==== 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 PROTEIN BINDING, DE NOVO PROTEIN 09-JAN-11 3Q9N . COMPND 2 MOLECULE: COA BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.KARANICOLAS,J.E.CORN,I.CHEN,L.A.JOACHIMIAK,O.DYM,S.CHUNG,S . 588 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27677.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 414 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 46 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.0 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 . 8 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 43 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 195 33.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 4.1 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 2 1 2 7 3 10 3 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 6 2 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 2 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 . 2 0 0 0 2 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 A 0 0 119 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -23.3 -4.9 27.0 -20.9 2 1 A T + 0 0 78 105,-0.1 126,-0.1 2,-0.1 3,-0.1 0.131 360.0 135.4 -98.8 14.2 -1.5 26.0 -19.5 3 2 A R - 0 0 187 1,-0.1 3,-0.0 124,-0.1 124,-0.0 -0.442 63.9-112.9 -57.6 122.8 -1.3 29.7 -18.5 4 3 A P - 0 0 51 0, 0.0 122,-0.2 0, 0.0 123,-0.1 -0.307 17.4-156.2 -58.7 142.7 -0.1 29.9 -14.9 5 4 A I S S+ 0 0 81 120,-2.7 121,-0.2 -3,-0.1 2,-0.1 0.705 76.6 74.5 -87.0 -27.7 -2.6 31.2 -12.3 6 5 A D S S- 0 0 27 119,-1.1 118,-0.1 1,-0.1 0, 0.0 -0.349 81.6-131.9 -81.3 166.4 0.3 32.3 -10.1 7 6 A G + 0 0 81 -2,-0.1 -1,-0.1 2,-0.0 117,-0.1 0.198 58.2 134.5-104.0 17.2 2.5 35.3 -10.7 8 7 A L - 0 0 44 115,-0.2 2,-0.2 1,-0.1 -2,-0.0 -0.193 48.6-126.7 -69.0 156.8 5.8 33.6 -10.2 9 8 A T > - 0 0 70 1,-0.1 4,-2.4 0, 0.0 3,-0.3 -0.521 27.2-103.0 -98.6 168.4 8.8 34.0 -12.4 10 9 A D H > S+ 0 0 76 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.821 124.5 53.1 -55.1 -33.7 11.0 31.4 -14.2 11 10 A E H > S+ 0 0 151 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.824 105.5 52.2 -75.7 -34.6 13.6 32.0 -11.5 12 11 A D H > S+ 0 0 72 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.931 114.0 44.1 -61.8 -48.3 11.1 31.4 -8.7 13 12 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.905 111.9 52.5 -65.6 -41.7 10.1 28.1 -10.4 14 13 A R H X S+ 0 0 105 -4,-2.6 4,-1.7 -5,-0.2 5,-0.3 0.935 109.2 49.9 -58.6 -45.5 13.8 27.2 -11.0 15 14 A E H X S+ 0 0 94 -4,-2.3 4,-3.3 1,-0.2 5,-0.4 0.931 110.8 50.4 -57.9 -47.1 14.6 27.8 -7.4 16 15 A I H X S+ 0 0 5 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.912 112.5 45.4 -58.5 -43.9 11.7 25.6 -6.3 17 16 A L H < S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.743 122.9 35.4 -74.6 -23.3 12.7 22.7 -8.5 18 17 A T H < S+ 0 0 70 -4,-1.7 -2,-0.2 -3,-0.3 -3,-0.2 0.810 117.3 48.2-101.2 -36.5 16.4 22.9 -7.6 19 18 A R H < S+ 0 0 141 -4,-3.3 2,-0.4 -5,-0.3 -3,-0.2 0.873 109.4 55.3 -70.1 -39.5 16.2 23.8 -3.9 20 19 A Y < + 0 0 20 -4,-1.4 -1,-0.1 -5,-0.4 3,-0.1 -0.833 46.2 163.7-107.3 133.0 13.6 21.3 -2.9 21 20 A K + 0 0 83 -2,-0.4 28,-2.5 1,-0.1 2,-0.8 0.523 55.3 87.8-114.8 -13.3 13.9 17.5 -3.4 22 21 A K E +a 49 0A 36 26,-0.2 56,-2.3 28,-0.1 55,-2.2 -0.806 55.0 177.1-104.1 107.0 11.2 16.1 -1.1 23 22 A I E -ab 50 78A 1 26,-2.7 28,-2.5 -2,-0.8 2,-0.6 -0.914 24.6-153.3-120.0 120.4 7.8 16.0 -2.7 24 23 A A E -ab 51 79A 0 54,-3.0 56,-3.0 -2,-0.5 2,-0.8 -0.819 19.1-153.9 -83.7 121.7 4.6 14.6 -1.3 25 24 A L E > -ab 52 80A 0 26,-2.2 28,-2.7 -2,-0.6 3,-1.0 -0.842 7.1-158.5-106.2 104.3 2.5 13.5 -4.4 26 25 A V E 3 S+ab 53 81A 4 54,-2.5 56,-2.3 -2,-0.8 28,-0.2 -0.643 76.2 23.2 -90.1 126.9 -1.2 13.7 -3.6 27 26 A G T 3 S+ 0 0 15 26,-2.9 -1,-0.3 -2,-0.4 9,-0.2 0.624 81.8 173.2 89.9 16.8 -3.5 11.5 -5.7 28 27 A A < + 0 0 0 