==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SYNTHASE 20-OCT-03 1UQU . COMPND 2 MOLECULE: ALPHA, ALPHA-TREHALOSE-PHOSPHATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR R.P.GIBSON,C.A.TARLING,S.ROBERTS,S.G.WITHERS,G.J.DAVIES . 901 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36379.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 653 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 123 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 3.8 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 . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 48 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 103 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 311 34.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 2.1 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 4 2 2 2 2 5 2 0 3 1 6 0 0 3 2 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 2 5 9 2 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 1 0 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 2 0 0 0 1 1 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 S 0 0 103 0, 0.0 121,-0.1 0, 0.0 120,-0.1 0.000 360.0 360.0 360.0 -90.2 37.2 43.8 -7.1 2 2 A R - 0 0 58 1,-0.1 120,-2.8 119,-0.1 2,-0.5 -0.173 360.0-144.7 -60.9 138.7 37.1 40.0 -7.3 3 3 A L E -ab 33 122A 1 29,-2.5 31,-2.5 118,-0.2 2,-0.5 -0.877 10.7-167.5-103.9 132.1 37.4 38.0 -4.1 4 4 A V E -ab 34 123A 0 118,-3.0 120,-3.3 -2,-0.5 2,-0.5 -0.979 9.0-174.8-115.0 129.0 39.2 34.7 -4.0 5 5 A V E -ab 35 124A 0 29,-2.7 31,-2.6 -2,-0.5 2,-0.4 -0.982 1.9-173.9-119.1 127.5 38.7 32.6 -0.8 6 6 A V E +ab 36 125A 1 118,-2.4 120,-2.1 -2,-0.5 2,-0.3 -0.996 12.3 155.5-126.2 142.9 40.5 29.5 -0.1 7 7 A S E - 0 0 9 29,-1.4 31,-0.5 -2,-0.4 120,-0.1 -0.954 56.2 -96.2-147.0 162.4 39.9 27.1 2.8 8 8 A N E S+ 0 0 13 118,-0.5 30,-0.9 -2,-0.3 2,-0.3 0.823 111.4 21.0 -54.2 -39.5 40.5 23.4 3.5 9 9 A R E S-a 38 0A 134 28,-0.2 2,-0.3 30,-0.1 30,-0.1 -0.927 73.2-155.6-125.4 160.1 36.9 22.6 2.6 10 10 A I - 0 0 24 28,-0.6 27,-0.1 -2,-0.3 49,-0.0 -0.945 13.2-133.7-132.5 152.6 34.3 24.5 0.5 11 11 A A - 0 0 36 -2,-0.3 6,-0.0 10,-0.1 -2,-0.0 -0.853 21.4-164.2-112.6 98.9 30.5 24.6 0.3 12 12 A P - 0 0 63 0, 0.0 46,-0.0 0, 0.0 -2,-0.0 -0.474 43.8 -81.6 -79.1 156.9 29.0 24.4 -3.2 13 13 A P 0 0 74 0, 0.0 -2,-0.0 0, 0.0 41,-0.0 0.606 360.0 360.0 -29.2 -59.3 25.3 25.3 -3.8 14 14 A D 0 0 200 2,-0.0 -3,-0.0 0, 0.0 0, 0.0 -0.770 360.0 360.0-116.0 360.0 23.6 22.0 -2.8 15 ! 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 16 19 A S 0 0 132 0, 0.0 2,-0.6 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 95.8 23.5 22.5 4.9 17 20 A A - 0 0 46 1,-0.1 5,-0.0 4,-0.1 -6,-0.0 -0.496 360.0-158.3 -81.7 109.6 25.1 26.0 5.4 18 21 A G > - 0 0 28 -2,-0.6 4,-2.1 1,-0.1 5,-0.2 -0.147 33.4 -91.5 -76.3 172.7 27.4 26.4 8.4 19 22 A G H > S+ 0 0 7 1,-0.2 4,-0.9 2,-0.2 204,-0.1 0.881 123.7 40.0 -49.8 -54.7 28.5 29.5 10.3 20 23 A L H >> S+ 0 0 51 1,-0.2 4,-2.5 2,-0.2 3,-0.5 0.913 111.0 59.3 -64.8 -42.2 31.7 30.2 8.3 21 24 A A H 3> S+ 0 0 12 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.883 101.5 53.5 -54.7 -45.2 30.1 29.3 5.0 22 25 A V H 3X S+ 0 0 29 -4,-2.1 4,-1.7 2,-0.2 -1,-0.3 0.854 111.0 48.9 -60.0 -32.8 27.4 32.0 5.3 23 26 A G H + 0 0 119 1,-0.1 3,-0.7 2,-0.1 19,-0.2 0.851 53.6 161.6 51.0 47.9 42.3 10.1 -8.1 45 48 A E T 3 + 0 0 63 1,-0.3 2,-0.3 17,-0.1 18,-0.3 0.775 58.0 73.6 -62.9 -31.3 44.1 13.5 -7.7 46 49 A D T 3 S+ 0 0 150 16,-0.1 -1,-0.3 3,-0.0 -2,-0.1 -0.039 70.6 104.7 -87.9 32.6 45.1 13.7 -11.3 47 50 A Q S < S- 0 0 73 -3,-0.7 16,-0.2 -2,-0.3 3,-0.1 -0.824 84.7 -86.3 -99.4 150.7 41.6 14.5 -12.6 48 51 A P - 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.052 57.1 -78.8 -50.6 156.7 41.0 18.2 -13.6 49 52 A L - 0 0 42 1,-0.1 2,-0.6 13,-0.1 13,-0.2 -0.335 47.0-124.1 -53.6 136.0 39.8 20.7 -11.1 50 53 A K E -D 61 0A 143 11,-2.9 11,-2.5 -3,-0.1 2,-0.4 -0.859 37.5-172.4 -90.6 118.0 36.1 20.3 -10.4 51 54 A K E -D 60 0A 125 -2,-0.6 2,-0.3 9,-0.2 9,-0.2 -0.914 17.5-176.6-121.0 135.9 34.4 23.6 -11.1 52 55 A V E -D 59 0A 69 7,-2.6 7,-3.0 -2,-0.4 2,-0.4 -0.983 7.3-164.0-125.0 147.3 30.9 25.0 -10.5 53 56 A K E +D 58 0A 137 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.971 12.4 170.0-135.7 120.5 29.6 28.5 -11.5 54 57 A K E > -D 57 0A 140 3,-2.1 3,-1.6 -2,-0.4 2,-0.5 -0.971 66.7 -53.6-130.1 117.0 26.4 30.2 -10.3 55 58 A G T 3 S- 0 0 66 -2,-0.4 -26,-0.0 1,-0.3 0, 0.0 -0.425 123.1 -14.3 56.5-106.6 25.9 33.8 -11.2 56 59 A N T 3 S+ 0 0 105 -2,-0.5 -23,-1.3 -27,-0.1 2,-0.3 0.666 119.7 81.0 -99.5 -25.2 29.0 35.6 -10.0 57 60 A I E < -cD 33 54A 9 -3,-1.6 -3,-2.1 -25,-0.2 2,-0.4 -0.630 55.8-163.6 -86.9 143.4 30.6 33.0 -7.8 58 61 A T E -cD 34 53A 22 -25,-2.0 -23,-2.6 -2,-0.3 2,-0.4 -0.974 6.0-155.2-117.4 140.1 32.8 30.0 -9.0 59 62 A W E -cD 35 52A 10 -7,-3.0 -7,-2.6 -2,-0.4 2,-0.4 -0.958 14.2-176.2-111.6 134.2 33.5 27.0 -6.7 60 63 A A E +cD 36 51A 0 -25,-2.9 -23,-1.9 -2,-0.4 2,-0.3 -0.996 3.7 174.4-135.7 135.2 36.6 24.9 -7.4 61 64 A S E -cD 37 50A 18 -11,-2.5 -11,-2.9 -2,-0.4 2,-0.3 -0.951 12.0-166.4-137.3 159.3 37.9 21.7 -5.8 62 65 A F E -c 38 0A 7 -25,-1.0 -23,-2.8 -2,-0.3 -22,-0.3 -0.953 23.0-121.1-135.3 152.8 40.6 19.1 -6.1 63 66 A N E - 0 0 8 -2,-0.3 2,-0.3 -18,-0.3 -21,-0.2 -0.552 24.5-139.5 -84.1 159.9 41.2 15.6 -4.5 64 67 A L E -c 42 0A 2 -23,-1.7 -21,-1.5 -2,-0.2 2,-0.0 -0.919 17.2-113.5-120.0 146.9 44.2 14.8 -2.4 65 68 A S > - 0 0 24 -2,-0.3 4,-2.3 -23,-0.2 5,-0.2 -0.296 32.0-110.7 -68.8 163.1 46.3 11.6 -2.4 66 69 A E H > S+ 0 0 118 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.899 117.4 50.5 -66.2 -41.2 46.3 9.4 0.7 67 70 A Q H > S+ 0 0 114 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.933 110.9 48.3 -61.6 -47.4 49.9 10.3 1.6 68 71 A D H >>S+ 0 0 22 1,-0.2 4,-3.0 2,-0.2 5,-0.5 0.934 112.8 48.6 -59.8 -48.6 49.3 14.0 1.3 69 72 A L H X>S+ 0 0 10 -4,-2.3 5,-2.4 1,-0.2 4,-1.4 0.917 111.7 50.4 -54.7 -47.1 46.1 13.8 3.4 70 73 A D H <>S+ 0 0 74 -4,-2.6 5,-1.9 3,-0.2 -2,-0.2 0.917 120.2 32.2 -62.4 -43.1 47.9 11.8 6.1 71 74 A E H <>S+ 0 0 28 -4,-2.3 5,-2.7 3,-0.2 31,-0.3 0.883 128.1 37.7 -84.2 -38.1 50.9 14.1 6.5 72 75 A Y H <>S+ 0 0 2 -4,-3.0 5,-2.0 -5,-0.3 -3,-0.2 0.966 132.8 15.7 -76.5 -57.2 49.2 17.4 5.8 73 76 A Y T XS+ 0 0 0 -5,-2.7 5,-2.8 22,-0.3 4,-0.8 0.950 129.2 37.9 -69.0 -50.1 50.7 18.1 10.8 77 80 A S H 4XS+ 0 0 0 -5,-2.0 5,-2.5 3,-0.2 -3,-0.2 0.960 131.5 25.1 -61.0 -52.7 47.4 20.1 11.0 78 81 A N H 4S+ 0 0 0 0, 0.0 5,-2.8 0, 0.0 3,-0.3 0.931 118.7 47.0 -59.8 -45.6 47.0 20.3 20.0 84 87 A A H ><5S+ 0 0 0 -4,-2.2 3,-2.1 1,-0.2 -2,-0.2 0.930 111.3 48.9 -59.7 -48.5 49.7 23.0 20.3 85 88 A F H 3<5S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.3 -3,-0.2 0.713 111.9 52.4 -69.4 -18.5 47.4 25.9 19.5 86 89 A H T 3<5S- 0 0 7 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.109 123.5-105.0 -99.5 23.5 45.0 24.5 22.1 87 90 A Y T < 5S+ 0 0 61 -3,-2.1 -3,-0.2 1,-0.1 2,-0.2 0.859 82.8 125.6 63.7 38.4 47.6 24.3 24.8 88 91 A R > < + 0 0 81 -5,-2.8 3,-1.7 1,-0.1 4,-0.4 -0.571 16.6 157.2-127.9 70.2 48.2 20.5 24.6 89 92 A L G > S+ 0 0 68 1,-0.3 3,-1.7 -2,-0.2 -1,-0.1 