==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-JUN-05 1ZXY . COMPND 2 MOLECULE: ANTHRANILATE PHOSPHORIBOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS; . AUTHOR M.MARINO,M.DEUSS,R.STERNER,O.MAYANS . 1376 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 52031.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1011 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 70 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 90 6.5 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 . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 76 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 166 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 544 39.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 26 1.9 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 5 0 0 5 2 9 7 5 7 3 8 0 0 3 1 0 0 0 0 1 1 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 4 0 0 8 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 . 12 0 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 3 1 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 A M 0 0 106 0, 0.0 2,-0.7 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 103.4 14.0 -7.6 62.2 2 2 A N > - 0 0 71 1,-0.2 4,-2.3 2,-0.0 5,-0.2 -0.836 360.0-157.0 -96.1 115.2 14.6 -11.3 62.8 3 3 A I H > S+ 0 0 39 -2,-0.7 4,-2.7 1,-0.2 -1,-0.2 0.907 93.7 49.8 -53.6 -44.8 14.5 -13.2 59.5 4 4 A N H > S+ 0 0 39 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.904 107.8 49.4 -64.5 -47.0 13.7 -16.4 61.4 5 5 A E H > S+ 0 0 129 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.933 113.4 49.8 -58.2 -45.0 10.8 -15.1 63.5 6 6 A I H X S+ 0 0 9 -4,-2.3 4,-2.1 2,-0.2 3,-0.3 0.961 111.5 47.0 -57.7 -55.9 9.3 -13.6 60.3 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.3 5,-0.2 0.933 112.4 48.8 -53.4 -51.3 9.6 -16.9 58.4 8 8 A K H X S+ 0 0 94 -4,-2.9 4,-1.2 1,-0.2 -1,-0.3 0.822 109.9 54.8 -59.2 -30.1 8.2 -19.0 61.2 9 9 A K H <>S+ 0 0 56 -4,-1.8 5,-2.1 -3,-0.3 -1,-0.2 0.893 110.1 43.9 -70.5 -40.9 5.4 -16.4 61.4 10 10 A L H ><5S+ 0 0 0 -4,-2.1 3,-2.8 -3,-0.2 -2,-0.2 0.910 108.0 58.6 -70.2 -42.4 4.5 -16.8 57.8 11 11 A I H 3<5S+ 0 0 9 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.847 103.9 52.9 -55.7 -34.6 4.8 -20.6 57.9 12 12 A N T 3<5S- 0 0 110 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.361 121.0-114.8 -83.0 7.7 2.1 -20.5 60.6 13 13 A K T < 5 + 0 0 112 -3,-2.8 2,-0.5 1,-0.2 -3,-0.2 0.858 65.2 147.3 62.2 39.7 -0.0 -18.5 58.1 14 14 A S < - 0 0 53 -5,-2.1 -1,-0.2 0, 0.0 2,-0.1 -0.894 47.8-122.9-106.1 133.6 -0.0 -15.3 60.2 15 15 A D - 0 0 82 -2,-0.5 2,-0.1 1,-0.1 35,-0.1 -0.445 26.3-123.7 -74.0 148.9 -0.1 -12.0 58.4 16 16 A L - 0 0 1 -2,-0.1 2,-0.3 1,-0.1 38,-0.2 -0.325 22.9-107.3 -83.7 171.9 2.7 -9.6 59.1 17 17 A E > - 0 0 115 36,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.671 36.9-106.0 -93.7 157.8 2.3 -6.0 60.3 18 18 A I H > S+ 0 0 21 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.894 121.2 48.2 -49.8 -45.0 3.0 -3.3 57.8 19 19 A N H > S+ 0 0 111 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.864 109.7 50.3 -67.4 -37.8 6.3 -2.4 59.5 20 20 A E H > S+ 0 0 54 -3,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.959 113.7 47.3 -62.4 -48.9 7.5 -6.0 59.8 21 21 A A H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 -2,-0.2 0.887 112.5 48.9 -58.6 -43.1 6.8 -6.5 56.1 22 22 A E H X S+ 0 0 21 -4,-2.5 4,-2.6 -5,-0.2 -1,-0.2 0.857 113.7 44.7 -68.4 -37.7 8.5 -3.2 55.1 23 23 A E H X S+ 0 0 86 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.938 115.2 50.2 -70.0 -43.2 11.7 -4.0 57.1 24 24 A L H X S+ 0 0 0 -4,-3.1 4,-2.2 -5,-0.3 -2,-0.2 0.942 112.5 45.9 -55.8 -52.0 11.5 -7.5 55.7 25 25 A A H X S+ 0 0 0 -4,-3.2 4,-2.9 1,-0.2 5,-0.3 0.951 110.1 55.4 -56.8 -50.7 11.2 -6.2 52.2 26 26 A K H X S+ 0 0 27 -4,-2.6 4,-1.0 1,-0.2 -1,-0.2 0.849 108.3 48.0 -52.7 -38.5 14.0 -3.7 52.8 27 27 A A H X>S+ 0 0 6 -4,-2.2 5,-2.0 2,-0.2 4,-1.2 0.948 113.9 46.0 -69.1 -46.5 16.3 -6.5 53.8 28 28 A I H ><5S+ 0 0 1 -4,-2.2 3,-0.7 1,-0.2 5,-0.3 0.944 113.6 46.8 -60.6 -51.4 15.5 -8.6 50.8 29 29 A I H 3<5S+ 0 0 3 -4,-2.9 130,-0.4 1,-0.2 -1,-0.2 0.729 109.6 57.0 -66.4 -20.0 15.7 -5.9 48.2 30 30 A R H 3<5S- 0 0 110 -4,-1.0 -1,-0.2 -5,-0.3 -2,-0.2 0.765 112.7-117.1 -82.2 -25.2 19.0 -4.8 49.8 31 31 A G T <<5S+ 0 0 46 -4,-1.2 -3,-0.2 -3,-0.7 -2,-0.1 0.595 80.0 121.4 99.1 13.6 20.7 -8.1 49.3 32 32 A E < + 0 0 129 -5,-2.0 -4,-0.2 -6,-0.2 -3,-0.1 0.097 54.6 78.1 -97.1 22.5 21.1 -8.8 53.0 33 33 A V S S- 0 0 12 -6,-0.3 5,-0.1 -5,-0.3 -1,-0.0 -0.975 85.7-112.3-135.2 122.7 19.1 -12.0 53.1 34 34 A P >> - 0 0 71 0, 0.0 4,-1.9 0, 0.0 3,-1.3 -0.177 27.9-120.0 -50.4 135.9 20.4 -15.4 51.9 35 35 A E H 3> S+ 0 0 96 1,-0.3 4,-3.3 2,-0.2 5,-0.3 0.848 112.3 61.6 -47.5 -42.9 18.7 -16.7 48.8 36 36 A I H 3> S+ 0 0 11 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.913 110.0 41.8 -53.7 -40.5 17.5 -19.8 50.6 37 37 A L H <> S+ 0 0 15 -3,-1.3 4,-2.7 2,-0.2 -1,-0.2 0.834 112.1 52.4 -77.5 -31.8 15.6 -17.5 53.0 38 38 A V H X S+ 0 0 5 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.945 112.8 46.4 -68.2 -42.5 14.3 -15.2 50.2 39 39 A S H X S+ 0 0 0 -4,-3.3 4,-2.5 2,-0.2 5,-0.3 0.961 112.9 49.5 -60.0 -51.3 13.0 -18.2 48.4 40 40 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.3 -2,-0.2 0.922 114.3 45.9 -53.0 -48.4 11.4 -19.6 51.6 41 41 A I H X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.934 111.6 48.3 -62.4 -51.1 9.8 -16.3 52.3 42 42 A L H X S+ 0 0 0 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.871 115.8 47.0 -60.4 -34.2 8.4 -15.6 48.8 43 43 A V H X S+ 0 0 0 -4,-2.5 4,-2.0 -5,-0.3 -1,-0.2 0.849 112.3 48.9 -75.2 -34.6 7.0 -19.1 48.8 44 44 A A H X S+ 0 0 0 -4,-2.3 4,-1.9 -5,-0.3 5,-0.3 0.959 110.0 51.7 -67.2 -49.6 5.6 -18.8 52.3 45 45 A L H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.874 111.1 48.5 -53.0 -45.0 3.9 -15.5 51.4 46 46 A R H < S+ 0 0 80 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.926 112.1 45.7 -67.0 -46.2 2.3 -17.0 48.4 47 47 A M H < S+ 0 0 9 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.724 115.6 47.7 -71.0 -20.2 0.9 -20.1 50.0 48 48 A K H < S- 0 0 33 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.861 117.7-118.7 -83.1 -35.2 -0.4 -18.0 52.9 49 49 A G < - 0 0 33 -4,-2.1 -3,-0.2 -5,-0.3 -2,-0.1 0.516 31.9 -95.6 96.2 111.5 -1.9 -15.6 50.4 50 50 A E - 0 0 32 -4,-0.1 2,-0.2 1,-0.1 -35,-0.1 -0.258 41.5-146.1 -60.5 143.7 -0.4 -12.1 50.8 51 51 A S > - 0 0 18 1,-0.1 4,-2.1 153,-0.0 5,-0.2 -0.571 26.6 -97.1-106.2 173.0 -2.3 -9.6 52.9 52 52 A K H > S+ 0 0 66 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.939 121.0 49.2 -52.6 -58.7 -2.8 -5.9 52.7 53 53 A N H > S+ 0 0 35 1,-0.2 4,-3.9 2,-0.2 -1,-0.2 0.890 110.3 53.9 -50.6 -43.4 -0.2 -4.9 55.3 54 54 A E H > S+ 0 0 0 2,-0.2 4,-2.8 -38,-0.2 -1,-0.2 0.920 111.3 43.1 -58.4 -48.3 2.3 -7.1 53.4 55 55 A I H X S+ 0 0 0 -4,-2.1 4,-3.4 2,-0.2 5,-0.3 0.981 117.3 47.1 -60.0 -57.2 1.6 -5.4 50.1 56 56 A V H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.902 112.5 51.8 -49.7 -46.7 1.7 -2.0 51.7 57 57 A G H X S+ 0 0 0 -4,-3.9 4,-1.8 -5,-0.3 -1,-0.2 0.948 113.5 41.0 -57.4 -54.5 4.9 -3.0 53.5 58 58 A F H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 5,-0.2 0.896 112.6 55.0 -62.2 -43.4 6.7 -4.2 50.4 59 59 A A H X S+ 0 0 0 -4,-3.4 4,-2.7 1,-0.2 5,-0.2 0.954 108.7 48.0 -55.8 -52.3 5.5 -1.2 48.3 60 60 A R H X S+ 0 0 84 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.880 111.4 51.6 -57.1 -38.4 6.8 1.3 50.8 61 61 A A H X S+ 0 0 0 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.972 111.7 46.0 -62.6 -52.6 10.1 -0.6 50.8 62 62 A M H X S+ 0 0 10 -4,-3.0 4,-1.3 2,-0.2 -2,-0.2 0.860 110.1 52.5 -58.3 -41.6 10.4 -0.5 47.0 63 63 A R H >< S+ 0 0 48 -4,-2.7 3,-1.0 -5,-0.2 -1,-0.2 0.979 109.5 51.6 -58.5 -51.9 9.5 3.1 46.7 64 64 A E H 3< S+ 0 0 90 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.893 114.6 40.3 -49.2 -50.5 12.2 3.9 49.3 65 65 A L H 3< S+ 0 0 43 -4,-2.2 91,-0.3 -5,-0.1 -1,-0.3 0.585 98.8 99.6 -79.4 -9.4 14.9 2.0 47.4 66 66 A A S << S- 0 0 7 -4,-1.3 2,-0.4 -3,-1.0 88,-0.2 -0.450 83.6-106.0 -82.6 151.3 13.9 3.1 44.0 67 67 A I - 0 