==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 20-OCT-06 2NLX . COMPND 2 MOLECULE: XYLULOSE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR E.DI LUCCIO,J.VOEGTLI,D.K.WILSON . 948 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36637.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 677 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 49 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 132 13.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 1 0.1 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 . 70 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 99 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 274 28.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 2.0 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 3 6 4 0 3 2 6 4 0 2 0 0 0 0 2 0 0 1 0 0 2 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 5 1 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 PARALLEL BRIDGES PER LADDER . 7 4 4 4 2 4 3 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 . 5 2 2 0 0 4 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 14 0, 0.0 68,-2.6 0, 0.0 69,-0.9 0.000 360.0 360.0 360.0 158.1 -21.0 31.5 -42.1 2 2 A Y E -Ab 17 70A 14 15,-2.6 15,-3.0 66,-0.2 2,-0.4 -0.941 360.0-144.3-136.4 147.4 -22.0 30.0 -38.8 3 3 A I E -Ab 16 71A 0 67,-1.9 69,-2.9 -2,-0.3 2,-0.4 -0.957 11.9-172.5-110.0 136.4 -20.5 29.0 -35.5 4 4 A G E -Ab 15 72A 0 11,-1.7 11,-2.4 -2,-0.4 2,-0.4 -0.994 4.3-164.1-118.1 139.0 -21.5 26.1 -33.4 5 5 A I E -Ab 14 73A 0 67,-1.6 69,-2.4 -2,-0.4 2,-0.5 -0.953 4.0-164.6-114.2 136.6 -20.2 25.3 -29.9 6 6 A D E -Ab 13 74A 27 7,-2.3 7,-1.9 -2,-0.4 2,-1.3 -0.935 5.2-161.8-117.3 103.9 -20.5 22.0 -28.0 7 7 A L E +Ab 12 75A 0 67,-2.9 69,-3.1 -2,-0.5 5,-0.2 -0.741 27.1 174.7 -71.0 91.3 -19.8 22.2 -24.3 8 8 A G - 0 0 13 3,-1.5 68,-0.2 -2,-1.3 4,-0.0 0.085 43.8-105.0 -75.7-163.2 -19.1 18.5 -23.7 9 9 A T S S+ 0 0 30 66,-0.1 3,-0.1 22,-0.1 -1,-0.1 0.642 116.0 18.4 -97.4 -19.8 -18.0 16.9 -20.5 10 10 A S S S+ 0 0 88 1,-0.2 21,-3.6 20,-0.1 2,-0.3 0.634 131.2 20.5-125.8 -32.9 -14.5 16.3 -21.6 11 11 A G E - C 0 30A 15 19,-0.3 -3,-1.5 17,-0.0 2,-0.4 -0.799 57.9-139.1-126.2 170.1 -14.1 18.6 -24.5 12 12 A V E -AC 7 29A 1 17,-1.5 17,-1.4 -2,-0.3 2,-0.4 -0.988 23.1-164.1-124.4 140.3 -15.5 21.7 -26.1 13 13 A K E -AC 6 28A 50 -7,-1.9 -7,-2.3 -2,-0.4 2,-0.4 -0.976 6.3-170.0-127.8 129.1 -15.8 21.7 -29.9 14 14 A V E -AC 5 27A 0 13,-2.2 13,-2.0 -2,-0.4 2,-0.3 -0.962 8.4-169.5-119.3 130.0 -16.3 24.7 -32.1 15 15 A I E -AC 4 26A 0 -11,-2.4 -11,-1.7 -2,-0.4 2,-0.5 -0.901 17.0-142.0-120.6 153.2 -17.1 24.5 -35.8 16 16 A L E -AC 3 25A 0 9,-2.1 8,-3.4 -2,-0.3 9,-1.1 -0.954 20.7-164.8-111.1 122.2 -17.3 26.9 -38.6 17 17 A L E -AC 2 23A 0 -15,-3.0 -15,-2.6 -2,-0.5 6,-0.2 -0.887 12.5-133.7-109.6 140.4 -20.1 26.3 -41.2 18 18 A N > - 0 0 19 4,-2.3 3,-2.4 -2,-0.4 4,-0.2 -0.499 38.9 -93.6 -87.8 160.1 -20.4 27.9 -44.6 19 19 A E T 3 S+ 0 0 100 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.724 129.2 58.7 -43.6 -23.4 -23.5 29.5 -46.0 20 20 A Q T 3 S- 0 0 125 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.866 118.6-111.8 -76.5 -36.4 -24.2 26.0 -47.5 21 21 A G S < S+ 0 0 9 -3,-2.4 2,-0.3 1,-0.4 -2,-0.1 0.528 73.3 131.7 112.6 15.3 -24.1 24.3 -44.1 22 22 A E - 0 0 123 -4,-0.2 -4,-2.3 1,-0.0 2,-0.4 -0.669 64.2-100.3 -97.8 153.1 -20.9 22.4 -44.7 23 23 A V E +C 17 0A 71 -2,-0.3 -6,-0.2 -6,-0.2 3,-0.1 -0.612 39.6 169.3 -78.2 129.9 -18.0 22.3 -42.2 24 24 A V E - 0 0 63 -8,-3.4 2,-0.3 -2,-0.4 -7,-0.2 0.710 65.7 -5.0-108.2 -32.2 -15.1 24.5 -43.0 25 25 A A E -C 16 0A 9 -9,-1.1 -9,-2.1 2,-0.0 -1,-0.4 -0.966 57.7-170.8-156.4 168.0 -13.1 24.3 -39.8 26 26 A A E -C 15 0A 38 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.961 0.2-172.0-165.4 149.5 -13.2 22.9 -36.3 27 27 A Q E -C 14 0A 46 -13,-2.0 -13,-2.2 -2,-0.3 2,-0.3 -0.999 4.1-161.5-149.5 145.9 -11.3 23.0 -33.1 28 28 A T E -C 13 0A 73 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.920 5.0-174.3-128.8 152.8 -11.2 21.2 -29.7 29 29 A E E -C 12 0A 20 -17,-1.4 -17,-1.5 -2,-0.3 2,-0.1 -0.984 27.1-122.6-144.7 132.9 -9.9 22.0 -26.2 30 30 A K E -C 11 0A 187 -2,-0.3 2,-0.3 -19,-0.2 -19,-0.3 -0.380 21.1-171.4 -82.6 154.6 -10.0 19.5 -23.3 31 31 A L - 0 0 10 -21,-3.6 2,-0.3 -2,-0.1 -22,-0.1 -0.854 10.7-147.6-130.9 166.2 -11.5 19.7 -19.9 32 32 A T - 0 0 97 -2,-0.3 2,-0.3 -21,-0.0 15,-0.1 -0.849 13.8-122.5-130.5 168.8 -11.1 17.4 -16.9 33 33 A V - 0 0 43 -2,-0.3 2,-0.4 10,-0.1 10,-0.2 -0.851 10.3-132.9-113.7 150.8 -13.5 16.4 -14.1 34 34 A S B -G 42 0B 60 8,-3.5 8,-3.0 -2,-0.3 0, 0.0 -0.842 19.9-179.8 -96.9 144.3 -13.2 16.7 -10.4 35 35 A R + 0 0 187 -2,-0.4 6,-0.1 6,-0.2 5,-0.1 -0.457 17.2 156.5-143.6 58.5 -14.2 13.6 -8.5 36 36 A P + 0 0 62 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 0.953 63.5 14.4 -77.1 -70.6 -13.8 14.5 -5.0 37 37 A H S > S- 0 0 105 1,-0.1 3,-1.5 0, 0.0 2,-0.3 -0.541 104.4 -80.5 -87.7 170.2 -15.9 12.3 -2.8 38 38 A P T 3 S+ 0 0 114 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.559 120.3 23.6 -81.9 136.6 -17.4 9.2 -4.4 39 39 A L T 3 S+ 0 0 125 1,-0.3 60,-4.0 -2,-0.3 61,-0.7 0.367 98.6 121.8 85.7 -2.5 -20.6 9.8 -6.4 40 40 A W < + 0 0 45 -3,-1.5 2,-0.5 58,-0.2 -1,-0.3 -0.851 35.1 174.8 -99.4 121.8 -19.3 13.4 -6.8 41 41 A S + 0 0 5 -2,-0.6 54,-2.5 -6,-0.1 2,-0.3 -0.907 17.9 170.5-126.1 98.8 -18.7 14.6 -10.4 42 42 A E E -GH 34 94B 13 -8,-3.0 -8,-3.5 -2,-0.5 2,-0.3 -0.782 14.4-173.9-115.7 157.3 -17.7 18.3 -10.3 43 43 A Q E - H 0 93B 4 50,-1.2 50,-3.6 -2,-0.3 -10,-0.1 -0.987 29.0-113.5-146.9 153.9 -16.4 20.9 -12.8 44 44 A D >> - 0 0 84 -2,-0.3 4,-1.4 48,-0.2 3,-1.1 -0.778 13.7-152.4 -89.2 112.3 -15.2 24.5 -12.8 45 45 A P H 3> S+ 0 0 0 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.822 101.3 56.7 -54.3 -24.5 -17.6 26.8 -14.7 46 46 A E H 3> S+ 0 0 60 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.815 97.7 58.0 -74.6 -33.3 -14.4 28.8 -15.3 47 47 A Q H <> S+ 0 0 50 -3,-1.1 4,-2.1 1,-0.2 -1,-0.2 0.817 103.9 55.6 -66.2 -29.6 -12.6 25.9 -16.9 48 48 A W H X S+ 0 0 0 -4,-1.4 4,-3.0 2,-0.2 -2,-0.2 0.955 109.2 44.8 -65.5 -51.2 -15.5 25.8 -19.4 49 49 A W H X S+ 0 0 26 -4,-1.4 4,-3.4 2,-0.2 5,-0.2 0.929 113.3 48.1 -59.9 -50.2 -14.9 29.5 -20.4 50 50 A Q H X S+ 0 0 99 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.953 115.3 47.0 -56.2 -48.7 -11.1 29.2 -20.7 51 51 A A H X S+ 0 0 7 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.911 114.3 46.3 -58.2 -46.6 -11.6 26.1 -22.8 52 52 A T H X S+ 0 0 0 -4,-3.0 4,-2.5 2,-0.2 -2,-0.2 0.955 114.6 48.1 -61.0 -50.9 -14.3 27.7 -25.0 53 53 A D H X S+ 0 0 20 -4,-3.4 4,-2.2 1,-0.2 5,-0.3 0.952 109.3 51.6 -55.8 -54.6 -12.2 30.9 -25.4 54 54 A R H X S+ 0 0 136 -4,-3.1 4,-2.4 -5,-0.2 -1,-0.2 0.890 111.7 48.8 -50.8 -43.0 -9.0 29.1 -26.3 55 55 A A H X S+ 0 0 0 -4,-1.9 4,-3.4 -5,-0.2 5,-0.2 0.929 106.9 