0.848 71.6 70.0 -54.4 -36.1 51.9 20.1 24.0 90 93 A D G 3 S+ 0 0 105 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.0 0.595 101.2 45.4 -61.7 -14.1 51.5 16.6 25.5 91 94 A L G < S+ 0 0 32 -3,-1.7 -1,-0.3 -11,-0.1 -2,-0.2 0.451 82.2 113.6-108.4 -7.7 49.6 15.5 22.4 92 95 A V < - 0 0 32 -3,-1.7 2,-0.3 -4,-0.4 -12,-0.2 -0.477 46.8-161.4 -81.0 147.1 51.6 16.9 19.6 93 96 A Q - 0 0 113 -14,-2.5 2,-0.4 -18,-0.3 -14,-0.1 -0.659 13.1-174.1-120.9 68.3 53.3 14.4 17.3 94 97 A F + 0 0 49 -2,-0.3 2,-0.3 -14,-0.1 -18,-0.0 -0.522 13.9 158.0 -69.2 123.9 56.0 16.3 15.6 95 98 A Q >> - 0 0 115 -2,-0.4 4,-1.7 1,-0.1 3,-0.5 -0.990 45.0-124.8-142.9 143.4 57.8 14.3 12.9 96 99 A R H 3> S+ 0 0 141 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.873 107.7 55.5 -58.1 -43.5 59.8 15.7 9.9 97 100 A P H 3> S+ 0 0 71 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.857 106.8 52.7 -59.2 -34.1 57.8 13.8 7.1 98 101 A A H <> S+ 0 0 0 -3,-0.5 4,-2.3 2,-0.2 -22,-0.3 0.928 109.8 47.2 -64.1 -48.3 54.6 15.4 8.5 99 102 A W H X S+ 0 0 16 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.915 112.9 49.7 -60.1 -43.0 56.1 18.9 8.3 100 103 A D H X S+ 0 0 82 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.910 110.3 50.0 -63.2 -44.7 57.4 18.2 4.8 101 104 A G H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.884 107.2 55.5 -56.4 -40.8 54.0 16.9 3.7 102 105 A Y H X S+ 0 0 0 -4,-2.3 4,-1.6 -31,-0.3 -2,-0.2 0.914 111.6 42.6 -62.5 -44.0 52.4 20.1 5.2 103 106 A L H X S+ 0 0 46 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.890 112.4 56.0 -65.9 -38.4 54.7 22.3 3.0 104 107 A R H X S+ 0 0 90 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.935 108.0 45.3 -62.8 -48.5 54.1 20.0 -0.0 105 108 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.893 112.0 52.0 -66.1 -38.6 50.3 20.3 0.0 106 109 A N H X S+ 0 0 0 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.921 112.2 46.3 -60.4 -45.9 50.4 24.1 0.5 107 110 A A H X S+ 0 0 20 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.902 112.7 51.6 -60.9 -43.5 52.8 24.3 -2.5 108 111 A L H X S+ 0 0 51 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.904 110.0 47.6 -57.1 -48.2 50.5 22.0 -4.4 109 112 A L H X S+ 0 0 4 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.877 111.0 51.6 -61.7 -41.2 47.4 24.2 -3.6 110 113 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.904 109.5 50.3 -64.4 -40.4 49.3 27.3 -4.6 111 114 A D H < S+ 0 0 91 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.901 112.2 46.4 -64.6 -45.3 50.2 25.7 -8.0 112 115 A K H < S+ 0 0 52 -4,-2.3 4,-0.2 1,-0.2 -1,-0.2 0.816 116.1 47.3 -60.2 -36.2 46.6 24.6 -8.7 113 116 A L H >< S+ 0 0 0 -4,-1.8 3,-1.8 -5,-0.2 4,-0.3 0.862 91.6 78.2 -81.0 -38.1 45.4 28.1 -7.7 114 117 A L G >< S+ 0 0 60 -4,-2.4 3,-2.0 1,-0.3 -1,-0.2 0.820 90.8 50.3 -43.4 -52.0 47.9 30.3 -9.7 115 118 A P G 3 S+ 0 0 107 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.711 106.5 59.3 -65.9 -16.6 46.3 30.0 -13.2 116 119 A L G < S+ 0 0 38 -3,-1.8 -2,-0.2 -4,-0.2 2,-0.2 0.396 88.9 99.4 -87.7 -5.3 42.9 31.0 -11.8 117 120 A L < - 0 0 29 -3,-2.0 2,-0.3 -4,-0.3 3,-0.0 -0.524 54.7-156.4 -89.7 154.5 44.1 34.3 -10.4 118 121 A Q > - 0 0 107 -2,-0.2 3,-1.5 -116,-0.1 26,-0.1 -0.940 31.2-110.7-124.9 152.7 43.7 37.8 -11.8 119 122 A D T 3 S+ 0 0 153 -2,-0.3 24,-0.1 1,-0.3 -1,-0.1 0.801 115.3 43.8 -51.6 -39.3 45.9 40.9 -11.2 120 123 A D T 3 S+ 0 0 107 24,-0.1 -1,-0.3 2,-0.1 25,-0.1 0.499 84.2 127.1 -89.2 -6.6 43.2 42.8 -9.2 121 124 A D < - 0 0 1 -3,-1.5 24,-0.5 -120,-0.1 2,-0.4 -0.158 51.2-144.9 -46.4 