==== 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 UNKNOWN FUNCTION 10-SEP-07 2R85 . COMPND 2 MOLECULE: PURP PROTEIN PF1517; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR Y.ZHANG,R.H.WHITE,S.E.EALICK . 659 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33787.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 462 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 97 14.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 61 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 159 24.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.4 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 7 4 0 0 0 4 1 1 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 4 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 PARALLEL BRIDGES PER LADDER . 4 0 4 3 1 2 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 2 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 1 A M 0 0 43 0, 0.0 25,-0.2 0, 0.0 653,-0.2 0.000 360.0 360.0 360.0 139.0 36.9 33.9 46.7 2 2 A K + 0 0 104 651,-1.5 652,-0.1 23,-0.1 2,-0.1 0.919 360.0 77.5 -69.7 -45.1 33.2 33.2 46.1 3 3 A V S S- 0 0 23 650,-0.5 23,-0.5 61,-0.1 2,-0.3 -0.409 70.1-157.9 -64.1 133.7 33.6 34.1 42.4 4 4 A R E -a 64 0A 49 59,-2.2 61,-2.3 21,-0.1 2,-0.5 -0.898 13.9-127.5-112.1 151.8 35.2 31.5 40.2 5 5 A I E -ab 65 27A 2 21,-2.3 23,-2.1 -2,-0.3 2,-0.3 -0.868 30.0-177.4-102.4 127.5 36.9 32.2 36.8 6 6 A A E +ab 66 28A 0 59,-2.9 61,-2.8 -2,-0.5 2,-0.3 -0.904 6.2 169.9-122.4 147.9 35.8 30.2 33.8 7 7 A T E - b 0 29A 0 21,-2.0 23,-1.7 -2,-0.3 2,-0.2 -0.991 39.9 -92.8-152.2 158.4 36.9 30.1 30.2 8 8 A Y E - b 0 30A 25 59,-0.4 2,-2.2 -2,-0.3 4,-0.3 -0.481 47.7-109.2 -67.8 141.0 36.4 28.0 27.1 9 9 A A S S+ 0 0 6 21,-2.9 23,-0.3 -2,-0.2 2,-0.3 -0.419 87.1 57.5 -80.7 68.5 39.1 25.3 26.6 10 10 A S S > S+ 0 0 41 -2,-2.2 2,-2.7 21,-0.1 3,-1.0 -0.957 84.0 30.1-169.7 174.3 41.1 26.8 23.7 11 11 A H T 3 S- 0 0 53 -2,-0.3 279,-0.1 1,-0.3 -2,-0.1 -0.279 130.9 -9.2 71.6 -61.8 43.1 29.8 22.5 12 12 A S T 3> S+ 0 0 3 -2,-2.7 4,-2.6 -4,-0.3 -1,-0.3 0.146 90.3 122.5-157.3 17.8 44.5 31.2 25.8 13 13 A A H <> S+ 0 0 1 -3,-1.0 4,-2.8 2,-0.2 5,-0.3 0.827 74.0 57.4 -60.8 -35.2 42.8 29.2 28.5 14 14 A L H > S+ 0 0 51 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.971 112.6 40.9 -59.4 -51.3 46.1 27.9 30.0 15 15 A Q H > S+ 0 0 4 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.903 116.1 50.0 -60.7 -44.8 47.3 31.5 30.5 16 16 A I H X S+ 0 0 2 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.944 115.0 42.1 -62.1 -49.3 43.9 32.8 31.7 17 17 A L H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.873 112.6 52.5 -73.7 -34.4 43.4 30.0 34.3 18 18 A K H X S+ 0 0 82 -4,-2.5 4,-2.6 -5,-0.3 -1,-0.2 0.932 110.7 49.8 -61.0 -43.1 47.0 30.1 35.5 19 19 A G H X S+ 0 0 1 -4,-2.3 4,-1.1 -5,-0.2 -2,-0.2 0.910 110.4 50.3 -60.5 -43.2 46.6 33.9 36.0 20 20 A A H ><>S+ 0 0 0 -4,-2.2 