53.2 -65.8 -47.4 -10.9 27.1 -29.0 56 56 A M H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.884 112.8 45.2 -56.1 -40.1 -12.6 30.1 -30.6 57 57 A K H X S+ 0 0 95 -4,-2.2 4,-3.0 2,-0.2 -1,-0.2 0.924 113.8 49.7 -68.3 -43.4 -9.2 31.8 -30.9 58 58 A A H X S+ 0 0 19 -4,-2.4 4,-1.0 -5,-0.3 -2,-0.2 0.875 111.3 49.0 -61.9 -38.1 -7.7 28.5 -32.2 59 59 A L H X S+ 0 0 0 -4,-3.4 4,-2.4 1,-0.2 3,-0.4 0.918 111.7 50.4 -66.1 -43.0 -10.7 28.3 -34.7 60 60 A G H < S+ 0 0 25 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.894 102.6 57.6 -62.5 -42.9 -10.0 31.8 -35.7 61 61 A D H < S+ 0 0 145 -4,-3.0 -1,-0.3 1,-0.2 -2,-0.2 0.826 111.7 46.6 -57.9 -27.8 -6.3 31.2 -36.3 62 62 A Q H < S- 0 0 107 -4,-1.0 2,-0.2 -3,-0.4 -2,-0.2 0.982 128.8 -0.9 -76.0 -63.5 -7.5 28.6 -38.7 63 63 A H S < S- 0 0 72 -4,-2.4 2,-0.4 -5,-0.1 -1,-0.2 -0.769 82.8 -93.0-123.6 169.8 -10.2 30.5 -40.7 64 64 A S - 0 0 55 -2,-0.2 3,-0.4 1,-0.1 157,-0.1 -0.714 23.6-166.1 -86.5 128.8 -11.6 34.1 -40.5 65 65 A L > + 0 0 3 -2,-0.4 3,-0.7 156,-0.2 158,-0.4 0.162 63.8 103.9 -98.2 18.1 -14.7 34.4 -38.3 66 66 A Q T 3 S+ 0 0 121 1,-0.2 157,-0.2 156,-0.2 -1,-0.2 0.815 79.6 48.4 -68.1 -32.8 -15.4 37.8 -39.8 67 67 A D T 3 S+ 0 0 81 -3,-0.4 2,-0.3 155,-0.1 -1,-0.2 0.461 78.6 122.5 -88.6 -1.6 -18.2 36.5 -42.0 68 68 A V < - 0 0 3 -3,-0.7 155,-0.3 1,-0.2 -66,-0.2 -0.473 36.6-178.4 -63.4 125.1 -19.9 34.6 -39.3 69 69 A K + 0 0 129 -68,-2.6 2,-0.3 -2,-0.3 -1,-0.2 0.791 62.0 14.1 -94.5 -35.9 -23.5 36.0 -39.1 70 70 A A E -b 2 0A 2 -69,-0.9 -67,-1.9 155,-0.2 2,-0.4 -0.980 61.0-146.9-143.1 154.8 -24.9 33.9 -36.2 71 71 A L E -bd 3 227A 0 155,-2.4 157,-1.8 -2,-0.3 2,-0.3 -0.977 11.3-171.3-129.4 130.1 -23.7 31.7 -33.3 72 72 A G E -b 4 0A 0 -69,-2.9 -67,-1.6 -2,-0.4 2,-0.3 -0.788 6.0-157.9-113.5 158.0 -25.3 28.7 -31.7 73 73 A I E +b 5 0A 0 -2,-0.3 158,-1.3 348,-0.2 2,-0.3 -0.993 11.6 176.3-139.9 146.8 -24.5 26.6 -28.6 74 74 A A E +be 6 231A 1 -69,-2.4 -67,-2.9 -2,-0.3 2,-0.3 -0.954 14.4 167.5-141.2 155.6 -25.1 23.2 -27.2 75 75 A G E -be 7 232A 0 156,-0.8 158,-1.9 -2,-0.3 -67,-0.2 -0.995 40.8 -59.2-161.5 161.8 -23.8 21.5 -24.1 76 76 A Q - 0 0 0 -69,-3.1 77,-0.4 -2,-0.3 3,-0.3 -0.170 62.1-120.4 -38.5 135.3 -23.9 18.7 -21.5 77 77 A M S S+ 0 0 11 1,-0.2 2,-0.6 75,-0.1 19,-0.2 -0.227 73.7 13.9 -85.1 167.6 -27.2 18.5 -19.8 78 78 A H S S+ 0 0 26 92,-0.4 -1,-0.2 1,-0.1 16,-0.1 0.276 74.5 145.2 63.6 -8.3 -28.5 18.8 -16.2 79 79 A G - 0 0 0 -2,-0.6 2,-0.6 -3,-0.3 16,-0.2 -0.313 43.9-134.5 -66.8 152.6 -25.4 20.3 -14.8 80 80 A A B -I 94 0B 1 14,-1.3 14,-1.2 71,-0.1 2,-0.6 -0.931 20.4-173.8-125.9 112.1 -26.1 22.7 -12.0 81 81 A T E -J 150 0C 0 69,-1.6 69,-2.7 -2,-0.6 2,-0.5 -0.921 10.4-155.1-118.3 116.2 -24.4 26.0 -11.9 82 82 A L E +J 149 0C 2 -2,-0.6 8,-2.4 9,-0.5 9,-0.5 -0.780 14.9 178.9-102.9 122.1 -25.0 28.2 -8.9 83 83 A L E -JK 148 89C 0 65,-2.4 64,-3.1 -2,-0.5 65,-2.1 -0.960 16.6-144.8-127.0 141.5 -24.5 32.0 -9.1 84 84 A D > - 0 0 12 4,-1.9 3,-2.5 -2,-0.4 4,-0.2 -0.341 46.6 -83.7 -90.9 176.7 -24.9 34.9 -6.6 85 85 A A T 3 S+ 0 0 55 60,-0.4 61,-0.1 1,-0.3 -1,-0.0 0.712 129.7 58.3 -56.9 -23.2 -26.2 38.4 -7.4 86 86 A Q T 3 S- 0 0 132 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.284 121.9-109.0 -88.4 10.1 -22.7 39.5 -8.5 87 87 A Q S < S+ 0 0 88 -3,-2.5 2,-0.3 1,-0.2 -2,-0.2 0.787 70.7 151.0 67.6 29.5 -22.9 36.7 -11.0 88 88 A R - 0 0 146 -4,-0.2 -4,-1.9 1,-0.0 2,-0.6 -0.693 53.0-109.7 -98.1 147.5 -20.3 34.7 -9.1 89 89 A V B -K 83 0C 55 -2,-0.3 -6,-0.2 -6,-0.2 -1,-0.0 -0.616 24.3-168.7 -75.3 113.3 -19.9 30.9 -8.8 90 90 A L - 0 0 26 -8,-2.4 -1,-0.2 -2,-0.6 -7,-0.1 0.759 69.8 -14.8 -73.4 -26.3 -20.9 29.7 -5.4 91 91 A R S S- 0 0 19 -9,-0.5 -9,-0.5 51,-0.0 -1,-0.2 -0.972 87.7 -68.0-169.1 161.2 -19.5 26.2 -5.9 92 92 A P - 0 0 54 0, 0.0 2,-0.5 0, 0.0 -48,-0.2 -0.047 64.7 -92.2 -52.1 162.6 -18.2 23.8 -8.6 93 93 A A E -H 43 0B 0 -50,-3.6 -50,-1.2 -12,-0.1 2,-1.0 -0.691 28.3-133.4 -85.3 127.8 -20.9 22.6 -11.0 94 94 A I E -HI 42 80B 3 -14,-1.2 -14,-1.3 -2,-0.5 -52,-0.2 -0.702 34.7-145.3 -78.0 104.3 -22.6 19.3 -10.1 95 95 A L > - 0 0 0 -54,-2.5 3,-1.0 -2,-1.0 -54,-0.1 0.101 24.3 -94.5 -64.0-179.7 -22.4 17.5 -13.5 96 96 A W T 3 S+ 0 0 116 1,-0.3 -1,-0.1 -19,-0.2 -18,-0.1 0.760 122.3 53.4 -68.1 -27.6 -25.0 15.1 -15.0 97 97 A N T 3 S+ 0 0 59 -56,-0.1 2,-0.3 29,-0.1 -1,-0.3 -0.097 80.4 112.9-102.2 32.4 -23.1 12.1 -13.7 98 98 A D < - 0 0 5 -3,-1.0 -58,-0.2 27,-0.1 3,-0.1 -0.742 42.0-173.8 -97.6 150.9 -23.0 13.1 -10.0 99 99 A G > + 0 0 18 -60,-4.0 3,-1.0 -2,-0.3 -59,-0.2 0.239 45.2 115.3-134.2 18.2 -25.0 11.0 -7.6 100 100 A R T 3 S+ 0 0 24 -61,-0.7 3,-0.3 1,-0.2 4,-0.1 0.624 74.0 61.6 -65.3 -10.9 -24.9 12.7 -4.2 101 101 A C T 3> + 0 0 0 1,-0.2 4,-0.8 24,-0.2 -1,-0.2 -0.024 53.8 123.9-111.3 36.7 -28.6 13.3 -4.3 102 102 A A H <> S+ 0 0 57 -3,-1.0 4,-0.9 1,-0.2 3,-0.2 0.797 79.9 51.1 -63.0 -27.1 -30.4 10.0 -4.5 103 103 A Q H >> S+ 0 0 91 -3,-0.3 4,-1.6 1,-0.2 3,-0.5 0.937 103.1 56.7 -71.6 -49.2 -32.3 10.8 -1.4 104 104 A E H 3> S+ 0 0 3 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.623 99.1 64.2 -59.0 -17.6 -33.5 14.1 -2.5 105 105 A C H 3X S+ 0 0 6 -4,-0.8 4,-1.7 2,-0.2 3,-0.5 0.946 104.6 42.2 -70.5 -54.0 -35.0 12.5 -5.5 106 106 A T H < + 0 0 6 -4,-1.8 3,-0.5 1,-0.1 -1,-0.3 -0.859 65.1 174.0-135.0 100.4 -44.7 16.4 -5.7 113 113 A P T > S+ 0 0 108 0, 0.0 3,-0.8 0, 0.0 4,-0.2 0.873 81.1 55.0 -72.7 -41.7 -46.6 13.4 -6.9 114 114 A Q T >> S+ 0 0 128 1,-0.2 4,-2.2 2,-0.1 3,-1.9 0.519 81.0 110.7 -71.2 -0.2 -47.7 14.6 -10.2 115 115 A S H <> S+ 0 0 0 -3,-0.5 4,-2.5 1,-0.3 5,-0.4 0.797 72.1 48.6 -42.3 -47.8 -44.0 15.2 -10.8 116 116 A R H <> S+ 0 0 73 -3,-0.8 4,-0.6 1,-0.2 -1,-0.3 0.756 113.9 51.5 -69.5 -21.4 -43.5 12.5 -13.3 117 117 A V H <4 S+ 0 0 76 -3,-1.9 -2,-0.3 -4,-0.2 -1,-0.2 0.891 111.5 43.4 -79.9 -44.8 -46.5 13.9 -15.0 118 118 A I H < S+ 0 0 19 -4,-2.2 61,-1.1 1,-0.2 62,-0.5 0.921 130.7 25.0 -66.9 -46.9 -45.3 17.4 -15.1 119 119 A T H < S- 0 0 0 -4,-2.5 -3,-0.2 59,-0.2 -1,-0.2 0.614 96.9-137.3 -91.2 -18.8 -41.8 16.6 -16.1 120 120 A G < + 0 0 0 -4,-0.6 149,-0.5 -5,-0.4 156,-0.3 0.656 67.1 97.2 66.2 23.1 -42.7 13.4 -17.7 121 121 A N S S- 0 0 0 -6,-0.4 2,-0.5 154,-0.1 -1,-0.2 -0.858 78.0-105.4-136.5 168.8 -39.7 11.7 -16.3 122 122 A L - 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0 0 80 -6,-0.5 2,-0.8 48,-0.1 -1,-0.3 -0.768 57.6-142.4-102.4 146.1 -27.9 37.3 -20.9 164 164 A F + 0 0 51 -2,-0.3 37,-2.4 -3,-0.1 2,-0.3 -0.838 50.9 132.8-103.9 91.5 -29.6 34.8 -18.6 165 165 A A E +l 201 0D 2 -2,-0.8 2,-0.3 -11,-0.3 37,-0.2 -0.929 30.4 178.2-143.6 167.1 -31.2 32.3 -21.0 166 166 A S E -l 202 0D 1 35,-2.2 37,-1.5 -2,-0.3 2,-0.3 -0.931 27.7-112.8-154.0 172.0 -31.8 28.7 -21.9 167 167 A D E > -l 203 0D 0 -2,-0.3 4,-2.5 62,-0.2 3,-0.4 -0.765 30.0-112.7-111.4 160.1 -33.7 26.6 -24.5 168 168 A M H > S+ 0 0 15 35,-1.6 4,-1.6 -2,-0.3 110,-0.5 