25,-1.1 -1,-0.2 -3,-1.0 9,-0.1 -0.297 8.0 178.0 -52.0 143.1 -0.7 9.2 -6.7 29 28 A S - 0 0 4 5,-0.1 31,-0.1 2,-0.1 5,-0.1 -0.996 43.1-138.0-153.9 147.0 -2.0 6.2 -8.6 30 29 A P S S+ 0 0 64 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.647 73.9 110.9 -75.4 -17.6 -0.9 3.0 -10.4 31 30 A K > - 0 0 56 1,-0.2 3,-1.4 2,-0.1 6,-0.4 -0.401 64.2-147.2 -64.8 129.2 -3.3 3.7 -13.3 32 31 A P T 3 S+ 0 0 106 0, 0.0 6,-0.2 0, 0.0 -1,-0.2 0.769 97.6 63.3 -64.8 -26.5 -1.6 4.7 -16.5 33 32 A E T 3 S+ 0 0 142 4,-0.1 2,-0.6 2,-0.0 -2,-0.1 0.500 85.5 86.0 -81.1 -2.8 -4.5 7.0 -17.3 34 33 A R S X> S- 0 0 114 -3,-1.4 3,-1.7 1,-0.1 4,-0.9 -0.885 72.2-147.7 -94.8 125.6 -3.8 9.2 -14.3 35 34 A D H 3> S+ 0 0 114 -2,-0.6 4,-2.7 1,-0.3 5,-0.3 0.750 96.7 73.0 -59.6 -24.3 -1.2 11.9 -15.1 36 35 A A H 3> S+ 0 0 3 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.847 96.0 52.7 -55.8 -33.1 -0.1 11.5 -11.4 37 36 A N H <> S+ 0 0 12 -3,-1.7 4,-1.9 -6,-0.4 -2,-0.2 0.961 110.5 41.8 -70.2 -54.5 1.4 8.2 -12.6 38 37 A I H X S+ 0 0 82 -4,-0.9 4,-2.0 -6,-0.2 -2,-0.2 0.906 117.0 49.8 -62.2 -40.2 3.5 9.5 -15.5 39 38 A V H X S+ 0 0 2 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.932 108.9 50.9 -64.0 -44.7 4.6 12.6 -13.5 40 39 A M H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.876 110.2 50.6 -60.7 -37.7 5.7 10.5 -10.5 41 40 A K H X S+ 0 0 108 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.919 110.6 49.1 -63.8 -45.2 7.7 8.3 -12.7 42 41 A Y H X S+ 0 0 31 -4,-2.0 4,-0.7 2,-0.2 -2,-0.2 0.891 111.5 48.9 -61.8 -42.4 9.4 11.3 -14.3 43 42 A L H ><>S+ 0 0 0 -4,-2.6 5,-2.1 2,-0.2 3,-0.8 0.918 111.3 48.2 -65.9 -43.6 10.2 12.8 -10.9 44 43 A L H ><5S+ 0 0 43 -4,-2.2 3,-1.1 1,-0.2 -1,-0.2 0.890 110.2 54.2 -60.0 -37.4 11.7 9.6 -9.5 45 44 A E H 3<5S+ 0 0 155 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.637 107.7 51.7 -73.0 -16.0 13.7 9.3 -12.8 46 45 A H T <<5S- 0 0 78 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 -0.089 125.0 -88.4-116.8 33.8 15.2 12.8 -12.2 47 46 A G T < 5S+ 0 0 54 -3,-1.1 2,-0.2 1,-0.2 -3,-0.2 0.501 78.7 136.4 86.3 5.8 16.5 12.6 -8.7 48 47 A Y < - 0 0 8 -5,-2.1 2,-0.7 -26,-0.0 -1,-0.2 -0.568 53.7-129.0 -86.5 149.2 13.5 13.5 -6.5 49 48 A D E -a 22 0A 63 -28,-2.5 -26,-2.7 -2,-0.2 2,-0.5 -0.888 32.8-167.3 -89.7 116.7 12.3 11.8 -3.3 50 49 A V E -a 23 0A 1 -2,-0.7 -26,-0.2 -28,-0.2 -28,-0.1 -0.935 15.3-169.5-115.3 126.1 8.6 11.2 -3.9 51 50 A Y E -a 24 0A 31 -28,-2.5 -26,-2.2 -2,-0.5 2,-0.1 -0.921 21.9-140.7-110.9 104.4 6.2 10.1 -1.2 52 51 A P E -a 25 0A 0 0, 0.0 14,-2.3 0, 0.0 2,-0.5 -0.442 12.7-160.3 -68.1 138.8 2.9 9.0 -2.7 53 52 A V E +ac 26 66A 4 -28,-2.7 -26,-2.9 12,-0.2 -25,-1.1 -0.988 36.4 121.6-122.8 118.7 -0.3 10.1 -0.8 54 53 A N > - 0 0 22 12,-2.1 3,-1.8 -2,-0.5 14,-0.1 -0.658 47.8-147.7-173.8 115.4 -3.6 8.2 -1.5 55 54 A P T 3 S+ 0 0 87 0, 0.0 13,-0.1 0, 0.0 10,-0.0 0.600 96.1 68.4 -67.4 -7.0 -5.7 6.4 1.1 56 55 A N T 3 S+ 0 0 84 10,-0.1 2,-0.3 11,-0.1 -27,-0.0 0.526 100.1 48.1 -91.0 -4.9 -6.7 3.9 -1.6 57 56 A Y < - 0 0 66 -3,-1.8 -3,-0.3 9,-0.1 3,-0.1 -0.989 54.5-159.5-136.7 149.3 -3.3 2.3 -2.0 58 57 A E S S+ 0 0 141 -2,-0.3 7,-2.6 1,-0.3 2,-0.3 0.644 88.2 16.0 -90.7 -20.6 -0.6 1.0 0.3 59 58 A E E -F 64 0B 123 5,-0.3 2,-0.4 7,-0.0 -1,-0.3 -0.991 61.2-168.9-154.9 140.4 2.1 1.4 -2.3 60 59 A V E > S-F 63 0B 2 3,-2.4 3,-1.9 -2,-0.3 -32,-0.0 -0.990 76.6 -13.5-136.8 132.6 2.5 3.2 -5.6 61 60 A L T 3 S- 0 0 66 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.867 129.5 -53.4 46.4 42.8 5.3 2.7 -8.1 62 61 A G T 3 S+ 0 0 51 1,-0.2 2,-0.4 3,-0.0 -1,-0.3 0.639 115.7 108.6 70.9 17.5 7.3 0.7 -5.5 63 62 A R E < S-F 60 0B 120 -3,-1.9 -3,-2.4 0, 0.0 -1,-0.2 -0.970 79.4 -97.2-122.6 143.9 7.1 3.4 -2.7 64 63 A K E -F 59 0B 122 -2,-0.4 2,-0.5 -5,-0.2 -5,-0.3 -0.332 40.0-145.5 -57.3 132.0 5.1 3.3 0.5 65 64 A