0 65 86,-2.2 2,-0.2 -2,-0.1 -1,-0.1 -0.608 52.4-164.4 -71.4 126.8 15.4 5.9 41.9 68 68 A K - 0 0 118 -2,-0.4 2,-0.3 -4,-0.1 115,-0.2 -0.649 28.7-175.6-118.6 170.3 12.9 8.8 42.1 69 69 A I - 0 0 22 113,-1.4 2,-0.7 -2,-0.2 65,-0.1 -0.911 35.3-111.1-150.3 161.0 11.8 12.1 40.6 70 70 A D + 0 0 100 -2,-0.3 114,-0.1 1,-0.1 113,-0.1 -0.839 60.2 125.8-113.7 103.5 9.1 14.4 41.8 71 71 A V > + 0 0 10 112,-1.9 3,-2.3 -2,-0.7 115,-0.2 -0.391 16.7 159.1-146.4 57.9 5.9 14.7 39.7 72 72 A P T 3 S+ 0 0 39 0, 0.0 114,-2.9 0, 0.0 115,-0.3 0.782 72.2 64.7 -53.5 -32.8 3.0 13.9 42.1 73 73 A N T 3 S+ 0 0 90 112,-0.2 112,-0.1 113,-0.1 111,-0.1 0.584 88.0 100.7 -69.0 -9.9 0.6 15.8 39.9 74 74 A A < - 0 0 0 -3,-2.3 113,-1.4 109,-0.2 112,-0.5 -0.156 64.5-137.2 -75.3 168.1 1.2 13.2 37.2 75 75 A I E -ab 104 187A 0 28,-1.9 30,-1.8 111,-0.1 2,-0.3 -0.962 12.8-165.7-127.8 146.0 -0.9 10.2 36.2 76 76 A D E - b 0 188A 0 111,-1.5 113,-2.1 -2,-0.4 30,-0.1 -0.919 12.2-165.2-127.1 152.8 0.2 6.7 35.3 77 77 A T + 0 0 4 -2,-0.3 114,-0.2 111,-0.2 2,-0.1 0.026 37.8 141.9-127.5 27.0 -1.8 3.9 33.6 78 78 A A - 0 0 7 100,-0.1 2,-0.3 112,-0.1 30,-0.1 -0.413 31.8-159.7 -73.0 142.1 0.4 0.8 34.4 79 79 A G - 0 0 28 111,-0.2 113,-0.2 -2,-0.1 111,-0.1 -0.766 30.4-110.8-115.1 167.2 -1.3 -2.5 35.2 80 80 A T - 0 0 21 111,-3.0 112,-0.2 -2,-0.3 97,-0.1 0.835 50.9-157.8 -65.3 -32.7 0.1 -5.5 37.0 81 81 A G + 0 0 24 110,-0.4 -1,-0.2 1,-0.1 112,-0.1 -0.421 48.7 123.7 83.6-165.9 0.1 -7.6 33.8 82 82 A G + 0 0 49 -2,-0.1 -1,-0.1 31,-0.1 110,-0.0 0.304 42.6 107.6 93.4 -9.1 0.1 -11.4 33.8 83 83 A D - 0 0 34 1,-0.1 109,-0.0 30,-0.0 -2,-0.0 0.770 59.9-162.1 -73.7 -22.8 -3.0 -12.0 31.7 84 84 A G + 0 0 45 1,-0.1 -1,-0.1 29,-0.1 138,-0.1 0.599 48.5 124.8 52.9 22.3 -0.8 -13.2 28.9 85 85 A L S S- 0 0 75 136,-0.1 -1,-0.1 29,-0.0 29,-0.1 0.364 73.9-125.1 -89.4 4.2 -3.4 -12.8 26.1 86 86 A G + 0 0 16 27,-0.2 177,-3.0 1,-0.1 179,-0.1 0.782 44.7 173.7 59.1 32.5 -1.1 -10.6 24.1 87 87 A T B -H 262 0B 10 175,-0.3 175,-0.3 1,-0.1 -1,-0.1 -0.205 42.8 -80.1 -66.2 164.3 -3.5 -7.7 23.7 88 88 A V - 0 0 1 173,-2.7 2,-2.9 1,-0.1 -1,-0.1 -0.242 54.0 -93.1 -61.8 152.3 -2.4 -4.4 22.2 89 89 A N > + 0 0 19 1,-0.2 4,-1.9 177,-0.1 3,-0.4 -0.298 61.7 163.9 -69.8 63.6 -0.4 -2.1 24.5 90 90 A V H > + 0 0 1 -2,-2.9 4,-3.8 1,-0.2 5,-0.3 0.900 64.4 47.0 -45.8 -71.0 -3.5 -0.1 25.6 91 91 A S H > S+ 0 0 18 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.801 111.7 54.6 -52.2 -30.2 -2.6 1.9 28.7 92 92 A T H > S+ 0 0 4 -3,-0.4 4,-1.0 2,-0.2 3,-0.3 0.966 113.2 41.2 -65.4 -50.5 0.6 3.0 26.9 93 93 A A H >X S+ 0 0 0 -4,-1.9 3,-1.3 1,-0.3 4,-1.3 0.935 114.2 53.2 -58.2 -46.9 -1.4 4.3 24.0 94 94 A S H 3X S+ 0 0 0 -4,-3.8 4,-1.8 1,-0.3 -1,-0.3 0.780 