0.833 113.1 55.6 -61.0 -36.2 -36.7 24.3 -23.8 169 169 A S H > S+ 0 0 2 110,-0.3 4,-0.5 61,-0.2 -1,-0.2 0.854 115.9 37.6 -68.9 -31.3 -34.9 21.1 -24.6 170 170 A D H 4 S+ 0 0 0 -3,-0.4 3,-0.4 2,-0.2 -92,-0.4 0.838 115.4 52.2 -86.1 -36.2 -32.2 21.8 -22.0 171 171 A A H >X>S+ 0 0 0 -4,-2.5 3,-1.3 1,-0.2 5,-0.6 0.774 100.5 65.5 -69.0 -25.8 -34.5 23.4 -19.5 172 172 A A H ><5S+ 0 0 0 -4,-1.6 3,-0.9 1,-0.3 5,-0.3 0.867 92.3 61.8 -65.1 -35.8 -36.7 20.3 -19.8 173 173 A G T 3<5S+ 0 0 0 -4,-0.5 -45,-0.9 -3,-0.4 -1,-0.3 0.182 90.1 69.9 -78.1 20.9 -33.9 18.3 -18.2 174 174 A T T <45S- 0 0 3 -3,-1.3 -45,-2.7 -47,-0.2 -1,-0.2 0.749 96.0-131.5-101.1 -34.0 -34.0 20.2 -15.0 175 175 A M T <<5S+ 0 0 0 -3,-0.9 -3,-0.1 -4,-0.5 -2,-0.1 0.658 88.9 97.6 85.8 21.8 -37.3 18.9 -13.8 176 176 A W < + 0 0 3 -5,-0.6 9,-3.3 -57,-0.1 2,-0.5 0.376 66.1 89.6-111.8 -3.9 -38.4 22.4 -13.1 177 177 A L E S-M 184 0E 0 -6,-0.4 2,-1.7 -5,-0.3 7,-0.3 -0.816 74.4-139.5-103.2 131.2 -40.2 22.6 -16.4 178 178 A D E >>> -M 183 0E 22 5,-2.6 3,-1.2 -2,-0.5 5,-1.0 -0.700 28.9-160.9 -79.1 90.7 -43.8 21.6 -17.1 179 179 A V T 345S+ 0 0 0 -2,-1.7 3,-0.3 -61,-1.1 -1,-0.2 0.766 81.7 56.2 -50.1 -33.3 -42.6 20.0 -20.4 180 180 A A T 345S+ 0 0 49 -62,-0.5 -1,-0.3 1,-0.2 86,-0.1 0.882 114.1 39.3 -69.0 -35.6 -46.1 19.9 -22.0 181 181 A K T <45S- 0 0 151 -3,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.442 100.9-130.2 -92.7 -2.2 -46.5 23.7 -21.5 182 182 A R T <5S+ 0 0 20 -4,-0.9 2,-0.3 -3,-0.3 -3,-0.2 0.930 75.4 98.4 51.4 47.2 -42.9 24.7 -22.4 183 183 A D E - 0 0 10 -9,-3.3 4,-2.0 1,-0.2 5,-0.2 -0.948 10.4-161.3-109.7 113.4 -43.5 24.7 -13.1 186 186 A D H > S+ 0 0 74 -2,-0.6 4,-3.5 1,-0.2 5,-0.3 0.911 93.7 58.8 -60.5 -39.2 -44.0 26.7 -10.0 187 187 A V H > S+ 0 0 84 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.942 107.8 44.2 -52.7 -53.1 -45.0 23.5 -8.2 188 188 A M H > S+ 0 0 0 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.822 116.6 47.3 -63.0 -34.8 -41.6 21.9 -9.0 189 189 A L H ><>S+ 0 0 0 -4,-2.0 5,-2.1 -13,-0.2 3,-0.8 0.949 107.5 53.0 -73.6 -50.4 -39.7 25.1 -8.1 190 190 A Q H ><5S+ 0 0 101 -4,-3.5 3,-1.4 1,-0.3 -2,-0.2 0.871 104.4 59.1 -53.6 -38.0 -41.5 25.8 -4.8 191 191 A A H 3<5S+ 0 0 11 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.889 109.7 41.2 -58.0 -41.7 -40.6 22.2 -3.8 192 192 A C T <<5S- 0 0 0 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.391 118.8-117.9 -86.3 5.3 -36.9 23.0 -4.2 193 193 A D T < 5S+ 0 0 102 -3,-1.4 2,-0.3 -4,-0.4 -3,-0.2 0.949 73.3 129.5 54.6 52.1 -37.7 26.3 -2.6 194 194 A L < - 0 0 3 -5,-2.1 2,-0.3 -8,-0.2 -1,-0.2 -0.760 44.6-145.7-125.2 172.2 -36.7 28.1 -5.7 195 195 A S > - 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0 0 6 -2,-0.3 4,-2.2 -71,-0.2 5,-0.2 -0.464 41.3-100.5 -80.4 160.7 -9.4 -57.8 -12.2 630 152 B P H >> S+ 0 0 0 0, 0.0 4,-1.6 0, 0.0 3,-0.5 0.935 121.5 46.6 -46.7 -61.9 -7.1 -57.1 -15.2 631 153 B K H 3> S+ 0 0 0 -77,-0.4 4,-0.9 1,-0.2 3,-0.1 0.882 115.1 48.3 -50.9 -43.5 -3.9 -57.0 -13.3 632 154 B D H 3> S+ 0 0 1 2,-0.2 4,-2.0 1,-0.2 11,-0.3 0.799 102.7 59.7 -70.8 -30.7 -4.8 -60.2 -11.4 633 155 B Y H S+ 0 0 0 -4,-0.9 4,-2.7 2,-0.2 5,-0.6 0.920 104.1 55.4 -66.0 -43.3 -1.0 -62.9 -12.2 636 158 B L H X5S+ 0 0 10 -4,-2.0 4,-2.2 1,-0.3 -2,-0.2 0.914 106.5 49.6 -55.4 -47.0 -3.0 -66.1 -13.0 637 159 B R H <5S+ 0 0 76 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.787 117.2 42.0 -65.7 -25.2 -1.2 -66.5 -16.3 638 160 B M H <5S+ 0 0 0 -4,-1.1 53,-3.4 -3,-0.5 -2,-0.2 0.768 135.1 9.8 -93.2 -27.3 2.2 -66.1 -14.6 639 161 B T H <5S- 0 0 11 -4,-2.7 50,-0.3 51,-0.3 -3,-0.2 0.526 86.8-121.9-129.4 -14.1 1.7 -68.1 -11.4 640 162 B G S < -f 681 0K 0 -2,-0.3 4,-3.1 35,-0.2 5,-0.2 -0.813 30.3-109.1-115.7 160.8 -4.4 -56.6 -3.4 646 168 B M H > S+ 0 0 13 35,-1.3 4,-2.8 -2,-0.3 110,-0.4 0.870 114.2 55.5 -55.8 -40.6 -6.6 -54.4 -1.2 647 169 B S H > S+ 0 0 2 110,-0.4 4,-0.8 61,-0.3 109,-0.2 0.958 116.2 35.2 -61.0 -51.1 -6.3 -51.4 -3.5 648 170 B D H >4 S+ 0 0 0 1,-0.2 3,-0.6 2,-0.2 -92,-0.3 0.907 116.7 55.1 -70.5 -40.2 -7.5 -53.1 -6.6 649 171 B A H ><>S+ 0 0 0 -4,-3.1 3,-2.6 1,-0.3 5,-0.6 0.925 101.6 56.9 -57.7 -48.9 -10.0 -55.3 -4.7 650 172 B A H ><5S+ 0 0 1 -4,-2.8 3,-1.2 1,-0.3 -1,-0.3 0.808 96.3 67.5 -52.9 -30.2 -11.7 -52.2 -3.0 651 173 B G T <<5S+ 0 0 0 -4,-0.8 -45,-0.8 -3,-0.6 -1,-0.3 0.464 88.7 66.5 -72.4 1.6 -12.3 -51.0 -6.6 652 174 B T T < 5S- 0 0 4 -3,-2.6 -45,-2.3 -47,-0.2 -1,-0.2 0.645 100.0-128.5 -94.1 -20.3 -14.7 -53.9 -7.2 653 175 B M T < 5S+ 0 0 0 -3,-1.2 -3,-0.1 -4,-0.4 -56,-0.1 0.720 92.7 91.5 75.2 23.5 -17.4 -52.7 -4.7 654 176 B W < + 0 0 2 -5,-0.6 9,-3.5 -57,-0.1 13,-0.3 0.407 66.3 92.1-117.9 -13.4 -17.3 -56.2 -3.1 655 177 B L E S-G 662 0L 0 -6,-0.4 2,-1.5 7,-0.3 7,-0.2 -0.645 75.3-134.6 -88.8 140.6 -14.7 -55.3 -0.6 656 178 B D E >> -G 661 0L 27 5,-3.4 4,-2.0 -2,-0.3 5,-0.9 -0.777 24.8-160.3 -90.5 90.5 -15.5 -54.0 2.9 657 179 B V T 45S+ 0 0 0 -2,-1.5 -1,-0.2 -61,-0.9 -60,-0.1 0.817 83.9 51.5 -42.8 -43.6 -12.9 -51.2 2.6 658 180 B A T 45S+ 0 0 45 -62,-0.5 -1,-0.2 1,-0.2 86,-0.1 0.985 117.8 35.0 -61.0 -59.3 -12.7 -50.8 6.4 659 181 B K T 45S- 0 0 157 2,-0.1 -1,-0.2 1,-0.0 -2,-0.2 0.603 101.1-134.0 -71.6 -11.3 -12.2 -54.4 7.3 660 182 B R T <5S+ 0 0 16 -4,-2.0 2,-0.3 1,-0.2 -3,-0.2 0.977 70.3 102.4 52.9 58.0 -10.0 -55.0 4.2 661 183 B D E - 0 0 8 -9,-3.5 4,-2.3 1,-0.2 5,-0.2 -0.868 12.5-160.3 -96.0 117.3 -18.1 -58.1 2.1 664 186 B D H > S+ 0 0 73 -2,-0.7 4,-3.0 1,-0.2 5,-0.3 0.906 89.5 56.6 -64.5 -42.6 -20.6 -60.9 2.1 665 187 B V H > S+ 0 0 83 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.923 110.4 46.6 -54.7 -45.1 -23.6 -58.7 1.9 666 188 B M H > S+ 0 0 0 2,-0.2 4,-0.5 -12,-0.2 -2,-0.2 0.967 114.2 44.8 -62.8 -55.7 -22.2 -57.2 -1.3 667 189 B L H ><>S+ 0 0 0 -4,-2.3 3,-3.1 -13,-0.3 5,-1.2 0.970 111.7 53.4 -53.2 -56.9 -21.3 -60.5 -2.9 668 190 B Q H ><5S+ 0 0 121 -4,-3.0 3,-2.0 1,-0.3 -1,-0.2 0.845 100.6 60.4 -47.3 -41.0 -24.6 -62.1 -2.0 669 191 B A H 3<5S+ 0 0 15 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.637 109.9 44.1 -64.5 -12.0 -26.5 -59.2 -3.6 670 192 B C T <<5S- 0 0 0 -3,-3.1 -1,-0.3 -4,-0.5 -2,-0.2 0.200 117.3-110.7-114.6 11.7 -24.8 -60.2 -6.9 671 193 B D T < 5S+ 0 0 91 -3,-2.0 2,-0.3 1,-0.2 -3,-0.2 0.916 80.9 121.1 56.8 45.2 -25.3 -64.0 -6.5 672 194 B L < - 0 0 6 -5,-1.2 2,-0.3 -8,-0.2 -1,-0.2 -0.928 44.1-160.1-133.8 156.8 -21.6 -64.4 -6.0 673 195 B S > - 0 0 51 -2,-0.3 3,-3.6 -3,-0.1 4,-0.5 -0.930 40.5 -95.5-137.9 161.5 -19.5 -65.9 -3.1 674 196 B R G > S+ 0 0 85 1,-0.3 3,-1.6 -2,-0.3 -1,-0.0 0.781 118.7 71.3 -44.8 -31.7 -16.0 -65.8 -1.8 675 197 B D G 3 S+ 0 0 128 1,-0.3 -1,-0.3 -49,-0.0 -3,-0.0 0.776 100.3 46.1 -56.7 -27.0 -15.4 -69.0 -3.7 676 198 B Q G < S+ 0 0 32 -3,-3.6 -49,-2.8 -50,-0.1 -1,-0.3 0.460 101.3 80.4 -96.5 -3.3 -15.6 -66.8 -6.9 677 199 B M S < S- 0 0 5 -3,-1.6 -49,-0.1 -4,-0.5 3,-0.1 -0.702 82.6-115.7-100.5 154.9 -13.3 -64.1 -5.6 678 200 B P - 0 0 6 0, 0.0 -35,-0.3 0, 0.0 2,-0.2 -0.265 44.1 -84.9 -79.0 175.3 -9.5 -64.3 -5.6 679 201 B A E -f 643 0K 47 -37,-3.6 -35,-2.3 8,-0.1 2,-0.4 -0.615 45.5-117.7 -84.1 147.2 -7.6 -64.4 -2.3 680 202 B L E +f 644 0K 34 -2,-0.2 2,-0.3 -37,-0.2 -35,-0.2 -0.672 35.9 168.7 -90.2 132.7 -6.7 -61.0 -0.6 681 203 B Y E -f 645 0K 71 -37,-1.8 -35,-1.3 -2,-0.4 2,-0.3 -0.927 38.3-109.4-134.4 158.7 -3.2 -59.8 -0.0 682 204 B E > - 0 0 18 -2,-0.3 3,-2.6 -37,-0.2 25,-0.5 -0.648 45.8-105.5 -81.8 149.8 -1.6 -56.5 1.0 683 205 B G T 3 S+ 0 0 0 74,-0.3 25,-2.8 1,-0.3 76,-0.2 0.778 119.3 47.6 -46.2 -37.3 0.3 -54.9 -1.9 684 206 B S T 3 S+ 0 0 18 23,-0.2 -1,-0.3 22,-0.1 2,-0.3 0.405 90.7 104.2 -89.2 2.7 3.7 -55.8 -0.6 685 207 B E S < S- 0 0 87 -3,-2.6 22,-2.4 23,-0.1 2,-0.2 -0.632 77.0-113.0 -86.7 143.8 2.8 -59.4 0.3 686 208 B I E -Z 706 0H 82 -2,-0.3 20,-0.3 20,-0.2 3,-0.1 -0.555 29.3-177.5 -74.3 135.7 4.0 -62.3 -1.9 687 209 B T E - 0 0 4 18,-3.2 2,-0.3 1,-0.4 19,-0.2 0.455 56.5 -51.9-113.1 -4.8 1.2 -64.1 -3.7 688 210 B G E -Z 705 0H 14 17,-0.5 17,-3.6 -47,-0.1 -1,-0.4 -0.945 57.4 -86.6 157.1-175.3 3.0 -66.9 -5.5 689 211 B A E -Z 704 0H 43 -2,-0.3 2,-0.3 15,-0.3 14,-0.2 -0.739 48.3 -83.5-121.1 170.1 5.9 -67.7 -7.8 690 212 B L - 0 0 3 13,-1.3 -51,-0.3 -2,-0.2 -52,-0.1 -0.584 49.4-107.5 -76.1 133.0 6.3 -67.7 -11.6 691 213 B L > - 0 0 55 -53,-3.4 4,-3.0 -2,-0.3 5,-0.2 -0.359 32.5-118.1 -54.9 138.2 5.2 -70.9 -13.2 692 214 B P H > S+ 0 0 77 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.863 114.5 55.4 -48.6 -43.0 8.5 -72.7 -14.3 693 215 B E H > S+ 0 0 125 2,-0.2 4,-3.1 1,-0.2 3,-0.3 0.980 111.3 42.1 -52.8 -62.7 7.4 -72.5 -17.9 694 216 B V H > S+ 0 0 13 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.896 111.3 56.5 -51.6 -47.5 6.9 -68.7 -17.7 695 217 B A H <>S+ 0 0 4 -4,-3.0 5,-2.6 1,-0.2 4,-0.4 0.920 112.4 42.4 -51.7 -46.8 10.1 -68.4 -15.8 696 218 B K H ><5S+ 0 0 182 -4,-2.8 3,-1.1 -3,-0.3 -2,-0.2 0.905 109.1 57.0 -69.0 -42.9 11.9 -70.2 -18.6 697 219 B A H 3<5S+ 0 0 50 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.754 114.4 40.4 -60.9 -22.8 10.2 -68.3 -21.3 698 220 B W T 3<5S- 0 0 8 -4,-1.7 -155,-0.4 -3,-0.3 -1,-0.2 0.398 111.7-112.9-107.7 1.8 11.4 -65.0 -19.8 699 221 B G T < 5S+ 0 0 23 -3,-1.1 2,-0.3 -4,-0.4 -3,-0.2 0.891 78.7 104.6 70.7 39.4 14.9 -65.9 -18.8 700 222 B M < - 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0 0 48 -5,-1.0 -1,-0.2 -6,-0.3 -2,-0.1 -0.487 42.5-169.2 -82.2 158.2 -2.7 -16.6 -28.0 786 308 B S + 0 0 85 -2,-0.1 2,-0.3 -3,-0.1 -5,-0.2 0.628 64.0 66.5-120.6 -26.4 -1.6 -20.1 -29.0 787 309 B N > - 0 0 90 -7,-0.2 4,-1.2 1,-0.1 5,-0.1 -0.732 68.0-143.9 -97.5 145.5 0.8 -21.1 -26.2 788 310 B V H > S+ 0 0 33 -2,-0.3 4,-1.8 1,-0.2 5,-0.2 0.857 106.2 63.3 -72.6 -32.9 -0.3 -21.7 -22.6 789 311 B P H > S+ 0 0 82 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.889 99.0 57.0 -54.9 -37.1 3.1 -20.1 -21.7 790 312 B A H > S+ 0 0 34 2,-0.2 4,-4.5 1,-0.2 -2,-0.2 0.936 105.6 44.6 -61.0 -52.6 1.8 -17.0 -23.4 791 313 B L H X S+ 0 0 0 -4,-1.2 4,-4.6 1,-0.2 -1,-0.2 0.807 111.2 55.8 -67.5 -24.2 -1.4 -16.4 -21.4 792 314 B I H X S+ 0 0 20 -4,-1.8 4,-0.5 2,-0.2 -1,-0.2 0.921 114.2 39.9 -68.7 -42.0 0.7 -17.2 -18.3 793 315 B A H >X S+ 0 0 42 -4,-2.1 3,-1.8 -5,-0.2 4,-0.7 0.971 119.3 46.4 -66.9 -52.1 3.0 -14.4 -19.4 794 316 B A H >X S+ 0 0 18 -4,-4.5 3,-2.0 1,-0.3 