5,-2.4 2,-0.2 3,-0.6 0.925 110.4 48.6 -59.9 -48.0 43.3 33.2 37.9 21 21 A K H ><5S+ 0 0 74 -4,-2.7 3,-2.1 1,-0.2 -2,-0.2 0.931 107.2 56.5 -58.0 -44.5 45.0 30.7 40.2 22 22 A D H 3<5S+ 0 0 61 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.766 108.2 48.5 -59.5 -26.7 47.9 33.1 40.8 23 23 A E T <<5S- 0 0 19 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.310 125.6 -99.5 -99.2 7.7 45.3 35.6 42.1 24 24 A G T < 5S+ 0 0 51 -3,-2.1 2,-0.3 1,-0.3 -3,-0.2 0.647 76.1 134.7 88.6 17.9 43.5 33.1 44.4 25 25 A F < - 0 0 6 -5,-2.4 -1,-0.3 -6,-0.1 2,-0.3 -0.710 55.7-121.9 -93.7 148.4 40.5 32.1 42.3 26 26 A E - 0 0 83 -23,-0.5 -21,-2.3 -2,-0.3 2,-0.3 -0.644 38.4-139.1 -78.8 150.0 39.2 28.6 41.7 27 27 A T E -b 5 0A 0 -2,-0.3 21,-1.7 -23,-0.2 20,-0.6 -0.850 20.2-167.9-125.7 148.5 39.1 27.9 38.0 28 28 A I E -bc 6 48A 0 -23,-2.1 -21,-2.0 -2,-0.3 2,-0.4 -0.999 1.3-170.0-134.8 128.9 36.9 26.2 35.4 29 29 A A E -bc 7 49A 0 19,-2.5 21,-2.6 -2,-0.4 2,-0.4 -0.934 9.4-171.2-110.5 144.0 37.6 25.1 31.8 30 30 A F E +bc 8 50A 0 -23,-1.7 -21,-2.9 -2,-0.4 2,-0.3 -1.000 34.5 71.7-136.0 138.3 34.9 24.0 29.5 31 31 A G S S+ 0 0 4 19,-2.1 2,-0.1 -2,-0.4 -21,-0.1 -0.965 73.7 10.9 163.1-149.3 35.1 22.5 26.1 32 32 A S > - 0 0 61 -2,-0.3 3,-1.1 -23,-0.3 4,-0.4 -0.391 50.8-137.6 -71.0 136.8 36.1 19.4 24.2 33 33 A S G > S+ 0 0 68 1,-0.2 3,-1.4 2,-0.2 -1,-0.1 0.840 100.8 70.5 -57.8 -36.1 36.8 16.2 26.1 34 34 A K G 3 S+ 0 0 176 1,-0.3 -1,-0.2 2,-0.1 4,-0.1 0.805 102.3 43.0 -50.2 -34.3 39.8 15.6 23.8 35 35 A V G X> S+ 0 0 46 -3,-1.1 3,-1.2 1,-0.2 4,-0.9 0.453 80.2 103.3 -99.5 -0.8 41.6 18.5 25.5 36 36 A K H X> S+ 0 0 83 -3,-1.4 4,-0.9 -4,-0.4 3,-0.8 0.876 78.3 56.7 -46.7 -46.8 40.8 17.8 29.2 37 37 A P H 3>>S+ 0 0 53 0, 0.0 4,-2.4 0, 0.0 5,-2.3 0.826 98.9 61.6 -58.4 -31.1 44.3 16.3 29.8 38 38 A L H <4>S+ 0 0 59 -3,-1.2 5,-1.6 1,-0.2 -2,-0.2 0.901 113.0 34.6 -58.5 -40.6 45.9 19.6 28.7 39 39 A Y H <<5S+ 0 0 12 -4,-0.9 7,-2.4 -3,-0.8 6,-0.7 0.484 130.0 31.6 -97.0 -6.9 44.2 21.6 31.4 40 40 A T H <5S+ 0 0 54 -4,-0.9 -2,-0.2 -3,-0.3 -1,-0.1 0.562 131.7 17.0-127.4 -20.6 44.2 19.0 34.2 41 41 A K T <5S+ 0 0 134 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.1 0.684 126.7 37.2-120.3 -62.1 47.3 16.8 33.7 42 42 A Y T + 0 0 4 0, 0.0 4,-2.5 0, 0.0 5,-0.2 -0.498 16.8 168.8 -82.6 72.5 27.4 24.5 30.4 56 56 A E H > S+ 0 0 52 -2,-2.0 4,-2.5 1,-0.2 5,-0.2 0.901 70.9 47.0 -54.5 -52.0 25.3 27.5 31.4 57 57 A E H > S+ 0 0 165 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.896 114.2 46.9 -61.4 -42.4 23.5 25.9 34.4 58 58 A E H > S+ 0 0 85 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.876 111.9 51.9 -66.8 -38.7 26.6 24.3 35.9 59 59 A L H <>S+ 0 0 0 -4,-2.5 5,-2.4 2,-0.2 -2,-0.2 0.899 109.0 49.4 -65.4 -41.6 28.5 27.6 35.5 60 60 A L H ><5S+ 0 0 74 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.922 110.2 51.6 -61.9 -42.5 25.8 29.6 37.3 61 61 A N H 