101.5 60.5 -59.3 -29.2 -3.9 5.6 26.5 95 95 A A H 3X S+ 0 0 0 -4,-1.4 4,-1.4 -3,-0.3 -1,-0.3 0.761 99.4 57.0 -70.8 -26.6 -0.9 7.4 28.2 96 96 A I H << S+ 0 0 5 -3,-1.3 4,-0.4 -4,-1.0 -1,-0.2 0.884 106.7 47.4 -71.5 -39.9 -0.3 9.3 25.1 97 97 A L H >< S+ 0 0 0 -4,-1.3 3,-1.3 1,-0.2 4,-0.3 0.917 110.2 53.2 -68.0 -40.7 -3.8 10.8 25.0 98 98 A L H >< S+ 0 0 0 -4,-1.8 3,-2.0 1,-0.3 4,-0.5 0.863 96.3 65.5 -61.4 -37.4 -3.6 11.7 28.7 99 99 A S T 3< S+ 0 0 1 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.665 88.1 71.8 -61.7 -15.2 -0.4 13.7 28.3 100 100 A L T < S+ 0 0 49 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.775 116.8 17.3 -70.9 -25.9 -2.3 16.1 26.1 101 101 A V S < S+ 0 0 39 -3,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.150 132.3 23.2-134.4 18.8 -4.1 17.5 29.2 102 102 A N S S- 0 0 16 -4,-0.5 -1,-0.3 -3,-0.1 -27,-0.1 -0.816 88.2 -87.3 179.9 139.7 -2.1 16.3 32.2 103 103 A P - 0 0 18 0, 0.0 -28,-1.9 0, 0.0 2,-0.5 -0.303 44.4-153.8 -57.0 133.4 1.5 15.3 33.0 104 104 A V E -ac 75 145A 0 40,-2.4 42,-2.2 -30,-0.2 2,-0.7 -0.945 19.2-174.9-120.8 124.2 2.0 11.6 32.4 105 105 A A E - c 0 146A 1 -30,-1.8 2,-0.7 -2,-0.5 42,-0.2 -0.797 17.3-162.9-113.0 85.6 4.6 9.4 34.1 106 106 A K E - c 0 147A 4 40,-1.9 42,-2.8 -2,-0.7 2,-0.4 -0.603 3.0-163.2 -77.2 112.7 4.3 6.0 32.4 107 107 A H E + c 0 148A 6 -2,-0.7 2,-0.3 40,-0.2 42,-0.2 -0.758 28.7 123.1 -96.0 135.8 5.9 3.2 34.4 108 108 A G E - c 0 149A 14 40,-1.8 42,-2.3 -2,-0.4 43,-0.2 -0.997 41.0-133.6-176.9 172.4 6.6 -0.1 32.7 109 109 A N - 0 0 72 -2,-0.3 10,-2.2 40,-0.2 11,-0.4 -0.698 39.7 -85.2-128.4 179.4 8.9 -2.9 31.6 110 110 A R - 0 0 82 -2,-0.2 8,-0.2 9,-0.2 -1,-0.1 -0.335 69.0 -60.6 -81.5 173.3 9.5 -4.9 28.4 111 111 A A + 0 0 34 6,-0.2 -1,-0.2 1,-0.2 3,-0.2 -0.262 42.8 173.2 -62.1 136.7 7.3 -8.0 27.6 112 112 A V S S+ 0 0 145 1,-0.3 2,-0.6 -3,-0.1 -1,-0.2 0.682 81.7 39.1-106.7 -38.6 7.2 -11.0 29.9 113 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17.6-175.9-112.3 146.9 -40.1 30.6 98.8 591 246 B L E -P 576 0D 13 -15,-2.5 -15,-2.3 -2,-0.4 2,-0.4 -0.974 19.6-149.0-143.4 154.6 -40.3 31.5 95.2 592 247 B N E > -P 575 0D 43 -2,-0.3 3,-2.5 -17,-0.2 4,-0.2 -0.963 29.4-124.6-122.4 143.5 -41.5 30.2 91.9 593 248 B V G > >S+ 0 0 0 -19,-2.2 3,-2.3 -2,-0.4 5,-0.7 0.875 113.1 68.4 -51.0 -34.2 -40.0 31.1 88.6 594 249 B T G > 5S+ 0 0 70 1,-0.3 3,-2.0 2,-0.2 -1,-0.3 0.801 84.7 68.5 -54.2 -32.2 -43.5 32.0 87.8 595 250 B D G < 5S+ 0 0 65 -3,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.513 89.8 63.6 -68.5 -3.8 -43.3 34.9 90.2 596 251 B F G < 5S- 0 0 3 -3,-2.3 -1,-0.3 -4,-0.2 -2,-0.2 0.326 121.1-107.1 -98.6 4.6 -40.8 36.6 87.9 597 252 B G T < 5S+ 0 0 44 -3,-2.0 2,-0.2 1,-0.3 -3,-0.2 0.754 