C - 0 0 3 -7,-2.6 -12,-0.2 -14,-0.1 -1,-0.1 -0.905 10.5-152.8-109.0 128.7 1.8 5.2 0.0 66 65 A Y B -c 53 0A 34 -14,-2.3 -12,-2.1 -2,-0.5 -10,-0.1 -0.691 20.4-129.1-103.7 151.8 0.3 7.2 2.9 67 66 A P S S+ 0 0 73 0, 0.0 2,-0.3 0, 0.0 -14,-0.1 0.731 89.8 3.8 -69.2 -26.0 -3.4 8.1 3.6 68 67 A S S S- 0 0 39 -14,-0.1 4,-0.3 1,-0.1 3,-0.2 -0.944 75.6-104.1-151.4 170.6 -2.5 11.8 4.2 69 68 A V S > S+ 0 0 1 -2,-0.3 3,-1.5 1,-0.2 -1,-0.1 0.890 117.7 56.7 -66.2 -40.9 0.4 14.3 4.1 70 69 A L T 3 S+ 0 0 123 1,-0.3 -1,-0.2 -3,-0.1 25,-0.0 0.800 98.2 63.0 -61.3 -30.2 0.7 14.3 7.9 71 70 A D T 3 S+ 0 0 82 -3,-0.2 -1,-0.3 2,-0.0 -2,-0.2 0.639 77.8 103.1 -71.2 -15.4 1.2 10.6 7.9 72 71 A I < - 0 0 2 -3,-1.5 4,-0.1 -4,-0.3 -48,-0.0 -0.567 58.2-160.7 -71.2 124.7 4.4 10.9 5.9 73 72 A P + 0 0 94 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.854 65.0 84.4 -75.4 -33.1 7.3 10.4 8.3 74 73 A D S S- 0 0 50 1,-0.1 2,-0.1 0, 0.0 -2,-0.0 -0.170 96.0 -90.1 -64.0 156.7 9.9 12.0 6.0 75 74 A K - 0 0 130 1,-0.0 2,-0.5 -52,-0.0 -1,-0.1 -0.455 43.9-151.4 -58.8 137.9 10.5 15.7 5.8 76 75 A V + 0 0 5 22,-0.4 -53,-0.2 1,-0.1 3,-0.1 -0.975 26.1 167.1-119.5 122.6 8.2 17.2 3.1 77 76 A E + 0 0 35 -55,-2.2 24,-2.0 -2,-0.5 25,-1.9 0.809 68.6 29.2 -98.4 -37.0 9.2 20.3 1.2 78 77 A V E -bd 23 102A 1 -56,-2.3 -54,-3.0 23,-0.2 2,-0.6 -0.984 60.9-153.0-129.7 137.7 6.7 20.4 -1.7 79 78 A V E -bd 24 103A 0 23,-2.1 25,-3.1 -2,-0.4 2,-0.6 -0.945 14.0-163.5-112.3 113.5 3.1 19.2 -1.9 80 79 A D E -bd 25 104A 0 -56,-3.0 -54,-2.5 -2,-0.6 2,-0.5 -0.880 12.2-148.5-106.2 118.7 2.2 18.3 -5.5 81 80 A L E +bd 26 105A 0 23,-2.7 25,-1.5 -2,-0.6 -54,-0.1 -0.812 31.6 164.2-107.2 120.4 -1.5 18.0 -6.0 82 81 A F + 0 0 36 -56,-2.3 2,-0.3 -2,-0.5 -46,-0.1 -0.446 48.5 106.1-121.8 51.5 -3.4 15.7 -8.5 83 82 A V S S- 0 0 32 1,-0.1 5,-0.2 23,-0.1 23,-0.1 -0.954 77.7 -73.1-131.0 155.4 -6.9 15.9 -7.0 84 83 A N >> - 0 0 21 -2,-0.3 4,-2.6 1,-0.1 3,-2.6 0.048 40.5-116.9 -38.4 142.9 -10.2 17.6 -8.0 85 84 A P H 3> S+ 0 0 2 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.761 116.8 62.9 -59.4 -26.4 -10.5 21.4 -7.6 86 85 A A H 34 S+ 0 0 0 1,-0.1 -2,-0.1 2,-0.1 263,-0.1 0.675 119.4 24.5 -65.1 -15.7 -13.3 20.7 -5.1 87 86 A K H X4 S+ 0 0 79 -3,-2.6 3,-1.3 22,-0.1 4,-0.2 0.687 102.8 74.6-121.3 -37.8 -10.7 18.9 -2.9 88 87 A A H >< S+ 0 0 0 -4,-2.6 3,-2.3 1,-0.3 4,-0.2 0.850 84.9 66.2 -61.9 -38.3 -7.2 20.2 -3.6 89 88 A W T >< S+ 0 0 6 -4,-0.5 3,-1.4 1,-0.3 4,-0.4 0.741 88.5 69.7 -56.7 -25.4 -7.4 23.6 -1.8 90 89 A R T <> S+ 0 0 28 -3,-1.3 4,-0.9 1,-0.3 -1,-0.3 0.649 85.1 70.8 -68.9 -15.5 -7.8 21.8 1.6 91 90 A F H <> S+ 0 0 35 -3,-2.3 4,-2.4 -4,-0.2 -1,-0.3 0.619 78.2 76.1 -81.0 -11.4 -4.2 20.7 1.4 92 91 A V H <> S+ 0 0 0 -3,-1.4 4,-2.3 -4,-0.2 -1,-0.2 0.958 100.4 42.0 -58.8 -51.9 -2.7 24.2 1.9 93 92 A V H > S+ 0 0 39 -4,-0.4 4,-2.3 -3,-0.2 -1,-0.2 0.885 114.3 51.9 -62.4 -39.0 -3.5 24.0 5.6 94 93 A Y H X S+ 0 0 113 -4,-0.9 4,-1.4 1,-0.2 -1,-0.2 0.887 111.0 48.4 -64.4 -35.7 -2.3 20.4 5.7 95 94 A A H X>S+ 0 0 0 -4,-2.4 5,-2.3 2,-0.2 4,-1.0 0.873 108.4 54.1 -70.8 -37.9 0.9 21.5 4.1 96 95 A I H ><5S+ 0 0 71 -4,-2.3 3,-0.7 1,-0.2 -2,-0.2 0.930 108.6 48.6 -60.9 -46.4 1.3 24.4 6.6 97 96 A K H 3<5S+ 0 0 150 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.835 110.6 51.5 -63.1 -32.4 1.0 21.9 9.5 98 97 A K H 3<5S- 0 0 49 -4,-1.4 -22,-0.4 -5,-0.2 -1,-0.2 0.644 114.6-116.5 -79.6 -15.8 3.6 19.6 7.9 99 98 A G T <<5 + 0 0 49 -4,-1.0 -3,-0.2 -3,-0.7 -2,-0.1 0.658 54.5 165.6 86.5 16.6 6.1 22.5 7.5 100 99 A A < - 0 0 9 -5,-2.3 -1,-0.2 -6,-0.1 -23,-0.2 -0.319 31.6-151.9 -63.0 148.8 6.1 22.3 3.7 101 100 A K S S+ 0 0 108 -24,-2.0 21,-2.2 1,-0.2 2,-0.4 0.713 74.1 31.9 -91.5 -28.5 7.6 25.3 1.8 102 101 A V E -de 78 122A 0 -25,-1.9 -23,-2.1 19,-0.2 2,-0.5 -0.983 54.4-160.6-137.4 141.1 5.5 25.0 -1.5 103 102 