137.8 42.0 39.8 -7.0 122 125 A I E -b 3 0A 1 -120,-2.8 -118,-3.0 22,-0.1 2,-0.5 -0.905 20.6-148.5 -98.9 140.0 41.8 40.2 -3.2 123 126 A I E -be 4 146A 0 22,-2.3 24,-2.8 -2,-0.4 2,-0.5 -0.954 14.0-169.5-121.6 126.8 42.7 36.9 -1.6 124 127 A W E -be 5 147A 0 -120,-3.3 -118,-2.4 -2,-0.5 2,-0.4 -0.969 6.8-168.1-118.4 114.8 41.3 35.6 1.7 125 128 A I E -be 6 148A 0 22,-3.3 24,-1.9 -2,-0.5 2,-0.5 -0.888 9.2-146.7-107.6 138.1 42.9 32.5 3.3 126 129 A H E - e 0 149A 2 -120,-2.1 -118,-0.5 -2,-0.4 3,-0.2 -0.902 38.3 -24.2-114.7 121.4 41.3 30.6 6.2 127 130 A D S > S- 0 0 28 22,-3.1 3,-2.4 -2,-0.5 23,-0.1 0.299 80.0 -53.1 86.3 168.5 42.8 28.7 9.1 128 131 A Y G > S+ 0 0 2 1,-0.3 3,-0.8 2,-0.2 -1,-0.2 0.564 115.5 71.9 -66.2 -12.4 45.8 26.8 10.5 129 132 A H G 3 S+ 0 0 14 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.717 105.0 41.2 -67.3 -20.0 46.0 24.3 7.5 130 133 A L G X + 0 0 0 -3,-2.4 3,-1.5 1,-0.1 4,-0.4 -0.051 67.3 128.2-127.9 31.7 47.3 27.2 5.3 131 134 A L T < S+ 0 0 1 -3,-0.8 3,-0.3 1,-0.3 4,-0.3 0.846 83.6 43.1 -52.2 -40.0 49.8 29.1 7.5 132 135 A P T 3> S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.394 88.0 98.0 -86.3 5.5 52.4 28.9 4.8 133 136 A F H <> S+ 0 0 0 -3,-1.5 4,-2.0 1,-0.2 -2,-0.1 0.899 77.2 51.3 -71.6 -40.2 50.1 29.7 1.9 134 137 A A H > S+ 0 0 0 -4,-0.4 4,-2.6 -3,-0.3 -1,-0.2 0.909 111.1 52.1 -56.9 -43.9 50.8 33.4 1.5 135 138 A H H > S+ 0 0 51 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.909 107.3 50.2 -58.8 -47.7 54.5 32.5 1.3 136 139 A E H < S+ 0 0 11 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.853 111.8 50.4 -60.3 -33.8 53.9 29.9 -1.4 137 140 A L H ><>S+ 0 0 0 -4,-2.0 5,-1.9 -5,-0.2 3,-1.0 0.933 108.8 50.2 -70.2 -44.6 51.9 32.6 -3.3 138 141 A R H ><5S+ 0 0 30 -4,-2.6 3,-2.2 1,-0.3 -2,-0.2 0.908 106.1 54.9 -59.8 -45.9 54.7 35.2 -3.0 139 142 A K T 3<5S+ 0 0 123 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.710 104.8 56.0 -66.4 -13.7 57.3 32.9 -4.3 140 143 A R T < 5S- 0 0 64 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.280 127.0 -97.6 -97.9 9.7 55.1 32.3 -7.4 141 144 A G T < 5S+ 0 0 55 -3,-2.2 2,-0.7 1,-0.2 -3,-0.2 0.614 71.4 149.0 89.4 16.1 55.0 36.0 -8.2 142 145 A V < + 0 0 6 -5,-1.9 -1,-0.2 1,-0.1 -2,-0.1 -0.744 16.6 171.6 -90.5 118.1 51.7 37.0 -6.6 143 146 A N + 0 0 90 -2,-0.7 310,-0.6 309,-0.1 -1,-0.1 0.439 36.0 126.9 -98.2 -3.8 51.7 40.6 -5.4 144 147 A N S S- 0 0 20 1,-0.2 2,-0.4 308,-0.1 309,-0.2 0.061 74.7 -87.8 -55.2 160.5 48.0 40.7 -4.6 145 148 A R - 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0 0 15 -3,-1.3 -3,-0.1 -4,-0.4 -37,-0.0 -0.386 57.2-114.8 -68.4 138.1 16.5 31.3 37.2 416 419 A S > - 0 0 66 1,-0.1 4,-2.4 -2,-0.1 3,-0.4 -0.310 22.7-113.2 -66.8 155.3 13.5 33.6 37.2 417 420 A L H > S+ 0 0 84 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.901 115.9 56.4 -51.8 -46.8 11.9 34.7 33.9 418 421 A A H > S+ 0 0 75 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.854 111.0 41.9 -57.5 -41.5 13.0 38.3 34.6 419 422 A E H > S+ 0 0 59 -3,-0.4 4,-2.5 2,-0.2 5,-0.3 0.855 111.7 54.3 -79.9 -34.4 16.6 37.4 35.0 420 423 A R H X S+ 0 0 50 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.922 111.1 47.3 -59.6 -41.9 16.6 35.0 32.0 421 424 A I H X S+ 0 0 62 -4,-2.6 4,-3.6 2,-0.2 5,-0.3 0.945 112.1 49.3 -65.5 -49.6 15.2 37.8 29.8 422 425 A S H X S+ 0 0 71 -4,-1.9 4,-2.2 2,-0.2 5,-0.2 0.957 115.3 42.3 -52.7 -58.7 17.7 40.4 31.1 423 426 A R H X S+ 0 0 57 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.911 117.5 48.3 -59.2 -44.2 20.7 38.1 30.5 424 427 A H H X S+ 0 0 7 -4,-2.8 4,-2.8 -5,-0.3 -2,-0.2 0.935 110.3 49.4 -62.7 -47.6 19.4 36.9 27.2 425 428 A A H X S+ 0 0 52 -4,-3.6 4,-2.2 1,-0.2 -1,-0.2 0.875 110.6 51.3 -63.4 -35.9 18.6 40.4 25.8 426 429 A E H X S+ 0 0 96 -4,-2.2 4,-1.5 -5,-0.3 -1,-0.2 0.910 113.3 44.1 -68.1 -43.3 22.1 41.7 26.7 427 430 A M H X S+ 0 0 7 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.910 112.6 52.2 -62.2 -43.9 23.8 38.8 25.0 428 431 A L H X S+ 0 0 46 -4,-2.8 4,-1.9 1,-0.2 5,-0.3 0.890 105.2 55.4 -64.7 -39.0 21.5 39.0 21.9 429 432 A D H X S+ 0 0 77 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.921 107.9 48.9 -58.5 -46.4 22.2 42.7 21.6 430 433 A V H X S+ 0 0 44 -4,-1.5 4,-1.3 1,-0.2 -2,-0.2 0.908 114.1 45.2 -59.0 -44.4 26.0 42.0 21.4 431 434 A I H < S+ 0 0 1 -4,-2.1 -207,-0.3 1,-0.2 -1,-0.2 0.737 111.9 50.9 -78.6 -19.6 25.6 39.3 18.8 432 435 A V H < S+ 0 0 59 -4,-1.9 3,-0.4 -5,-0.2 -1,-0.2 0.816 110.8 50.4 -80.2 -33.6 23.2 41.3 16.6 433 436 A K H < S+ 0 0 141 -4,-2.0 2,-0.4 1,-0.3 -2,-0.2 0.729 114.1 44.5 -76.6 -21.7 25.6 44.2 16.7 434 437 A N S < S+ 0 0 24 -4,-1.3 -210,-0.4 -5,-0.1 -1,-0.3 -0.728 87.8 175.8-122.7 77.4 28.6 42.0 15.6 435 438 A D > - 0 0 27 -3,-0.4 4,-2.4 -2,-0.4 -210,-0.2 -0.329 48.4-112.8 -70.5 159.6 27.0 39.9 12.9 436 439 A I H > S+ 0 0 6 -212,-2.4 4,-2.4 2,-0.2 5,-0.2 0.893 125.3 52.5 -59.2 -42.1 28.5 37.4 10.6 437 440 A N H > S+ 0 0 72 -213,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.932 109.8 47.8 -53.3 -47.8 27.8 40.0 7.9 438 441 A H H > S+ 0 0 84 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.876 110.1 54.5 -60.5 -39.4 29.7 42.6 10.0 439 442 A W H X S+ 0 0 2 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.945 113.6 38.0 -64.0 -50.5 32.5 40.1 10.4 440 443 A Q H X S+ 0 0 8 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.891 115.3 54.6 -70.6 -38.9 33.1 39.5 6.7 441 444 A E H X S+ 0 0 102 -4,-2.7 4,-2.7 -5,-0.2 5,-0.2 0.926 109.7 47.5 -58.8 -45.6 32.5 43.2 5.8 442 445 A C H X S+ 0 0 40 -4,-2.6 4,-2.6 -5,-0.2 5,-0.2 0.934 114.2 46.7 -61.5 -47.1 35.2 44.3 8.3 443 446 A F H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.927 116.0 43.5 -59.2 -48.6 37.7 41.8 7.0 444 447 A I H X S+ 0 0 17 -4,-2.6 4,-2.2 2,-0.2 5,-0.2 0.926 113.5 52.1 -67.5 -43.3 37.1 42.6 3.3 445 448 A S H X S+ 0 0 60 -4,-2.7 4,-1.0 -5,-0.3 -2,-0.2 0.931 112.7 45.4 -58.2 -44.6 37.1 46.4 4.0 446 449 A D H X S+ 0 0 30 -4,-2.6 4,-0.5 1,-0.2 3,-0.5 0.905 112.1 51.7 -66.2 -40.4 40.4 46.0 5.8 447 450 A L H >< S+ 0 0 0 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.857 105.3 54.9 -63.8 -36.6 41.9 43.8 3.1 448 451 A K H 3< S+ 0 0 96 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.766 100.4 64.2 -70.7 -23.1 40.9 46.3 0.4 449 452 A Q H 3< S+ 0 0 118 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.672 77.1 100.4 -74.3 -18.8 42.8 49.0 2.2 450 453 A I S << S- 0 0 15 -3,-1.0 -305,-0.1 -4,-0.5 -272,-0.0 -0.496 73.4-130.3 -78.2 138.6 46.3 47.5 1.9 451 454 A V - 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0 0 6 -4,-1.1 29,-0.2 -3,-0.8 -94,-0.1 -0.751 62.3-153.5 -89.9 131.3 9.6 -7.6 31.3 800 352 B D S S+ 0 0 58 -96,-0.7 29,-2.3 -2,-0.4 2,-0.4 0.766 81.0 32.1 -73.8 -27.0 8.7 -9.1 27.9 801 353 B V E -ce 705 829G 0 -97,-2.1 -95,-2.7 27,-0.2 2,-0.6 -0.998 65.4-154.0-136.4 131.9 12.0 -11.0 27.4 802 354 B G E -ce 706 830G 2 27,-3.3 29,-3.1 -2,-0.4 2,-0.7 -0.934 14.3-159.8-104.6 120.5 14.2 -12.5 30.0 803 355 B L E + e 0 831G 1 -97,-2.6 2,-0.4 -2,-0.6 -95,-0.2 -0.899 20.8 163.3-108.4 109.1 17.8 -12.7 28.8 804 356 B V E + e 0 832G 4 27,-2.9 29,-2.5 -2,-0.7 32,-0.1 -0.801 10.5 