3<5S+ 0 0 131 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.823 108.7 51.2 -63.3 -32.0 25.9 27.0 40.1 62 62 A L T 3<5S- 0 0 25 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.364 112.2-120.4 -86.9 4.2 29.7 27.4 40.4 63 63 A N T < 5 + 0 0 73 -3,-1.5 -59,-2.2 -4,-0.2 -3,-0.2 0.872 52.5 176.9 57.7 40.7 29.4 31.2 40.6 64 64 A A E < -a 4 0A 4 -5,-2.4 2,-0.4 -61,-0.2 -59,-0.2 -0.431 30.7-158.4 -78.7 147.3 31.5 31.6 37.5 65 65 A V E -a 5 0A 5 -61,-2.3 -59,-2.9 -2,-0.1 2,-0.5 -0.992 24.7-134.6-113.5 129.8 32.5 34.7 35.6 66 66 A V E -ad 6 88A 0 21,-3.0 23,-3.1 -2,-0.4 -59,-0.2 -0.769 9.6-156.6 -90.0 125.5 33.5 33.9 32.0 67 67 A V - 0 0 0 -61,-2.8 -59,-0.4 -2,-0.5 2,-0.3 -0.905 26.0-130.0 -93.3 116.9 36.6 35.4 30.6 68 68 A P - 0 0 9 0, 0.0 217,-0.6 0, 0.0 2,-0.1 -0.530 18.0-145.0 -73.9 127.8 36.1 35.4 26.8 69 69 A T > - 0 0 0 -2,-0.3 3,-1.2 215,-0.1 4,-0.3 -0.318 32.3 -98.2 -75.5 173.5 39.1 33.9 24.9 70 70 A G T 3 S+ 0 0 29 1,-0.2 -59,-0.1 2,-0.1 -1,-0.1 0.440 125.9 40.5 -73.7 -1.8 40.0 35.3 21.4 71 71 A S T 3> S+ 0 0 24 -61,-0.1 4,-1.7 -63,-0.1 -1,-0.2 0.142 79.9 114.8-127.2 19.4 38.1 32.4 19.8 72 72 A F H <> S+ 0 0 0 -3,-1.2 4,-1.6 1,-0.2 5,-0.3 0.900 80.4 42.5 -58.4 -48.9 35.1 32.4 22.1 73 73 A V H > S+ 0 0 30 -4,-0.3 4,-2.8 1,-0.2 -1,-0.2 0.837 107.6 62.2 -69.1 -34.9 32.5 33.5 19.4 74 74 A A H 4 S+ 0 0 86 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.914 112.6 36.0 -56.6 -42.5 34.1 31.2 16.8 75 75 A H H < S+ 0 0 82 -4,-1.7 -1,-0.2 -3,-0.1 -2,-0.2 0.747 131.7 27.1 -84.5 -27.1 33.2 28.1 19.0 76 76 A L H < S- 0 0 16 -4,-1.6 4,-0.3 -5,-0.2 -3,-0.2 0.731 103.4-118.6-107.3 -30.9 29.9 29.3 20.4 77 77 A G X - 0 0 30 -4,-2.8 4,-2.0 -5,-0.3 5,-0.2 0.198 26.2 -92.3 92.5 142.8 28.4 31.7 17.9 78 78 A I H > S+ 0 0 43 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.854 121.0 53.1 -57.0 -42.2 27.6 35.4 18.4 79 79 A E H > S+ 0 0 111 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.920 108.8 48.4 -62.2 -46.2 23.9 34.8 19.4 80 80 A L H 4 S+ 0 0 65 -4,-0.3 4,-0.4 1,-0.2 -1,-0.2 0.932 115.2 46.0 -60.7 -45.0 24.7 32.3 22.2 81 81 A V H >< S+ 0 0 0 -4,-2.0 3,-1.1 1,-0.2 -2,-0.2 0.931 111.5 50.3 -65.0 -46.2 27.4 34.6 23.6 82 82 A E H 3< S+ 0 0 51 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.855 117.5 40.7 -61.0 -34.3 25.3 37.8 23.4 83 83 A N T 3< S+ 0 0 108 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.373 83.8 132.4 -97.3 5.0 22.4 36.0 25.2 84 84 A M < - 0 0 9 -3,-1.1 4,-0.1 -4,-0.4 -3,-0.1 -0.267 46.1-154.1 -62.0 140.9 24.5 34.1 27.8 85 85 A K + 0 0 149 2,-0.1 -1,-0.1 0, 0.0 3,-0.1 0.630 69.8 93.3 -89.4 -19.2 23.3 34.3 31.4 86 86 A V S S- 0 0 1 1,-0.1 -21,-0.1 -21,-0.0 245,-0.1 -0.613 93.7 -98.9 -73.8 132.3 26.7 33.7 33.0 87 87 A P - 0 0 46 0, 0.0 -21,-3.0 0, 0.0 2,-0.4 -0.254 39.3-147.0 -55.7 142.9 28.5 37.0 33.7 88 88 A Y B -d 66 0A 5 243,-2.2 243,-2.3 -23,-0.2 2,-0.9 -0.947 