A V E -de 79 123A 0 19,-2.8 21,-2.6 -2,-0.4 2,-0.6 -0.994 18.2-162.7-120.8 124.0 2.1 23.8 -2.6 104 103 A W E -de 80 124A 0 -25,-3.1 -23,-2.7 -2,-0.5 2,-0.7 -0.920 4.8-158.6-115.0 112.4 1.9 23.0 -6.3 105 104 A F E -de 81 125A 0 19,-3.3 22,-1.5 -2,-0.6 21,-1.2 -0.816 13.0-151.6 -92.6 117.5 -1.5 22.8 -8.1 106 105 A Q > - 0 0 7 -25,-1.5 3,-0.9 -2,-0.7 20,-0.4 -0.107 47.3 -49.8 -75.9 178.3 -1.4 20.8 -11.3 107 106 A Y T 3 S+ 0 0 55 1,-0.2 -1,-0.2 2,-0.1 -105,-0.1 -0.230 125.5 4.9 -56.2 136.3 -3.8 21.5 -14.2 108 107 A N T 3 S+ 0 0 137 -3,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.888 106.0 96.5 58.0 42.8 -7.5 21.7 -13.3 109 108 A T < + 0 0 7 -3,-0.9 -20,-0.3 -25,-0.2 -21,-0.3 0.489 52.9 103.1-129.5 -15.9 -6.9 21.4 -9.5 110 109 A Y + 0 0 30 -4,-0.4 15,-0.0 -5,-0.1 -24,-0.0 -0.455 35.9 173.7 -80.2 143.7 -6.9 25.0 -8.2 111 110 A Y > - 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0 0 10 -5,-2.4 2,-0.7 -6,-0.2 -1,-0.2 -0.278 45.0-110.0 -53.6 136.1 -29.3 26.7 -8.3 373 93 C D > - 0 0 79 1,-0.2 3,-1.4 -32,-0.1 -1,-0.1 -0.612 26.3-159.2 -71.3 109.8 -28.9 29.7 -5.9 374 94 C V T 3 S+ 0 0 18 -2,-0.7 11,-0.4 1,-0.3 -1,-0.2 0.744 88.1 43.9 -66.5 -22.4 -27.3 32.3 -8.0 375 95 C N T 3 S+ 0 0 43 8,-0.1 -1,-0.3 30,-0.1 2,-0.1 -0.094 75.4 145.4-118.2 34.1 -26.1 34.2 -5.0 376 96 C A < - 0 0 13 -3,-1.4 2,-0.4 1,-0.0 -26,-0.1 -0.474 38.2-143.5 -68.5 142.8 -24.8 31.4 -2.7 377 97 C Y - 0 0 109 6,-0.1 6,-0.2 -2,-0.1 2,-0.1 -0.932 8.6-150.9-113.2 132.7 -21.7 32.5 -0.6 378 98 C D > - 0 0 9 4,-1.9 3,-2.2 -2,-0.4 -30,-0.2 -0.208 44.9 -76.6 -88.2-176.3 -18.8 30.1 0.2 379 99 C R T 3 S+ 0 0 122 -32,-2.7 -31,-0.1 1,-0.3 -1,-0.0 0.804 132.5 49.4 -49.8 -35.5 -16.6 30.2 3.3 380 100 C A T 3 S- 0 0 8 -33,-0.2 32,-2.3 2,-0.1 33,-0.3 0.384 122.3-102.7 -88.5 2.3 -14.6 33.2 1.9 381 101 C G S < S+ 0 0 14 -3,-2.2 2,-0.4 30,-0.3 -2,-0.1 0.671 72.7 149.7 80.5 17.2 -17.7 35.2 1.1 382 102 C W - 0 0 5 29,-0.1 -4,-1.9 4,-0.1 -1,-0.3 -0.719 29.8-163.4 -87.9 131.0 -17.5 34.4 -2.6 383 103 C T > - 0 0 0 -2,-0.4 4,-2.0 -6,-0.2 3,-0.3 -0.514 43.0 -96.8 -92.2 168.7 -20.6 34.1 -4.9 384 104 C P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.859 126.5 59.2 -56.1 -30.2 -20.5 32.5 -8.3 385 105 C L H > S+ 0 0 2 -11,-0.4 4,-2.1 2,-0.2 5,-0.1 0.913 104.4 49.0 -63.9 -42.6 -20.1 36.0 -9.8 386 106 C H H > S+ 0 0 1 -3,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.924 112.9 48.0 -58.2 -46.8 -16.9 36.5 -7.8 387 107 C L H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.882 109.6 51.5 -66.3 -39.3 -15.6 33.1 -8.9 388 108 C A H <>S+ 0 0 0 -4,-2.6 5,-2.6 -5,-0.2 -1,-0.2 0.909 112.6 47.3 -61.2 -39.3 -16.5 33.8 -12.6 389 109 C A H ><5S+ 0 0 0 -4,-2.1 3,-1.6 3,-0.2 -2,-0.2 0.926 105.6 58.6 -69.5 -46.0 -14.5 37.1 -12.3 390 110 C L H 3<5S+ 0 0 35 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.870 115.3 35.1 -49.4 -44.1 -11.5 35.5 -10.6 391 111 C S T 3<5S- 0 0 31 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.265 112.7-119.0-100.4 16.6 -11.0 33.1 -13.6 392 112 C G T < 5 + 0 0 25 -3,-1.6 2,-1.1 1,-0.2 -3,-0.2 0.836 47.8 167.1 58.1 42.9 -12.1 35.7 -16.1 393 113 C Q >< + 0 0 54 -5,-2.6 4,-2.5 1,-0.2 -1,-0.2 -0.721 9.3 178.8 -92.6 94.7 -15.1 33.9 -17.6 394 114 C L H > S+ 0 0 81 -2,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.908 79.0 48.1 -60.1 -49.1 -16.9 36.6 -19.7 395 115 C E H > S+ 0 0 123 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.892 113.3 48.3 -62.5 -41.1 -19.7 34.3 -21.0 396 116 C I H > S+ 0 0 3 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.913 109.4 52.2 -67.8 -41.2 -20.4 32.9 -17.5 397 117 C V H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.935 108.6 51.7 -56.8 -47.7 -20.5 36.4 -15.9 398 118 C E H X S+ 0 0 98 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.890 111.3 47.3 -55.7 -44.1 -23.0 