150.1-127.2 89.8 19.9 -15.3 30.6 805 357 B T + 0 0 3 -2,-0.4 27,-0.1 27,-0.2 29,-0.1 -0.350 11.7 167.1-125.8 56.8 23.0 -16.0 28.6 806 358 B P - 0 0 0 0, 0.0 29,-0.4 0, 0.0 -91,-0.3 -0.238 39.2-133.0 -61.9 155.2 26.0 -17.0 30.8 807 359 B L S S- 0 0 13 -93,-2.8 2,-0.3 1,-0.4 -92,-0.2 0.788 94.6 -1.1 -78.6 -30.9 29.1 -18.5 29.1 808 360 B R S S+ 0 0 73 -94,-1.7 -1,-0.4 -204,-0.0 2,-0.3 -0.905 73.7 171.0-158.9 133.5 29.1 -21.2 31.8 809 361 B D B -h 836 0I 21 26,-1.8 28,-2.0 -2,-0.3 29,-0.1 -0.941 34.6-140.6-150.5 125.4 26.7 -21.6 34.8 810 362 B G S S- 0 0 2 -2,-0.3 -1,-0.1 26,-0.2 -207,-0.1 0.924 91.0 -43.5 -41.8 -53.7 26.2 -24.4 37.4 811 363 B M - 0 0 4 26,-0.2 27,-2.1 25,-0.1 28,-0.2 0.437 66.5-136.8-143.3 -62.7 22.4 -23.8 37.2 812 364 B N > - 0 0 10 25,-0.2 4,-0.6 24,-0.1 3,-0.4 0.865 7.9-160.4 83.5 92.5 21.3 -20.2 37.2 813 365 B L H >> S+ 0 0 42 1,-0.2 4,-2.7 2,-0.2 3,-0.6 0.781 84.3 73.2 -70.6 -29.1 18.3 -19.5 39.4 814 366 B V H 3> S+ 0 0 32 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.898 91.7 57.7 -51.4 -44.1 17.4 -16.3 37.6 815 367 B A H 3> S+ 0 0 0 -3,-0.4 4,-1.5 1,-0.2 -1,-0.2 0.874 111.6 41.5 -53.0 -41.3 16.2 -18.3 34.6 816 368 B K H < S+ 0 0 1 -4,-1.5 3,-1.0 1,-0.2 -1,-0.2 0.925 113.4 53.7 -77.9 -23.7 9.5 -17.8 34.5 820 372 B A H 3< S+ 0 0 6 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.832 106.8 54.9 -68.8 -26.6 7.9 -18.3 38.0 821 373 B A H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 -3,-0.3 -2,-0.2 0.593 87.5 109.8 -78.9 -17.4 7.3 -14.5 38.3 822 374 B Q S << S- 0 0 6 -3,-1.0 -25,-0.1 -4,-0.6 -24,-0.1 -0.264 79.1-115.0 -63.6 144.7 5.4 -14.3 35.0 823 375 B D > - 0 0 57 3,-0.4 3,-1.1 -26,-0.3 -1,-0.1 -0.755 25.9-147.2 -64.2 114.4 1.7 -13.7 34.8 824 376 B P T 3 S+ 0 0 77 0, 0.0 -1,-0.1 0, 0.0 52,-0.1 0.731 97.6 58.9 -63.1 -19.8 0.7 -17.1 33.3 825 377 B A T 3 S+ 0 0 65 1,-0.2 47,-0.1 -3,-0.0 -3,-0.0 0.730 127.5 11.2 -76.4 -25.5 -2.1 -15.3 31.4 826 378 B N S < S+ 0 0 89 -3,-1.1 -3,-0.4 45,-0.1 -1,-0.2 -0.445 88.0 174.4-153.0 69.1 0.5 -13.0 29.6 827 379 B P - 0 0 0 0, 0.0 48,-0.1 0, 0.0 -30,-0.1 -0.445 25.0-124.9 -87.2 152.1 4.0 -14.3 30.2 828 380 B G - 0 0 7 -29,-0.2 2,-0.4 -10,-0.2 -27,-0.2 -0.188 31.5-100.5 -77.5 178.3 7.3 -13.1 28.7 829 381 B V E -e 801 0G 7 -29,-2.3 -27,-3.3 34,-0.1 2,-0.6 -0.874 22.7-139.2-109.9 136.3 9.8 -15.2 26.8 830 382 B L E -e 802 0G 1 -2,-0.4 16,-3.3 -29,-0.2 2,-0.6 -0.867 10.3-165.9 -92.7 119.5 13.0 -16.7 28.3 831 383 B V E -ef 803 846G 0 -29,-3.1 -27,-2.9 -2,-0.6 2,-0.4 -0.955 22.7-175.5-100.2 117.7 16.1 -16.6 26.1 832 384 B L E -ef 804 847G 0 14,-3.0 16,-2.4 -2,-0.6 -27,-0.2 -0.964 26.8-120.4-127.6 134.2 18.6 -19.0 27.7 833 385 B S E > - f 0 848G 0 -29,-2.5 3,-1.4 -2,-0.4 6,-0.3 -0.370 17.5-136.4 -63.6 140.9 22.2 -20.1 27.1 834 386 B Q T 3 S+ 0 0 89 14,-2.2 -1,-0.1 1,-0.3 15,-0.1 0.608 105.0 65.9 -72.3 -13.6 22.8 -23.8 26.4 835 387 B F T 3 S+ 0 0 49 -29,-0.4 -26,-1.8 13,-0.3 2,-0.4 0.385 80.1 96.6 -90.4 2.1 25.7 -23.5 28.7 836 388 B A B X S-h 809 0I 3 -3,-1.4 3,-2.0 -28,-0.2 4,-0.3 -0.801 78.1-134.0 -87.8 133.5 23.4 -22.8 31.7 837 389 B G G > S+ 0 0 7 -28,-2.0 3,-1.3 -2,-0.4 4,-0.3 0.801 104.3 66.9 -56.7 -30.5 22.7 -25.8 33.8 838 390 B A G >> S+ 0 0 0 -27,-2.1 4,-2.9 1,-0.2 3,-1.3 0.716 82.3 77.0 -63.0 -19.8 19.0 -24.8 33.8 839 391 B A G <4 S+ 0 0 16 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.742 81.0 66.9 -68.5 -23.8 18.9 -25.5 30.0 840 392 B N G <4 S+ 0 0 108 -3,-1.3 -1,-0.3 -4,-0.3 3,-0.2 0.803 117.8 24.5 -60.7 -32.6 18.7 -29.3 30.6 841 393 B E T <4 S+ 0 0 33 -3,-1.3 2,-2.0 -4,-0.3 3,-0.3 0.812 111.2 66.5-102.5 -34.0 15.3 -28.7 32.1 842 394 B L >< + 0 0 0 -4,-2.9 3,-1.8 1,-0.2 -1,-0.1 -0.373 58.9 152.0 -91.0 58.9 14.0 -25.5 30.6 843 395 B T T 3 + 0 0 98 -2,-2.0 -1,-0.2 1,-0.3 4,-0.2 0.708 64.7 61.1 -62.6 -28.5 13.8 -27.1 27.2 844 396 B S T 3 S+ 0 0 8 -3,-0.3 -1,-0.3 30,-0.2 -14,-0.1 0.397 84.1 101.0 -78.4 -3.9 11.0 -24.8 26.1 845 397 B A S < S- 0 0 5 -3,-1.8 2,-1.0 -6,-0.1 -14,-0.2 -0.357 94.3 -96.4 -70.3 161.2 13.2 -21.7 26.6 846 398 B L E -f 831 0G 8 -16,-3.3 -14,-3.0 -2,-0.1 2,-0.4 -0.795 50.3-152.3 -78.7 105.7 14.7 -20.1 23.5 847 399 B I E +f 832 0G 67 -2,-1.0 2,-0.3 -4,-0.2 -14,-0.2 -0.690 20.3 176.3 -91.3 129.6 18.0 -21.9 23.8 848 400 B V E -f 833 0G 3 -16,-2.4 -14,-2.2 -2,-0.4 -13,-0.3 -0.909 37.0-126.2-134.3 159.4 21.1 -20.1 22.3 849 401 B N > - 0 0 42 -2,-0.3 3,-2.4 -16,-0.2 7,-0.3 -0.902 19.8-158.6 -99.4 106.4 24.8 -20.3 21.8 850 402 B P T 3 S+ 0 0 9 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.683 89.1 70.1 -61.2 -19.3 26.1 -16.9 23.2 851 403 B Y T 3 S+ 0 0 141 1,-0.2 2,-0.5 -44,-0.1 -44,-0.0 0.529 94.3 62.2 -68.9 -7.3 29.3 -17.4 21.1 852 404 B D X> - 0 0 71 -3,-2.4 4,-2.1 1,-0.1 3,-0.8 -0.755 68.1-178.7-119.5 80.2 27.0 -16.8 18.1 853 405 B R H 3> S+ 0 0 119 -2,-0.5 4,-2.5 1,-0.3 -1,-0.1 0.797 80.4 55.0 -57.7 -30.3 25.8 -13.3 18.7 854 406 B D H 3> S+ 0 0 68 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.870 106.5 50.9 -69.8 -36.7 23.6 -13.3 15.5 855 407 B E H <> S+ 0 0 74 -3,-0.8 4,-2.2 2,-0.2 -2,-0.2 0.933 111.3 49.2 -63.8 -42.2 21.8 -16.5 16.7 856 408 B V H X S+ 0 0 2 -4,-2.1 4,-2.4 -7,-0.3 -2,-0.2 0.943 111.5 49.2 -61.4 -44.1 21.2 -14.6 20.1 857 409 B A H X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.2 -2,-0.2 0.939 109.7 50.9 -60.2 -45.1 19.9 -11.6 18.2 858 410 B A H X S+ 0 0 40 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.866 109.5 51.0 -60.9 -39.9 17.5 -13.8 16.1 859 411 B A H X S+ 0 0 10 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.924 110.0 50.1 -59.2 -45.9 16.2 -15.4 19.3 860 412 B L H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.934 111.0 48.3 -59.4 -47.9 15.6 -11.9 20.7 861 413 B D H X S+ 0 0 34 -4,-3.1 4,-0.9 1,-0.2 -2,-0.2 0.919 112.7 49.0 -56.3 -45.3 13.8 -11.0 17.5 862 414 B R H < S+ 0 0 121 -4,-2.7 4,-0.5 1,-0.2 3,-0.3 0.866 110.5 50.5 -62.4 -40.5 11.7 -14.2 17.8 863 415 B A H >< S+ 0 0 3 -4,-2.6 3,-0.6 1,-0.2 -1,-0.2 0.878 108.6 52.7 -65.0 -36.8 10.9 -13.6 21.5 864 416 B L H 3< S+ 0 0 10 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.668 116.1 38.4 -75.0 -20.1 9.8 -10.0 20.7 865 417 B T T 3< S+ 0 0 91 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.355 84.7 131.7-108.4 2.8 7.3 -11.1 18.0 866 418 B M < - 0 0 13 -3,-0.6 -3,-0.1 -4,-0.5 -37,-0.0 -0.339 58.1-117.6 -69.8 134.4 6.1 -14.3 19.6 867 419 B S > - 0 0 66 1,-0.1 4,-2.8 -2,-0.1 5,-0.2 -0.275 21.0-115.2 -64.4 151.0 2.3 -14.8 19.7 868 420 B L H > S+ 0 0 84 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.916 116.0 56.3 -50.1 -47.6 0.4 -15.0 23.0 869 421 B A H > S+ 0 0 76 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.936 112.1 40.7 -52.9 -50.2 -0.5 -18.7 22.2 870 422 B E H > S+ 0 0 58 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.896 112.7 54.3 -68.7 -40.3 3.1 -19.7 21.8 871 423 B R H X S+ 0 0 51 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.884 110.3 49.9 -57.0 -39.5 4.3 -17.6 24.8 872 424 B I H X S+ 0 0 56 -4,-2.7 4,-3.1 -5,-0.2 5,-0.3 0.937 111.2 44.5 -64.7 -52.8 1.7 -19.4 26.9 873 425 B S H X S+ 0 0 68 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.898 