10.7-127.9-121.9 127.4 31.0 38.0 31.0 89 89 A F B S+E 330 0B 4 -23,-3.1 2,-0.2 -2,-0.4 241,-0.2 -0.670 82.1 16.9 -80.5 110.6 34.2 39.8 31.7 90 90 A G S S- 0 0 5 239,-1.7 2,-0.7 -2,-0.9 241,-0.2 -0.723 107.5 -52.3 119.5-177.4 34.2 42.7 29.2 91 91 A N > - 0 0 17 170,-0.3 3,-1.7 -2,-0.2 4,-0.3 -0.882 37.2-159.0-101.9 111.5 31.5 44.4 27.2 92 92 A K T > S+ 0 0 26 -2,-0.7 3,-1.1 1,-0.3 4,-0.4 0.731 88.4 70.7 -61.7 -22.6 29.5 41.9 25.1 93 93 A R T >> S+ 0 0 140 1,-0.2 4,-1.0 164,-0.2 3,-0.7 0.782 85.2 68.8 -63.1 -27.3 28.5 44.8 22.8 94 94 A V H <> S+ 0 0 4 -3,-1.7 4,-2.3 1,-0.2 5,-0.3 0.784 80.5 77.6 -62.9 -26.8 32.0 45.0 21.4 95 95 A L H <> S+ 0 0 3 -3,-1.1 4,-0.8 -4,-0.3 -1,-0.2 0.884 98.5 40.4 -56.6 -43.7 31.7 41.6 19.7 96 96 A R H X> S+ 0 0 96 -3,-0.7 4,-2.5 -4,-0.4 3,-0.5 0.904 113.7 54.5 -70.0 -40.1 29.7 43.0 16.8 97 97 A W H 3< S+ 0 0 33 -4,-1.0 10,-0.2 1,-0.2 -2,-0.2 0.789 111.5 43.9 -66.1 -30.5 31.8 46.2 16.5 98 98 A E H 3< S+ 0 0 18 -4,-2.3 183,-0.3 1,-0.1 -1,-0.2 0.658 121.1 39.4 -84.9 -15.7 35.0 44.2 16.2 99 99 A S H << S+ 0 0 84 -4,-0.8 2,-0.5 -3,-0.5 -2,-0.2 0.765 91.9 82.4-109.9 -35.1 33.7 41.7 13.7 100 100 A D S X S- 0 0 73 -4,-2.5 4,-3.1 1,-0.1 5,-0.3 -0.690 73.5-141.1 -76.9 121.2 31.4 43.5 11.3 101 101 A R H > S+ 0 0 131 -2,-0.5 4,-2.2 1,-0.2 -1,-0.1 0.861 99.7 45.6 -53.2 -43.6 33.7 45.1 8.6 102 102 A N H > S+ 0 0 106 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.886 114.6 46.1 -69.7 -41.1 31.6 48.3 8.4 103 103 A L H > S+ 0 0 50 2,-0.2 4,-2.5 -7,-0.2 -2,-0.2 0.905 112.9 51.0 -67.0 -42.1 31.3 48.7 12.2 104 104 A E H X S+ 0 0 22 -4,-3.1 4,-2.5 -8,-0.2 -2,-0.2 0.919 110.6 48.7 -59.7 -46.0 35.0 48.0 12.7 105 105 A R H X S+ 0 0 91 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.2 0.894 111.3 50.1 -60.8 -42.9 35.9 50.6 10.0 106 106 A K H X S+ 0 0 113 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.903 111.2 49.2 -61.7 -43.7 33.6 53.2 11.7 107 107 A W H X S+ 0 0 0 -4,-2.5 4,-2.1 -10,-0.2 -2,-0.2 0.945 112.9 45.8 -60.3 -51.5 35.2 52.5 15.1 108 108 A L H <>S+ 0 0 5 -4,-2.5 5,-2.6 1,-0.2 -2,-0.2 0.866 112.8 50.9 -64.3 -37.1 38.8 52.8 13.8 109 109 A K H ><5S+ 0 0 174 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.931 110.4 48.6 -65.4 -45.6 37.9 56.0 11.9 110 110 A K H 3<5S+ 0 0 115 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.861 110.6 52.3 -60.6 -36.7 36.3 57.6 15.0 111 111 A A T 3<5S- 0 0 4 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.360 113.0-121.2 -81.8 3.6 39.5 56.6 16.9 112 112 A G T < 5 + 0 0 48 -3,-1.6 2,-0.5 1,-0.2 -3,-0.2 0.897 54.1 162.3 55.7 44.1 41.7 58.3 14.3 113 113 A I < - 0 0 12 -5,-2.6 2,-0.3 -6,-0.1 -1,-0.2 -0.841 43.7-116.9 -97.0 128.5 43.6 55.1 13.5 114 114 A R + 0 0 81 -2,-0.5 164,-3.0 162,-0.3 -5,-0.0 -0.490 46.6 165.4 -64.0 123.1 45.5 54.9 10.3 115 115 A V - 0 0 41 -2,-0.3 164,-0.1 162,-0.2 2,-0.1 -0.908 45.1 -79.6-135.1 159.3 44.0 52.1 8.1 116 