37.5 -18.6 399 119 C V H X S+ 0 0 22 -4,-1.8 4,-1.0 2,-0.2 -1,-0.2 0.907 110.6 50.6 -66.0 -44.9 -25.3 34.5 -17.8 400 120 C L H ><>S+ 0 0 0 -4,-2.6 5,-1.9 1,-0.2 3,-0.6 0.918 110.1 50.9 -60.1 -43.4 -25.1 35.0 -14.0 401 121 C L H ><5S+ 0 0 49 -4,-2.4 3,-1.9 1,-0.3 -1,-0.2 0.922 106.4 53.7 -59.7 -45.5 -26.1 38.6 -14.3 402 122 C K H 3<5S+ 0 0 181 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.747 107.5 54.6 -61.4 -22.3 -29.0 37.8 -16.5 403 123 C H T <<5S- 0 0 92 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.117 129.6 -90.7-103.8 21.4 -30.1 35.4 -13.8 404 124 C G T < 5 + 0 0 49 -3,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.731 58.7 175.4 83.6 25.8 -30.1 38.0 -11.0 405 125 C A < - 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0 0 19 -2,-0.4 4,-1.8 -6,-0.2 -6,-0.1 -0.469 35.8-103.2 -87.8 166.0 -17.2 42.9 -5.2 417 137 C A H > S+ 0 0 1 -8,-0.3 4,-2.0 -10,-0.3 5,-0.2 0.919 125.7 56.0 -52.3 -44.0 -16.9 40.9 -8.4 418 138 C F H > S+ 0 0 49 -11,-0.4 4,-2.1 15,-0.4 -1,-0.2 0.947 102.8 52.8 -50.7 -56.0 -16.1 44.2 -10.1 419 139 C D H > S+ 0 0 49 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.875 108.2 53.3 -48.4 -43.3 -13.2 44.9 -7.6 420 140 C I H X S+ 0 0 11 -4,-1.8 4,-1.1 1,-0.2 -1,-0.2 0.925 106.4 48.2 -64.2 -48.5 -11.7 41.6 -8.5 421 141 C S H <>S+ 0 0 0 -4,-2.0 5,-1.6 1,-0.2 -1,-0.2 0.872 112.3 52.2 -62.4 -34.7 -11.6 42.0 -12.3 422 142 C I H ><5S+ 0 0 56 -4,-2.1 3,-2.1 1,-0.2 -2,-0.2 0.952 105.5 51.9 -64.1 -51.3 -10.1 45.4 -11.8 423 143 C N H 3<5S+ 0 0 120 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.753 113.6 48.1 -55.2 -23.3 -7.3 44.1 -9.5 424 144 C Q T 3<5S- 0 0 88 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.358 112.5-120.0-103.3 2.5 -6.7 41.6 -12.3 425 145 C G T < 5S+ 0 0 55 -3,-2.1 2,-1.9 1,-0.2 -3,-0.2 0.445 70.6 132.7 78.8 -0.9 -6.7 44.1 -15.2 426 146 C Q >< + 0 0 69 -5,-1.6 4,-1.8 1,-0.2 3,-0.3 -0.565 21.0 162.1 -80.5 77.0 -9.6 42.6 -17.0 427 147 C E H > + 0 0 129 -2,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.622 66.3 64.8 -80.4 -10.1 -11.3 45.9 -17.5 428 148 C D H > S+ 0 0 142 2,-0.2 4,-0.7 -3,-0.2 -1,-0.2 0.895 108.3 41.6 -73.0 -40.4 -13.5 44.5 -20.3 429 149 C L H >> S+ 0 0 10 -3,-0.3 4,-1.0 1,-0.2 3,-0.8 0.893 110.8 57.6 -67.4 -41.7 -15.1 42.2 -17.7 430 150 C A H 3< S+ 0 0 2 -4,-1.8 4,-0.3 1,-0.2 3,-0.3 0.842 98.5 61.6 -57.4 -34.8 -15.2 45.0 -15.2 431 151 C E H 3< S+ 0 0 147 -4,-1.2 3,-0.4 1,-0.2 -1,-0.2 0.814 109.2 39.0 -67.8 -31.4 -17.2 47.2 -17.5 432 152 C I H << S+ 0 0 59 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.2 0.588 111.4 61.5 -91.6 -9.5 -20.2 44.7 -17.6 433 153 C L < 0 0 1 -4,-1.0 -15,-0.4 -3,-0.3 -2,-0.2 0.364 360.0 360.0 -94.1 1.9 -19.8 44.0 -13.9 434 154 C Q 0 0 183 -3,-0.4 -1,-0.2 -4,-0.3 -2,-0.1 0.369 360.0 360.0 -88.1 360.0 -20.4 47.5 -12.7 435 !* 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 0.0 436 -3 D A > 0 0 96 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 84.7 -26.0 11.3 32.8 437 -2 D F H > + 0 0 184 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.904 360.0 44.0 -40.5 -62.7 -22.4 11.8 31.6 438 -1 D G H > S+ 0 0 49 2,-0.2 4,-3.3 1,-0.2 28,-0.3 0.868 109.5 55.8 -63.5 -41.4 -21.2 8.3 32.1 439 0 D Q H > S+ 0 0 81 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.955 111.5 43.9 -54.5 -51.6 -24.3 6.7 30.6 440 1 D D H X S+ 0 0 80 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.880 114.9 48.9 -63.4 -41.0 -23.9 8.6 27.4 441 2 D L H X S+ 0 0 31 -4,-2.2 4,-2.5 -5,-0.2 5,-0.2 0.963 109.5 52.5 -62.7 -51.6 -20.1 8.0 27.3 442 3 D G H X S+ 0 0 5 -4,-3.3 4,-2.4 1,-0.2 -2,-0.2 0.916 108.5 51.1 -46.9 -52.3 -20.7 4.2 27.9 443 4 D K H X S+ 0 0 126 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.909 109.8 49.3 -52.9 -47.4 -23.1 4.1 25.0 444 5 D K H X S+ 0 0 110 