84.5 100.3 78.2 24.2 -43.6 36.9 85.3 598 253 B I S - 0 0 42 0, 0.0 3,-1.4 0, 0.0 4,-0.3 -0.697 22.7-145.3 -79.5 115.9 -36.3 24.5 79.6 603 258 B I G > S+ 0 0 31 -2,-0.8 3,-1.6 1,-0.3 4,-0.3 0.699 89.6 75.5 -55.0 -21.3 -33.1 23.5 81.4 604 259 B E G > S+ 0 0 134 1,-0.3 3,-1.4 2,-0.2 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4,-2.6 2,-0.2 -2,-0.2 0.976 109.2 50.0 -62.0 -55.0 -20.8 29.3 77.9 615 270 B A H X S+ 0 0 0 -4,-2.4 4,-3.5 1,-0.2 5,-0.2 0.905 110.3 50.0 -49.6 -50.7 -19.4 32.7 76.7 616 271 B I H X S+ 0 0 28 -4,-2.7 4,-3.4 1,-0.2 5,-0.3 0.909 109.4 50.9 -59.6 -42.7 -21.3 32.5 73.4 617 272 B K H X S+ 0 0 38 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.943 113.3 46.2 -61.6 -42.7 -24.6 31.7 75.2 618 273 B I H X S+ 0 0 4 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.962 115.1 46.0 -63.1 -50.4 -23.9 34.7 77.5 619 274 B V H X S+ 0 0 0 -4,-3.5 4,-2.0 2,-0.2 6,-0.2 0.938 112.2 49.7 -59.0 -48.2 -23.0 37.0 74.6 620 275 B R H <>S+ 0 0 74 -4,-3.4 5,-3.1 1,-0.2 6,-0.5 0.931 109.3 53.9 -56.1 -43.6 -26.0 35.9 72.4 621 276 B A H ><5S+ 0 0 2 -4,-2.5 3,-1.2 -5,-0.3 5,-0.3 0.897 109.3 47.3 -56.3 -42.5 -28.2 36.5 75.4 622 277 B F H 3<5S+ 0 0 16 -4,-2.1 43,-0.3 1,-0.3 -1,-0.3 0.788 109.3 54.7 -69.1 -29.4 -26.8 40.1 75.6 623 278 B L T 3<5S- 0 0 62 -4,-2.0 -1,-0.3 -3,-0.2 -2,-0.2 0.372 119.4-111.1 -84.7 4.4 -27.3 40.4 71.9 624 279 B G T < 5S+ 0 0 54 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-4,-2.0 4,-0.7 2,-0.2 -1,-0.2 0.764 114.5 42.5 -77.7 -20.1 -34.2 36.0 87.2 636 291 B N H >X S+ 0 0 0 -4,-0.8 4,-2.0 -3,-0.4 3,-0.7 0.905 111.7 51.9 -85.8 -48.7 -30.9 35.9 89.2 637 292 B T H 3X S+ 0 0 0 -4,-3.0 4,-3.1 1,-0.2 5,-0.3 0.891 102.8 63.0 -52.7 -40.6 -30.1 39.6 88.7 638 293 B A H 3X S+ 0 0 0 -4,-1.8 4,-1.1 1,-0.2 -1,-0.2 0.904 105.9 43.4 -50.7 -47.4 -33.6 40.3 90.0 639 294 B V H S+ 0 0 0 -4,-3.1 5,-2.5 1,-0.2 6,-0.6 0.797 107.0 54.0 -64.3 -29.1 -31.1 43.8 92.8 642 297 B F H ><5S+ 0 0 47 -4,-1.1 3,-2.6 -5,-0.3 -2,-0.2 0.942 103.4 55.5 -70.2 -44.2 -33.5 43.0 95.7 643 298 B A H 3<5S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.842 106.2 51.1 -55.4 -35.8 -30.5 42.5 98.0 644 299 B L T 3<5S- 0 0 12 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.412 113.1-122.6 -82.7 4.1 -29.3 46.0 97.0 645 300 B D T < 5S+ 0 0 105 -3,-2.6 -3,-0.2 -5,-0.2 -2,-0.1 0.840 74.3 130.5 58.8 32.2 -32.8 47.3 97.9 646 301 B R < + 0 0 100 -5,-2.5 2,-0.3 1,-0.1 -4,-0.2 0.662 65.2 40.3 -88.9 -16.9 -33.0 48.7 94.4 647 302 B V S S- 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B A H 3X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.718 97.2 64.4 -60.3 -20.5 -32.8 43.4 85.0 658 313 B D H 3X S+ 0 0 57 -4,-0.8 4,-1.1 -3,-0.4 -1,-0.2 