116 A P - 0 0 7 0, 0.0 2,-0.1 0, 0.0 56,-0.1 -0.428 52.2-112.6 -61.2 133.3 44.3 51.1 4.4 117 117 A E - 0 0 93 -2,-0.1 54,-3.1 53,-0.1 2,-0.4 -0.430 28.7-136.2 -63.6 138.1 42.2 53.4 2.2 118 118 A V B -F 170 0C 47 52,-0.2 2,-0.5 -2,-0.1 52,-0.2 -0.862 10.8-150.7 -99.5 135.1 39.3 51.5 0.6 119 119 A Y - 0 0 13 50,-2.7 50,-0.5 -2,-0.4 6,-0.0 -0.924 14.0-175.7-106.4 123.9 38.6 52.0 -3.2 120 120 A E S S+ 0 0 170 -2,-0.5 -1,-0.1 1,-0.2 3,-0.1 0.768 78.2 44.5 -85.3 -26.4 35.0 51.6 -4.3 121 121 A D > - 0 0 68 1,-0.1 3,-2.2 48,-0.1 -1,-0.2 -0.977 68.5-150.3-124.7 121.4 35.8 52.2 -8.0 122 122 A P G > S+ 0 0 11 0, 0.0 3,-1.7 0, 0.0 26,-0.1 0.788 97.9 67.6 -57.1 -29.2 38.9 50.5 -9.7 123 123 A D G 3 S+ 0 0 65 1,-0.3 23,-0.1 22,-0.1 -3,-0.0 0.620 92.4 62.3 -70.1 -8.2 39.1 53.6 -12.0 124 124 A D G < S+ 0 0 103 -3,-2.2 -1,-0.3 20,-0.1 2,-0.2 0.429 71.9 125.1 -91.8 -3.5 40.1 55.6 -8.9 125 125 A I < + 0 0 7 -3,-1.7 23,-0.1 -4,-0.2 4,-0.0 -0.421 19.1 155.7 -63.1 122.9 43.3 53.6 -8.3 126 126 A E + 0 0 117 1,-0.3 -1,-0.2 -2,-0.2 18,-0.1 0.402 65.2 32.0-128.3 -5.0 46.3 56.1 -8.1 127 127 A K S S- 0 0 64 15,-0.1 -1,-0.3 0, 0.0 15,-0.1 -0.944 107.8 -62.7-145.2 160.7 48.7 54.0 -6.0 128 128 A P - 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0 0 15 -13,-0.2 23,-0.4 62,-0.0 2,-0.3 -0.939 68.7-144.7-138.4 146.1 37.0 49.5 53.6 336 4 B R E -n 396 0E 58 59,-2.0 61,-2.4 -2,-0.3 2,-0.5 -0.858 26.4-124.3-106.1 152.3 39.9 51.2 55.5 337 5 B I E -no 397 359E 2 21,-2.3 23,-2.3 -2,-0.3 2,-0.3 -0.869 32.1-177.5-101.9 127.2 41.0 49.7 58.9 338 6 B A E +no 398 360E 0 59,-3.0 61,-2.6 -2,-0.5 2,-0.3 -0.907 6.3 169.8-122.9 149.1 41.0 52.1 61.8 339 7 B T E - o 0 361E 0 21,-2.0 23,-1.9 -2,-0.3 2,-0.2 -0.991 40.0 -91.7-153.2 158.3 42.0 51.7 65.5 340 8 B Y E - o 0 362E 24 59,-0.4 2,-2.3 -2,-0.3 4,-0.3 -0.478 47.6-110.1 -66.9 139.8 42.5 53.7 68.7 341 9 B A S S+ 0 0 6 21,-2.7 23,-0.3 -2,-0.2 2,-0.3 -0.410 86.9 59.6 -78.8 67.5 46.2 54.9 69.0 342 10 B S S > S+ 0 0 40 -2,-2.3 2,-2.7 21,-0.1 3,-1.0 -0.959 83.7 28.0-167.3 174.1 47.2 52.7 72.0 343 11 B H T 3 S- 0 0 52 -2,-0.3 278,-0.1 1,-0.3 -2,-0.1 -0.267 131.0 -8.9 71.6 -61.1 47.6 49.1 73.2 344 12 B S T 3> S+ 0 0 3 -2,-2.7 4,-2.6 -4,-0.3 -1,-0.3 0.160 90.0 122.5-157.3 17.7 48.3 47.2 69.9 345 13 B A H <> S+ 0 0 1 -3,-1.0 4,-2.9 1,-0.2 5,-0.3 0.826 74.1 57.8 -61.2 -34.5 47.6 49.8 67.1 346 14 B L H > S+ 0 0 51 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.968 112.6 40.1 -59.1 -51.3 51.1 49.4 65.7 347 15 B Q H > S+ 0 0 3 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.899 116.7 50.4 -62.0 -44.8 50.6 45.6 65.2 348 16 B I H X S+ 0 0 3 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.949 115.1 41.3 -61.5 -49.7 47.0 46.1 64.0 349 17 B L H X S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.870 112.9 53.1 -73.4 -35.3 47.8 48.7 61.4 350 18 B K H X S+ 0 0 82 -4,-2.5 4,-2.4 -5,-0.3 -1,-0.2 0.932 