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.896 110.6 49.9 -64.4 -38.7 -20.7 5.8 22.6 445 6 D L H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.919 107.8 53.7 -66.5 -42.3 -17.9 3.4 23.6 446 7 D L H X S+ 0 0 17 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.919 112.8 44.5 -55.2 -46.0 -20.1 0.3 23.0 447 8 D E H X S+ 0 0 94 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.915 115.1 46.8 -67.0 -43.7 -20.9 1.5 19.5 448 9 D A H <>S+ 0 0 1 -4,-2.5 5,-2.2 2,-0.2 4,-0.5 0.888 112.7 49.2 -69.2 -37.4 -17.3 2.5 18.7 449 10 D A H ><5S+ 0 0 0 -4,-3.1 3,-0.9 1,-0.2 -1,-0.2 0.922 111.5 49.9 -66.6 -41.7 -15.9 -0.8 20.0 450 11 D A H 3<5S+ 0 0 15 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.873 113.0 47.4 -62.1 -37.2 -18.5 -2.7 18.0 451 12 D A T 3<5S- 0 0 48 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.427 109.9-118.8 -87.6 0.8 -17.6 -0.8 14.8 452 13 D G T < 5 + 0 0 17 -3,-0.9 2,-1.7 -4,-0.5 -3,-0.2 0.750 55.4 157.9 70.3 23.0 -13.8 -1.1 15.1 453 14 D Q >< + 0 0 105 -5,-2.2 4,-2.1 1,-0.2 -1,-0.2 -0.585 13.9 178.1 -84.0 84.4 -13.3 2.6 15.4 454 15 D D H > S+ 0 0 57 -2,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.845 75.2 49.8 -61.0 -38.0 -9.9 2.6 17.1 455 16 D D H >> S+ 0 0 114 2,-0.2 4,-2.1 1,-0.2 3,-0.8 0.985 111.2 45.7 -63.6 -60.1 -9.5 6.3 17.1 456 17 D E H 3> S+ 0 0 75 1,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.821 109.4 58.5 -54.2 -33.2 -12.9 7.2 18.6 457 18 D V H 3X S+ 0 0 2 -4,-2.1 4,-1.7 2,-0.2 -1,-0.3 0.893 106.8 47.3 -63.1 -40.0 -12.4 4.4 21.2 458 19 D R H S+ 0 0 9 -4,-2.4 5,-2.7 2,-0.2 -1,-0.2 0.887 110.8 47.1 -67.1 -41.3 -13.9 8.3 24.5 461 22 D M H ><5S+ 0 0 39 -4,-1.7 3,-1.8 1,-0.2 -1,-0.2 0.914 110.8 52.7 -66.1 -41.0 -11.8 6.5 27.1 462 23 D A H 3<5S+ 0 0 86 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.808 107.0 54.5 -62.7 -29.8 -9.6 9.6 27.5 463 24 D N T 3<5S- 0 0 108 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.269 132.6 -89.0 -89.8 10.7 -12.9 11.6 28.0 464 25 D G T < 5S+ 0 0 55 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.1 0.453 70.1 154.7 104.2 2.0 -13.9 9.3 30.9 465 26 D A < - 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0 0 7 -2,-0.4 4,-1.5 -6,-0.2 3,-0.3 -0.707 37.3-106.1-108.6 166.0 -19.1 -14.2 27.5 510 71 D P H > S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.878 120.7 56.6 -57.2 -35.0 -16.7 -12.6 25.0 511 72 D L H > S+ 0 0 0 -11,-0.3 4,-2.0 1,-0.2 5,-0.2 0.870 102.8 54.3 -66.3 -36.8 -15.0 -16.0 24.4 512 73 D H H > S+ 0 0 0 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.886 111.9 45.7 -57.0 -42.8 -18.4 -17.5 23.4 513 74 D L H X S+ 0 0 0 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.920 111.1 49.2 -71.8 -46.4 -18.8 -14.8 20.8 514 75 D A H <>S+ 0 0 0 -4,-2.7 5,-2.4 1,-0.2 4,-0.3 0.854 112.9 50.6 -63.3 -33.8 -15.3 -15.0 19.4 515 76 D A H ><5S+ 0 0 0 -4,-2.0 3,-1.1 -5,-0.2 -2,-0.2 0.954 112.6 42.6 -67.3 -53.0 -15.6 -18.7 19.1 516 77 D Y H 3<5S+ 0 0 24 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.867 114.9 51.6 -63.6 -34.1 -19.0 -18.8 17.3 517 78 D D T 3<5S- 0 0 40 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.440 111.4-120.1 -88.2 0.4 -18.0 -15.9 15.0 518 79 D G T < 5 + 0 0 26 -3,-1.1 2,-1.0 -4,-0.3 -3,-0.2 0.800 56.9 151.4 74.2 32.1 -14.7 -17.6 14.0 519 80 D H >< + 0 0 54 -5,-2.4 4,-2.0 1,-0.2 -1,-0.2 -0.738 14.6 175.0-100.4 88.9 -12.2 -15.0 15.1 520 81 D L H > S+ 0 0 63 -2,-1.0 4,-2.1 1,-0.2 -1,-0.2 0.883 75.3 53.5 -62.8 -45.4 -9.1 -17.1 15.9 521 82 D E H > S+ 0 0 133 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.891 112.6 45.7 -59.2 -39.4 -6.7 -14.3 16.8 522 83 D I H > S+ 0 0 3 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.848 107.0 57.7 -73.0 -36.4 -9.2 -12.9 19.3 523 84 D V H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.941 108.3 47.9 -57.5 -44.7 -9.8 -16.3 20.8 524 85 D E H X S+ 0 0 86 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.909 110.8 50.5 -65.1 -41.0 -6.1 -16.6 21.5 525 86 D V H X S+ 0 0 15 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.928 110.1 49.2 -63.0 -48.3 -5.9 -13.1 23.1 526 87 D L H <>S+ 0 0 0 -4,-2.6 5,-2.1 1,-0.2 3,-0.4 0.942 113.3 46.8 -55.1 -50.1 -8.9 -13.7 25.4 527 88 D L H ><5S+ 0 0 17 -4,-2.3 3,-1.7 1,-0.2 -1,-0.2 0.889 107.9 56.9 -59.9 -40.6 -7.4 -17.0 26.5 528 89 D K H 3<5S+ 0 0 175 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.840 108.5 48.3 -59.3 -33.1 -4.0 -15.2 27.0 529 90 D H T 3<5S- 0 0 91 -4,-1.7 -1,-0.3 -3,-0.4 -2,-0.2 0.252 133.2 -84.9 -96.7 13.3 -5.7 -12.8 29.4 530 91 D G T < 5 + 0 0 46 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.655 60.9 174.3 100.2 18.5 -7.5 -15.5 31.4 531 92 D A < - 0 0 11 -5,-2.1 2,-0.6 -6,-0.1 -1,-0.2 -0.363 37.7-113.5 -62.1 135.1 -10.7 -16.2 29.5 532 93 D D > - 0 0 79 1,-0.1 3,-1.0 -32,-0.1 -1,-0.1 -0.588 23.8-164.3 -74.8 110.9 -12.6 -19.1 31.1 533 94 D V T 3 S+ 0 0 22 -2,-0.6 11,-0.4 1,-0.2 -1,-0.1 0.782 86.1 44.9 -68.2 -30.2 -12.7 -22.1 28.7 534 95 D N T 3 S+ 0 0 53 8,-0.1 2,-0.4 30,-0.1 -1,-0.2 -0.105 74.6 138.3-109.4 39.2 -15.6 -23.9 30.5 535 96 D A < - 0 0 16 -3,-1.0 2,-0.4 1,-0.0 -26,-0.1 -0.669 42.8-147.1 -76.7 129.8 -18.0 -21.0 31.0 536 97 D Y - 0 0 107 -2,-0.4 6,-0.2 6,-0.1 2,-0.1 -0.843 7.9-152.2-103.2 140.9 -21.5 -22.2 30.3 537 98 D D > - 0 0 11 4,-1.9 3,-1.8 -2,-0.4 -30,-0.2 -0.195 42.8 -73.9 -95.5-167.8 -24.2 -20.0 28.8 538 99 D R T 3 S+ 0 0 144 -32,-2.0 -31,-0.1 1,-0.3 -2,-0.0 0.824 132.0 44.8 -61.0 -38.4 -28.1 -20.2 29.1 539 100 D A T 3 S- 0 0 28 -33,-0.2 32,-2.7 2,-0.1 33,-0.3 0.321 124.7-100.5 -87.7 8.3 -28.5 -23.2 26.9 540 101 D G S < S+ 0 0 15 -3,-1.8 2,-0.4 30,-0.3 -2,-0.2 0.699 72.6 152.7 79.8 20.0 -25.6 -25.0 28.6 541 102 D W - 0 0 30 29,-0.1 -4,-1.9 4,-0.1 -1,-0.2 -0.698 28.4-163.1 -88.5 133.3 -23.1 -24.2 25.8 542 103 D T > - 0 0 0 -2,-0.4 4,-1.6 -6,-0.2 3,-0.3 -0.536 43.9 -95.6 -94.9 170.7 -19.4 -23.8 26.4 543 104 D P H > S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.814 126.0 60.1 -58.4 -25.7 -17.1 -22.1 23.9 544 105 D L H > S+ 0 0 2 -11,-0.4 4,-2.2 1,-0.2 5,-0.2 0.896 102.7 49.9 -69.8 -39.9 -16.4 -25.6 22.5 545 106 D H H > S+ 0 0 2 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.910 112.0 49.6 -58.1 -41.4 -20.0 -26.2 21.7 546 107 D L H X S+ 0 0 0 -4,-1.6 4,-1.3 2,-0.2 -2,-0.2 0.895 109.3 49.7 -70.2 -40.8 -20.1 -22.9 19.9 547 108 D A H <>S+ 0 0 0 -4,-2.1 5,-2.6 1,-0.2 3,-0.3 0.908 112.7 49.0 -59.9 -44.9 -17.0 -23.5 17.9 548 109 D A H ><5S+ 0 0 0 -4,-2.2 3,-1.5 1,-0.2 -2,-0.2 0.896 103.4 61.0 -63.1 -39.7 -18.5 -26.9 16.9 549 110 D L H 3<5S+ 0 0 34 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.852 113.3 35.1 -58.9 -35.8 -21.8 -25.3 15.9 550 111 D S T 3<5S- 0 0 37 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.218 115.2-112.9-105.1 17.8 -20.1 -23.1 13.2 551 112 D G T < 5 + 0 0 26 -3,-1.5 2,-1.2 1,-0.2 -3,-0.2 0.839 50.4 169.0 60.9 42.8 -17.5 -25.7 12.2 552 113 D Q >< + 0 0 45 -5,-2.6 4,-2.7 1,-0.2 5,-0.2 -0.687 8.4 175.0 -94.9 94.1 -14.4 -24.0 13.4 553 114 D L H > S+ 0 0 62 -2,-1.2 4,-2.0 1,-0.2 -1,-0.2 0.912 78.5 46.7 -59.7 -50.5 -11.6 -26.5 13.3 554 115 D E H > S+ 0 0 102 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.863 114.9 46.8 -67.8 -35.3 -8.7 -24.2 14.2 555 116 D I H > S+ 0 0 2 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.917 108.5 54.3 -72.0 -44.5 -10.6 -22.7 17.2 556 117 D V H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.921 108.4 52.6 -50.7 -43.8 -11.7 -26.1 18.4 557 118 D E H X S+ 0 0 102 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.909 109.2 46.6 -62.6 -44.9 -8.0 -27.1 18.4 558 119 D V H X S+ 0 0 16 -4,-1.7 4,-1.3 2,-0.2 -1,-0.2 0.909 111.5 51.4 -64.9 -41.9 -6.9 -24.1 20.5 559 120 D L H <>S+ 0 0 0 -4,-2.6 5,-2.3 1,-0.2 3,-0.3 0.912 110.0 49.0 -62.3 -44.9 -9.7 -24.5 23.1 560 121 D L H ><5S+ 0 0 52 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.893 108.2 54.2 -60.4 -41.0 -8.9 -28.2 23.6 561 122 D K H 3<5S+ 0 0 175 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.793 107.5 52.5 -63.4 -26.4 -5.2 -27.2 24.0 562 123 D H T 3<5S- 0 0 87 -4,-1.3 -1,-0.3 -3,-0.3 -29,-0.2 0.213 130.4 -91.0 -97.9 15.4 -6.3 -24.8 26.8 563 124 D G T < 5 + 0 0 49 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.647 60.5 170.3 93.9 17.1 -8.3 -27.4 28.7 564 125 D A < - 0 0 12 -5,-2.3 2,-0.9 -6,-0.1 -1,-0.2 -0.364 42.6-111.2 -58.5 140.1 -11.8 -27.3 27.3 565 126 D D > - 0 0 59 1,-0.2 3,-1.7 -32,-0.1 -1,-0.1 -0.661 25.8-167.6 -81.7 105.1 -13.9 -30.2 28.5 566 127 D V T 3 S+ 0 0 34 -2,-0.9 11,-0.4 1,-0.3 10,-0.3 0.694 88.6 54.4 -64.4 -18.3 -14.6 -32.5 25.6 567 128 D N T 3 S+ 0 0 114 8,-0.1 -1,-0.3 9,-0.1 2,-0.1 0.322 76.5 125.3-100.5 5.3 -17.2 -34.2 27.8 568 129 D A < - 0 0 4 -3,-1.7 2,-0.4 1,-0.0 8,-0.3 -0.394 47.5-150.3 -64.0 143.4 -19.3 -31.1 28.7 569 130 D Q - 0 0 123 6,-0.1 6,-0.2 -2,-0.1 5,-0.1 -0.923 1.0-139.7-120.9 143.8 -23.0 -31.5 27.9 570 131 D D > - 0 0 15 4,-2.3 3,-2.4 -2,-0.4 -30,-0.3 -0.122 47.0 -75.9 -88.0-168.8 -25.5 -28.8 27.0 571 132 D A T 3 S+ 0 0 80 -32,-2.7 -31,-0.1 1,-0.3 -1,-0.1 0.724 135.2 48.1 -66.3 -18.9 -29.1 -28.4 28.1 572 133 D L T 3 S- 0 0 150 -33,-0.3 -1,-0.3 2,-0.1 -32,-0.1 0.324 121.6-106.4-100.0 6.5 -30.1 -31.2 25.7 573 134 D G S < S+ 0 0 30 -3,-2.4 2,-0.2 1,-0.3 -2,-0.1 0.473 73.1 142.2 84.9 2.2 -27.3 -33.5 26.8 574 135 D L - 0 0 47 -5,-0.1 -4,-2.3 4,-0.0 -1,-0.3 -0.510 38.6-150.7 -79.5 143.9 -25.2 -33.0 23.7 575 136 D T > - 0 0 22 -6,-0.2 4,-1.6 -2,-0.2 -6,-0.1 -0.544 37.4-101.2 -94.3 170.6 -21.4 -32.7 23.6 576 137 D A H > S+ 0 0 2 -8,-0.3 4,-2.2 -10,-0.3 5,-0.2 0.883 125.7 58.7 -58.5 -36.9 -19.5 -30.7 21.0 577 138 D F H > S+ 0 0 62 -11,-0.4 4,-2.2 15,-0.4 -1,-0.2 0.941 103.0 50.7 -57.5 -49.0 -18.8 -34.1 19.4 578 139 D D H > S+ 0 0 50 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.862 107.7 54.7 -55.4 -40.0 -22.6 -34.8 19.0 579 140 D I H X S+ 0 0 8 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.946 107.8 47.6 -63.7 -48.2 -23.0 -31.3 17.4 580 141 D S H <>S+ 0 0 0 -4,-2.2 5,-3.0 1,-0.2 -2,-0.2 0.911 112.5 50.6 -59.2 -41.6 -20.4 -32.0 14.7 581 142 D I H ><5S+ 0 0 63 -4,-2.2 3,-1.9 1,-0.2 -2,-0.2 0.938 107.2 52.6 -61.2 -49.1 -22.0 -35.4 14.0 582 143 D N H 3<5S+ 0 0 114 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.868 110.9 48.5 -53.8 -37.0 -25.5 -34.0 13.7 583 144 D Q T 3<5S- 0 0 88 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.377 116.3-113.4 -89.4 5.1 -24.2 -31.5 11.1 584 145 D G T < 5S+ 0 0 44 -3,-1.9 2,-1.0 -4,-0.2 -3,-0.2 0.753 72.2 138.6 69.4 25.0 -22.3 -34.1 9.1 585 146 D Q >>< + 0 0 67 -5,-3.0 4,-2.3 -6,-0.2 3,-0.5 -0.563 18.0 163.8 -98.4 69.5 -18.9 -32.7 10.0 586 147 D E H 3> + 0 0 111 -2,-1.0 4,-1.8 1,-0.2 -1,-0.2 0.744 68.3 55.9 -62.7 -28.7 -17.2 -36.0 10.6 587 148 D D H 3> S+ 0 0 134 2,-0.2 4,-1.0 -3,-0.2 -1,-0.2 0.867 110.7 43.5 -75.7 -35.4 -13.7 -34.7 10.5 588 149 D L H <> S+ 0 0 12 -3,-0.5 4,-1.2 2,-0.2 3,-0.3 0.899 110.4 57.6 -71.9 -39.2 -14.3 -32.2 13.3 589 150 D A H >< S+ 0 0 1 -4,-2.3 3,-0.8 1,-0.2 4,-0.4 0.913 101.8 55.1 -55.5 -44.5 -16.2 -34.8 15.2 590 151 D E H >< S+ 0 0 129 -4,-1.8 3,-0.9 1,-0.3 -1,-0.2 0.878 107.5 49.4 -59.2 -37.9 -13.1 -37.1 15.2 591 152 D I H 3< S+ 0 0 69 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.769 112.5 50.0 -68.9 -23.9 -11.0 -34.3 16.7 592 153 D L T << 0 0 0 -4,-1.2 -15,-0.4 -3,-0.8 -1,-0.2 0.290 360.0 360.0-100.2 5.9 -13.7 -33.8 19.4 593 154 D Q < 0 0 154 -3,-0.9 -27,-0.1 -4,-0.4 -26,-0.1 -0.166 360.0 360.0 -54.4 360.0 -14.1 -37.5 20.5