.1 -2,-0.2 0.799 114.8 49.8 -88.3 -33.3 -35.6 85.7 -32.8 775 775 T M H <5S- 0 0 97 -4,-0.9 -2,-0.2 2,-0.1 -1,-0.1 0.643 112.2-114.8 -80.5 -16.1 -36.0 82.8 -35.3 776 776 T G T <5S+ 0 0 47 -4,-1.3 2,-0.2 1,-0.3 -3,-0.2 0.777 72.5 126.0 87.1 28.8 -37.1 80.4 -32.6 777 777 T A < - 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