110.5 49.4 -59.4 -45.3 51.0 47.0 60.2 351 19 B G H X S+ 0 0 0 -4,-2.4 4,-1.1 2,-0.2 -2,-0.2 0.892 110.3 50.6 -60.2 -41.0 48.9 43.9 59.6 352 20 B A H ><>S+ 0 0 0 -4,-2.1 5,-2.4 2,-0.2 3,-0.5 0.920 110.3 48.7 -63.2 -45.3 46.3 45.9 57.8 353 21 B K H ><5S+ 0 0 76 -4,-2.5 3,-1.7 1,-0.2 -2,-0.2 0.908 107.3 56.6 -60.2 -41.6 49.0 47.4 55.5 354 22 B D H 3<5S+ 0 0 63 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.770 108.1 48.5 -60.9 -27.6 50.4 44.0 54.9 355 23 B E T <<5S- 0 0 20 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.317 125.7 -98.6 -98.7 7.1 47.0 42.9 53.6 356 24 B G T < 5S+ 0 0 56 -3,-1.7 2,-0.3 1,-0.3 -3,-0.2 0.650 76.8 134.0 90.5 17.5 46.5 45.9 51.3 357 25 B F < - 0 0 7 -5,-2.4 -1,-0.3 -6,-0.1 2,-0.3 -0.715 55.7-122.3 -94.5 149.4 44.3 48.1 53.4 358 26 B E - 0 0 87 -23,-0.4 -21,-2.3 -2,-0.3 2,-0.3 -0.651 38.0-137.6 -80.7 149.7 44.7 51.9 54.0 359 27 B T E -o 337 0E 0 -2,-0.3 21,-1.7 -23,-0.2 20,-0.6 -0.855 20.5-168.4-124.8 147.8 45.0 52.6 57.7 360 28 B I E -op 338 380E 0 -23,-2.3 -21,-2.0 -2,-0.3 2,-0.4 -0.997 1.5-170.7-133.4 128.0 43.7 55.1 60.3 361 29 B A E -op 339 381E 0 19,-2.5 21,-2.6 -2,-0.4 2,-0.4 -0.947 9.2-171.7-111.2 141.3 44.9 55.7 63.8 362 30 B F E +op 340 382E 0 -23,-1.9 -21,-2.7 -2,-0.4 2,-0.3 -0.999 34.8 72.4-134.0 137.2 42.9 58.0 66.1 363 31 B G S S+ 0 0 4 19,-2.0 2,-0.1 -2,-0.4 23,-0.1 -0.950 72.9 11.2 165.4-144.0 43.8 59.2 69.6 364 32 B S > - 0 0 63 -23,-0.3 3,-1.1 -2,-0.3 4,-0.4 -0.401 50.2-135.7 -75.6 137.9 46.1 61.6 71.4 365 33 B S G > S+ 0 0 66 1,-0.2 3,-1.2 18,-0.2 -1,-0.1 0.833 102.2 68.6 -52.5 -36.0 48.2 64.3 69.6 366 34 B K G 3 S+ 0 0 180 1,-0.3 -1,-0.2 2,-0.1 4,-0.1 0.792 102.4 42.3 -57.2 -33.4 51.1 63.2 71.8 367 35 B V G X> S+ 0 0 43 -3,-1.1 3,-1.1 1,-0.2 4,-1.0 0.413 80.5 104.1-100.2 1.5 51.5 59.8 70.2 368 36 B K H X> S+ 0 0 79 -3,-1.2 4,-1.0 -4,-0.4 3,-0.7 0.880 78.1 56.0 -49.0 -46.9 51.0 60.9 66.5 369 37 B P H 3>>S+ 0 0 55 0, 0.0 4,-2.5 0, 0.0 5,-2.3 0.819 99.1 62.4 -57.1 -31.1 54.8 60.6 65.8 370 38 B L H <4>S+ 0 0 59 -3,-1.1 5,-1.6 1,-0.2 -2,-0.2 0.908 112.6 34.0 -59.3 -41.5 54.8 56.9 67.0 371 39 B Y H <<5S+ 0 0 11 -4,-1.0 7,-2.3 -3,-0.7 6,-1.6 0.501 130.4 32.0 -95.0 -8.2 52.4 55.9 64.2 372 40 B T H <5S+ 0 0 55 -4,-1.0 -2,-0.2 -3,-0.3 -1,-0.1 0.587 131.1 17.0-125.0 -22.1 53.6 58.2 61.5 373 41 B K T <5S+ 0 0 139 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.1 0.713 127.0 36.7-119.4 -60.2 57.3 58.7 62.0 374 42 B Y T + 0 0 3 0, 0.0 4,-2.3 0, 0.0 5,-0.2 -0.509 15.6 169.3 -83.1 72.9 36.0 60.9 65.3 388 56 B E H > S+ 0 0 58 -2,-1.8 4,-2.2 1,-0.2 5,-0.2 0.889 70.8 48.7 -54.5 -50.0 32.8 59.2 64.2 389 57 B E H > S+ 0 0 145 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.919 113.8 45.6 -58.8 -48.2 32.0 61.5 61.3 390 58 B E H > S+ 0 0 75 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.851 111.6 52.7 -65.4 -37.1 35.4 61.4 59.7 391 59 B L H <>S+ 0 0 