114.7 48.9 -67.0 -36.5 2.6 -23.0 26.0 874 426 B R H X S+ 0 0 52 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.948 116.8 42.6 -64.2 -47.6 6.4 -22.4 26.3 875 427 B H H X S+ 0 0 6 -4,-1.9 4,-3.0 -5,-0.3 5,-0.2 0.929 113.2 50.1 -65.1 -48.3 5.9 -20.8 29.7 876 428 B A H X S+ 0 0 50 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.866 111.7 51.6 -58.3 -37.7 3.4 -23.3 31.1 877 429 B E H X S+ 0 0 105 -4,-1.9 4,-1.5 -5,-0.3 -2,-0.2 0.954 113.0 42.0 -64.0 -51.8 5.8 -26.0 30.0 878 430 B M H X S+ 0 0 8 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.893 114.6 53.4 -60.9 -40.6 8.8 -24.5 31.8 879 431 B L H X S+ 0 0 46 -4,-3.0 4,-2.2 1,-0.2 5,-0.2 0.888 103.1 54.5 -65.9 -43.3 6.7 -23.7 34.8 880 432 B D H X S+ 0 0 81 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.922 109.5 50.3 -53.8 -44.0 5.3 -27.2 35.2 881 433 B V H X S+ 0 0 48 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.886 111.1 47.1 -61.6 -45.4 9.0 -28.4 35.3 882 434 B I H < S+ 0 0 1 -4,-2.0 -207,-0.3 2,-0.2 -1,-0.2 0.814 112.1 50.2 -69.6 -28.5 10.0 -25.9 38.0 883 435 B V H >< S+ 0 0 70 -4,-2.2 3,-0.7 -5,-0.2 -2,-0.2 0.883 111.8 47.8 -75.2 -38.6 7.0 -26.6 40.2 884 436 B K H 3< S+ 0 0 142 -4,-2.1 2,-0.7 1,-0.3 -2,-0.2 0.940 119.8 38.2 -68.4 -48.3 7.7 -30.4 40.0 885 437 B N T 3< S+ 0 0 26 -4,-2.2 -210,-0.3 -5,-0.2 -1,-0.3 -0.529 89.3 158.1-100.3 66.5 11.4 -30.0 40.8 886 438 B D <> - 0 0 37 -2,-0.7 4,-2.3 -3,-0.7 -210,-0.2 -0.215 60.8 -93.3 -82.2 175.7 11.1 -27.2 43.4 887 439 B I H > S+ 0 0 2 -212,-3.4 4,-2.0 1,-0.2 5,-0.2 0.852 127.5 53.0 -58.5 -32.1 13.6 -26.2 46.1 888 440 B N H > S+ 0 0 74 -213,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.939 108.4 48.2 -68.7 -47.1 11.6 -28.4 48.5 889 441 B H H > S+ 0 0 85 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.911 110.6 54.5 -55.9 -43.4 11.8 -31.5 46.2 890 442 B W H X S+ 0 0 1 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.947 111.0 41.2 -59.4 -55.8 15.6 -30.8 45.8 891 443 B Q H X S+ 0 0 6 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.904 115.4 52.0 -62.0 -41.7 16.5 -30.8 49.5 892 444 B E H X S+ 0 0 99 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.857 109.0 49.8 -64.3 -38.5 14.2 -33.8 50.2 893 445 B C H X S+ 0 0 45 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.931 113.4 46.2 -65.0 -44.3 15.7 -35.9 47.4 894 446 B F H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.927 115.2 46.1 -65.4 -44.9 19.3 -35.1 48.7 895 447 B I H X S+ 0 0 20 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.965 111.0 51.6 -62.3 -52.2 18.4 -35.8 52.3 896 448 B S H X S+ 0 0 62 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.857 113.3 45.5 -52.9 -40.6 16.5 -39.1 51.5 897 449 B D H X S+ 0 0 38 -4,-1.9 4,-0.6 2,-0.2 -1,-0.2 0.901 112.7 50.2 -68.9 -41.1 19.5 -40.3 49.5 898 450 B L H >< S+ 0 0 0 -4,-2.4 3,-0.7 1,-0.2 -2,-0.2 0.879 108.7 52.9 -65.3 -36.7 22.0 -39.3 52.2 899 451 B K H 3< S+ 0 0 81 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.856 100.9 61.9 -64.0 -39.7 19.9 -41.1 54.9 900 452 B Q H 3< S+ 0 0 126 -4,-1.3 -1,-0.2 -5,-0.2 2,-0.2 0.622 81.0 100.0 -62.8 -23.2 19.9 -44.4 52.9 901 453 B I S << S- 0 0 18 -3,-0.7 -305,-0.1 -4,-0.6 -272,-0.0 -0.516 74.7-129.9 -70.7 133.1 23.7 -44.8 53.1 902 454 B V - 0 0 130 -2,-0.2 -2,-0.1 1,-0.0 -1,-0.1 -0.773 31.5-120.1 -77.5 122.3 25.0 -47.2 55.7 903 455 B P 0 0 64 0, 0.0 -308,-0.1 0, 0.0 -307,-0.1 -0.251 360.0 360.0 -60.9 152.6 27.7 -45.3 57.6 904 456 B R 0 0 121 -310,-0.7 -310,-0.0 -309,-0.2 -276,-0.0 -0.394 360.0 360.0 -62.9 360.0 31.2 -46.8 57.5