0.927 99.1 48.8 -70.2 -45.8 -34.1 43.9 81.5 659 314 B H H << S+ 0 0 103 -4,-0.9 4,-0.4 -3,-0.6 -1,-0.2 0.765 112.4 51.6 -66.1 -23.9 -32.9 47.4 81.1 660 315 B L H >< S+ 0 0 8 -4,-1.1 3,-1.1 2,-0.2 4,-0.3 0.881 102.0 56.1 -81.1 -39.7 -29.4 46.3 82.3 661 316 B I H >X S+ 0 0 13 -4,-1.9 3,-0.8 1,-0.3 4,-0.5 0.807 100.6 61.8 -62.8 -27.4 -28.9 43.4 80.0 662 317 B E T 3< S+ 0 0 129 -4,-1.1 -1,-0.3 1,-0.2 4,-0.2 0.775 111.2 37.6 -68.8 -25.5 -29.4 45.8 77.0 663 318 B K T <> S+ 0 0 101 -3,-1.1 4,-1.8 -4,-0.4 -1,-0.2 0.295 96.9 90.0-106.9 8.9 -26.4 47.8 78.1 664 319 B S H <> S+ 0 0 0 -3,-0.8 4,-3.0 -4,-0.3 5,-0.2 0.826 76.7 55.9 -79.0 -33.6 -24.4 44.7 79.2 665 320 B L H X S+ 0 0 33 -4,-0.5 4,-2.0 -43,-0.3 -1,-0.2 0.907 113.2 44.7 -65.9 -36.9 -22.6 43.8 76.0 666 321 B D H > S+ 0 0 118 2,-0.2 4,-1.9 -4,-0.2 5,-0.2 0.971 113.4 50.4 -65.8 -51.9 -21.1 47.3 75.9 667 322 B K H X S+ 0 0 17 -4,-1.8 4,-2.5 1,-0.3 -2,-0.2 0.886 109.0 51.3 -51.0 -45.9 -20.3 47.2 79.5 668 323 B L H X S+ 0 0 3 -4,-3.0 4,-2.5 1,-0.2 -1,-0.3 0.929 107.9 55.1 -58.1 -44.9 -18.6 43.9 79.1 669 324 B N H X S+ 0 0 61 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.836 110.1 42.6 -59.1 -38.9 -16.6 45.4 76.3 670 325 B E H X S+ 0 0 83 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.935 111.9 54.7 -76.0 -42.2 -15.2 48.3 78.3 671 326 B I H < S+ 0 0 2 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.904 116.0 39.0 -53.1 -45.6 -14.5 46.0 81.3 672 327 B I H >< S+ 0 0 1 -4,-2.5 3,-1.1 1,-0.2 -1,-0.2 0.774 109.1 59.7 -77.9 -28.1 -12.4 43.8 79.1 673 328 B S H 3< S+ 0 0 66 -4,-1.6 3,-0.3 1,-0.2 -1,-0.2 0.778 108.6 48.1 -70.6 -22.7 -10.9 46.6 77.1 674 329 B M T 3< S+ 0 0 69 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.350 130.0 15.3 -97.9 5.2 -9.5 47.8 80.4 675 330 B N S < S+ 0 0 17 -3,-1.1 -202,-2.3 -5,-0.1 2,-0.3 -0.169 121.5 9.9-176.3 70.1 -8.1 44.5 81.5 676 331 B G B S-R 472 0F 42 -204,-0.3 2,-0.5 -3,-0.3 -204,-0.2 -0.984 94.4 -50.2 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130.6 989 299 C L T 3<5S- 0 0 20 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.399 114.6-122.7 -85.3 1.0 -6.2 -23.5 130.6 990 300 C D T < 5S+ 0 0 101 -3,-1.3 -3,-0.2 -5,-0.2 -2,-0.1 0.916 71.9 133.7 56.4 46.9 -8.8 -25.6 132.5 991 301 C R < + 0 0 94 -5,-2.4 2,-0.3 1,-0.1 -4,-0.2 0.571 66.6 35.7 -98.2 -14.8 -6.4 -26.1 135.4 992 302 C V - 0 0 11 -6,-0.6 -1,-0.1 -5,-0.1 -2,-0.1 -0.962 69.8-133.0-139.6 157.4 -9.0 -25.3 138.0 993 303 C G S S+ 0 0 57 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.819 84.8 0.7 -78.5 -33.4 -12.7 -25.7 138.6 994 304 C D S > S- 0 0 76 1,-0.0 4,-2.5 -11,-0.0 5,-0.1 -0.897 76.3 -94.3-147.6 178.3 -13.5 -22.2 139.7 995 305 C F H > S+ 0 0 25 -2,-0.3 