0 -4,-2.3 5,-2.6 2,-0.2 -1,-0.2 0.869 109.9 48.3 -67.3 -38.2 35.6 57.6 60.2 392 60 B L H ><5S+ 0 0 78 -4,-2.2 3,-1.6 -5,-0.2 -2,-0.2 0.924 110.7 51.3 -65.1 -43.9 32.3 57.1 58.4 393 61 B N H 3<5S+ 0 0 120 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.805 110.4 49.7 -61.4 -31.3 33.5 59.4 55.6 394 62 B L T 3<5S- 0 0 30 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.304 111.8-120.7 -90.9 7.4 36.7 57.3 55.3 395 63 B N T < 5 + 0 0 101 -3,-1.6 -59,-2.0 1,-0.2 -3,-0.2 0.870 51.8 177.6 53.2 42.7 34.7 54.0 55.1 396 64 B A E < -n 336 0E 4 -5,-2.6 2,-0.4 -61,-0.2 -59,-0.2 -0.433 30.0-158.2 -78.4 146.2 36.5 52.8 58.2 397 65 B V E -n 337 0E 1 -61,-2.4 -59,-3.0 -2,-0.1 2,-0.5 -0.989 24.4-134.5-111.9 131.8 36.0 49.5 60.1 398 66 B V E -nq 338 420E 0 21,-3.0 23,-3.2 -2,-0.4 -59,-0.2 -0.790 10.1-157.6 -91.2 125.6 37.2 49.8 63.7 399 67 B V - 0 0 2 -61,-2.6 -59,-0.4 -2,-0.5 2,-0.2 -0.919 26.7-129.2 -94.0 116.6 39.3 47.0 65.1 400 68 B P - 0 0 8 0, 0.0 216,-0.6 0, 0.0 2,-0.1 -0.503 17.6-144.5 -71.9 131.7 39.0 47.2 68.8 401 69 B T > - 0 0 0 -2,-0.2 3,-1.2 214,-0.1 4,-0.3 -0.358 32.2 -99.0 -78.1 174.0 42.2 47.2 70.8 402 70 B G T 3 S+ 0 0 29 1,-0.2 -59,-0.1 2,-0.1 4,-0.1 0.480 125.7 39.4 -74.1 -5.1 42.5 45.6 74.2 403 71 B S T 3> S+ 0 0 23 -61,-0.1 4,-1.7 -63,-0.1 -1,-0.2 0.111 80.2 115.2-125.4 20.3 42.0 49.0 76.0 404 72 B F H <> S+ 0 0 0 -3,-1.2 4,-1.5 1,-0.2 5,-0.2 0.908 81.1 42.3 -58.7 -48.0 39.4 50.4 73.6 405 73 B V H > S+ 0 0 23 -4,-0.3 4,-2.8 1,-0.2 -1,-0.2 0.848 107.6 61.9 -69.3 -36.5 36.6 50.5 76.2 406 74 B A H 4 S+ 0 0 87 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.886 112.7 36.6 -55.7 -40.7 39.0 51.9 78.9 407 75 B H H < S+ 0 0 77 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.766 131.1 26.9 -84.7 -28.6 39.6 55.0 76.8 408 76 B L H < S- 0 0 14 -4,-1.5 4,-0.3 -5,-0.2 -3,-0.2 0.713 103.9-114.0-109.8 -28.9 36.1 55.5 75.3 409 77 B G X - 0 0 32 -4,-2.8 4,-2.0 -5,-0.2 5,-0.2 0.229 23.9 -96.6 95.3 140.4 33.6 54.1 77.8 410 78 B I H > S+ 0 0 46 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.846 120.2 52.2 -57.4 -41.2 31.3 51.1 77.3 411 79 B E H > S+ 0 0 141 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.916 109.0 49.0 -65.5 -45.1 28.2 53.1 76.3 412 80 B L H 4 S+ 0 0 59 -4,-0.3 4,-0.5 2,-0.2 -1,-0.2 0.913 115.0 45.6 -59.9 -44.6 30.1 55.1 73.6 413 81 B V H >< S+ 0 0 0 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.948 110.6 51.4 -66.8 -49.0 31.5 51.8 72.1 414 82 B E H 3< S+ 0 0 55 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.828 118.0 40.0 -56.5 -32.8 28.2 49.9 72.3 415 83 B N T 3< S+ 0 0 95 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.372 83.1 131.4-101.3 3.7 26.4 52.7 70.4 416 84 B M < - 0 0 7 -3,-1.3 4,-0.1 -4,-0.5 -3,-0.1 -0.264 46.8-153.1 -60.4 141.2 29.1 53.6 67.9 417 85 B K S S+ 0 0 137 2,-0.1 -1,-0.1 0, 0.0 3,-0.1 0.646 70.2 94.4 -90.2 -18.9 27.9 53.9 64.3 418 86 B V S S- 0 0 1 1,-0.1 -21,-0.1 -21,-0.0 244,-0.1 -0.601 93.8 -99.2 -72.2 130.5 31.2 53.0 62.7 419 87 B P - 0 0 47 0, 0.0 -21,-3.0 0, 0.0 2,-0.4 -0.231 39.5-147.0 -55.2 143.5 31.3 49.3 62.0 420 88 B Y B -q 398 0E 4 242,-2.2 242,-2.3 -23,-0.2 2,-0.8 -0.950 11.1-127.4-122.5 126.8 33.2 47.3 64.6 421 89 B F B S+R 661 0F 5 -23,-3.2 2,-0.2 -2,-0.4 240,-0.2 -0.671 82.0 16.3 -79.0 110.5 35.2 44.1 64.0 422 90 B G S S- 0 0 7 238,-1.8 2,-0.7 -2,-0.8 240,-0.3 -0.711 106.5 -51.0 119.8-175.4 33.9 41.5 66.5 423 91 B N > - 0 0 14 169,-0.3 3,-1.8 -2,-0.2 4,-0.4 -0.875 36.1-159.5-103.7 110.8 30.7 41.2 68.6 424 92 B K T > S+ 0 0 24 -2,-0.7 3,-1.1 1,-0.3 4,-0.4 0.761 88.3 71.2 -59.8 -24.4 30.0 44.3 70.7 425 93 B R T 3> S+ 0 0 146 1,-0.2 4,-0.7 163,-0.2 3,-0.5 0.733 86.1 66.4 -63.1 -23.1 27.8 42.2 73.0 426 94 B V H <> S+ 0 0 4 -3,-1.8 4,-2.0 1,-0.2 5,-0.3 0.777 80.9 80.2 -68.9 -27.4 30.9 40.5 74.3 427 95 B L H <> S+ 0 0 1 -3,-1.1 4,-0.9 -4,-0.4 -1,-0.2 0.856 95.9 41.1 -54.3 -43.5 32.1 43.7 76.0 428 96 B R H > S+ 0 0 113 -3,-0.5 4,-2.3 -4,-0.4 -1,-0.3 0.875 113.2 55.2 -71.7 -35.2 29.8 43.4 79.0 429 97 B W H < S+ 0 0 37 -4,-0.7 10,-0.2 1,-0.2 -2,-0.2 0.775 111.5 42.7 -69.3 -29.7 30.4 39.7 79.4 430 98 B E H < S+ 0 0 18 -4,-2.0 182,-0.3 1,-0.1 -1,-0.2 0.670 119.3 43.6 -87.7 -18.3 34.2 40.0 79.5 431 99 B S H < S+ 0 0 73 -4,-0.9 2,-0.5 -5,-0.3 -2,-0.2 0.845 92.5 79.8 -96.3 -43.5 34.1 43.0 81.9 432 100 B D S X S- 0 0 75 -4,-2.3 4,-3.0 1,-0.1 5,-0.3 -0.608 72.8-142.9 -75.6 119.7 31.5 42.2 84.5 433 101 B R H > S+ 0 0 154 -2,-0.5 4,-1.9 1,-0.2 -1,-0.1 0.839 99.0 46.6 -49.3 -43.9 33.1 39.9 87.1 434 102 B N H > S+ 0 0 122 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.905 115.2 43.9 -70.3 -44.1 29.8 37.9 87.5 435 103 B L H > S+ 0 0 53 2,-0.2 4,-2.6 -7,-0.2 -2,-0.2 0.877 111.7 54.7 -67.6 -39.3 29.1 37.5 83.8 436 104 B E H X S+ 0 0 20 -4,-3.0 4,-2.3 2,-0.2 -2,-0.2 0.926 111.0 45.0 -59.2 -46.4 32.7 36.6 83.1 437 105 B R H X S+ 0 0 52 -4,-1.9 4,-2.6 -5,-0.3 -2,-0.2 0.893 111.0 53.4 -64.8 -41.9 32.6 33.8 85.6 438 106 B K H X S+ 0 0 106 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.910 110.1 49.0 -57.1 -44.4 29.2 32.6 84.3 439 107 B W H X S+ 0 0 1 -4,-2.6 4,-2.3 -10,-0.2 -2,-0.2 0.933 111.2 48.0 -63.2 -48.5 30.7 32.4 80.8 440 108 B L H <>S+ 0 0 4 -4,-2.3 5,-2.6 1,-0.2 -2,-0.2 0.895 112.7 49.3 -61.4 -40.1 33.8 30.5 82.0 441 109 B K H ><5S+ 0 0 120 -4,-2.6 3,-1.6 3,-0.2 -1,-0.2 0.903 109.2 51.6 -64.1 -43.4 31.6 28.1 83.9 442 110 B K H 3<5S+ 0 0 105 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.910 109.1 51.6 -58.0 -41.9 29.3 27.6 80.9 443 111 B A T 3<5S- 0 0 5 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.366 114.7-119.1 -77.6 3.1 32.5 26.8 78.8 444 112 B G T < 5 + 0 0 49 -3,-1.6 2,-0.4 1,-0.2 -3,-0.2 0.886 57.1 160.0 58.6 41.0 33.6 24.2 81.4 445 113 B I < - 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