4,-1.7 1,-0.2 5,-0.1 0.798 118.4 54.2 -69.1 -31.4 -12.2 -18.7 140.3 996 306 C R H > S+ 0 0 91 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.862 110.9 48.1 -71.0 -33.7 -11.5 -19.1 144.0 997 307 C E H > S+ 0 0 85 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.966 107.4 55.1 -68.7 -51.5 -9.5 -22.2 143.2 998 308 C G H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.865 109.2 48.9 -48.3 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76.6 1332 297 D F H ><5S+ 0 0 37 -4,-1.9 3,-0.8 1,-0.2 5,-0.2 0.899 106.6 54.4 -58.1 -37.0 4.7 -53.7 75.8 1333 298 D A H 3<5S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.912 104.5 49.6 -62.6 -46.5 5.9 -53.3 72.2 1334 299 D L H 3<5S- 0 0 18 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.544 112.6-126.3 -70.1 -5.2 8.4 -56.2 72.4 1335 300 D D T <<5S+ 0 0 95 -3,-0.8 -3,-0.2 -4,-0.6 -2,-0.1 0.878 75.2 125.6 60.7 41.8 5.5 -58.1 73.8 1336 301 D R S S- 0 0 78 -11,-0.1 4,-1.9 1,-0.1 5,-0.2 -0.999 75.7-133.7-145.9 137.1 -0.1 -55.1 80.4 1340 305 D F T 4 S+ 0 0 31 -2,-0.3 4,-0.5 1,-0.2 -8,-0.1 0.647 110.2 43.9 -65.3 -15.8 1.0 -51.4 80.8 1341 306 D R T > S+ 0 0 125 2,-0.2 4,-1.8 3,-0.1 -1,-0.2 0.707 107.0 58.7 -98.1 -26.5 1.5 -51.7 84.5 1342 307 D E H > S+ 0 0 86 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.878 105.8 52.1 -66.8 -35.5 3.3 -55.0 84.2 1343 308 D G H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.845 106.0 52.1 -68.3 -34.8 5.8 -53.2 82.0 1344 309 D Y H > S+ 0 0 26 -4,-0.5 4,-1.4 2,-0.2 -1,-0.2 0.862 110.9 49.2 -68.5 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0.966 111.6 48.6 -63.2 -52.2 24.9 -51.7 81.9 1358 323 D L H X S+ 0 0 4 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.906 109.5 55.9 -53.3 -42.0 25.7 -48.1 81.0 1359 324 D N H X S+ 0 0 44 -4,-3.0 4,-2.1 -5,-0.3 -1,-0.2 0.949 110.1 41.9 -56.7 -53.7 29.1 -48.7 82.6 1360 325 D E H X S+ 0 0 78 -4,-2.4 4,-0.9 1,-0.2 -1,-0.2 0.844 112.1 56.6 -65.0 -32.7 29.9 -51.7 80.4 1361 326 D I H X S+ 0 0 5 -4,-2.6 4,-1.4 -5,-0.2 3,-0.4 0.930 110.4 44.4 -64.3 -43.0 28.5 -49.9 77.3 1362 327 D I H < S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.890 109.2 53.2 -71.5 -39.2 30.8 -47.0 77.8 1363 328 D S H < S+ 0 0 66 -4,-2.1 3,-0.3 1,-0.2 -1,-0.2 0.653 110.4 49.2 -72.9 -11.5 34.0 -48.9 78.5 1364 329 D M H < S+ 0 0 75 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.782 129.9 17.2 -93.7 -30.2 33.6 -50.9 75.3 1365 330 D N S < S+ 0 0 12 -4,-1.4 -202,-2.0 -5,-0.2 2,-0.3 -0.608 126.6 5.7-139.2 75.0 32.9 -47.9 73.0 1366 331 D G B S-K 1162 0L 32 -3,-0.3 2,-0.7 -204,-0.3 -204,-0.2 -0.960 92.5 -46.2 150.7-168.1 34.1 -44.8 74.8 1367 332 D D > - 0 0 75 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