4,-0.6 0.946 106.4 58.3 -53.7 -53.5 -0.1 -12.3 -20.5 795 317 B A H 3< S+ 0 0 0 -4,-4.6 3,-0.3 1,-0.3 -1,-0.3 0.720 102.4 60.7 -41.2 -29.5 -1.7 -13.2 -17.2 796 318 B Q H << S+ 0 0 95 -3,-1.8 -1,-0.3 -4,-0.5 -2,-0.2 0.722 101.8 45.1 -79.6 -25.9 1.3 -11.5 -15.7 797 319 B Q H << S+ 0 0 131 -3,-2.0 -1,-0.2 -4,-0.7 -2,-0.2 0.326 76.5 137.6-101.1 6.6 1.0 -8.1 -17.1 798 320 B A < - 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0 0 20 1,-0.2 4,-2.6 -3,-0.1 5,-0.2 -0.715 58.3-161.1 -84.2 116.0 4.9 -22.4 -14.6 869 400 B E H > S+ 0 0 101 -2,-0.7 4,-2.9 1,-0.2 -1,-0.2 0.883 93.9 55.5 -60.1 -35.3 6.5 -21.2 -11.4 870 401 B Y H > S+ 0 0 55 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.926 110.0 41.3 -63.8 -49.2 3.9 -18.3 -11.6 871 402 B W H > S+ 0 0 6 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.874 114.1 54.6 -69.4 -33.7 0.9 -20.6 -11.7 872 403 B R H X S+ 0 0 2 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.960 109.3 46.7 -61.6 -48.9 2.4 -22.8 -9.1 873 404 B Q H X S+ 0 0 47 -4,-2.9 4,-1.9 1,-0.2 54,-0.3 0.760 109.6 55.4 -65.3 -24.9 2.8 -19.9 -6.8 874 405 B M H X S+ 0 0 8 -4,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.931 104.6 51.6 -72.2 -45.7 -0.7 -18.7 -7.5 875 406 B L H X S+ 0 0 6 -4,-2.3 4,-2.1 1,-0.2 6,-0.4 0.808 109.4 53.0 -59.2 -31.1 -2.2 -22.1 -6.5 876 407 B A H X>S+ 0 0 0 -4,-1.4 4,-2.4 2,-0.2 5,-0.6 0.955 111.9 42.6 -69.9 -48.9 -0.2 -21.7 -3.2 877 408 B D H <5S+ 0 0 3 -4,-1.9 57,-0.2 1,-0.2 -2,-0.2 0.771 117.6 48.2 -68.3 -27.6 -1.6 -18.3 -2.5 878 409 B I H <5S+ 0 0 1 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.930 122.3 29.5 -78.2 -48.0 -5.1 -19.4 -3.5 879 410 B S H <5S- 0 0 5 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.749 95.1-131.5 -84.5 -29.0 -5.4 -22.6 -1.5 880 411 B G T <5 + 0 0 24 -4,-2.4 2,-0.4 -5,-0.3 -3,-0.2 0.839 63.3 131.8 77.1 32.1 -3.1 -21.8 1.3 881 412 B Q < - 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0 0 47 1,-0.1 3,-2.6 0, 0.0 4,-1.2 -0.653 19.8-111.6 -96.8 156.9 12.4 -50.4 6.2 911 442 B L H >> S+ 0 0 43 1,-0.3 4,-2.1 -2,-0.2 3,-1.3 0.938 118.5 66.8 -50.1 -47.4 9.8 -48.8 3.9 912 443 B I H 34 S+ 0 0 145 1,-0.3 -1,-0.3 2,-0.2 -3,-0.0 0.722 105.0 45.0 -45.3 -24.7 11.4 -45.5 4.7 913 444 B E H <4 S+ 0 0 111 -3,-2.6 -1,-0.3 1,-0.1 -2,-0.2 0.743 116.1 41.6 -94.6 -26.9 14.4 -46.9 2.8 914 445 B L H << S+ 0 0 16 -3,-1.3 -2,-0.2 -4,-1.2 -3,-0.1 0.563 104.0 65.8 -99.7 -8.2 12.7 -48.4 -0.2 915 446 B L < + 0 0 19 -4,-2.1 -1,-0.2 -5,-0.2 -193,-0.1 -0.570 63.2 169.3-118.3 73.6 10.2 -45.7 -1.0 916 447 B P - 0 0 66 0, 0.0 2,-0.2 0, 0.0 -195,-0.1 -0.132 25.0-128.1 -73.4 171.9 11.8 -42.4 -2.1 917 448 B Q - 0 0 81 -197,-0.1 -197,-0.2 1,-0.1 3,-0.1 -0.642 35.4 -79.0-113.6 174.3 10.1 -39.4 -3.6 918 449 B L - 0 0 22 -199,-0.6 -30,-0.1 -2,-0.2 -1,-0.1 -0.454 63.9 -85.1 -72.1 146.6 10.7 -37.4 -6.8 919 450 B P - 0 0 80 0, 0.0 -32,-1.8 0, 0.0 -1,-0.1 -0.307 49.2-107.0 -57.2 125.8 13.6 -34.9 -6.5 920 451 B L E +M 886 0M 101 -34,-0.2 -34,-0.3 1,-0.2 3,-0.1 -0.278 38.6 176.3 -54.6 132.5 12.4 -31.5 -5.0 921 452 B E E - 0 0 100 -36,-3.1 2,-0.3 1,-0.5 -35,-0.2 0.600 63.9 -26.6-113.5 -20.6 12.3 -28.9 -7.7 922 453 B Q E -M 885 0M 76 -37,-1.4 -37,-2.2 2,-0.0 -1,-0.5 -0.886 53.2-134.9 176.0 160.3 10.9 -25.9 -5.7 923 454 B S E -M 884 0M 44 -39,-0.3 2,-0.5 -2,-0.3 -39,-0.3 -0.999 16.4-156.7-135.3 128.1 8.7 -25.3 -2.7 924 455 B H E -M 883 0M 1 -41,-2.0 -41,-2.5 -2,-0.4 -2,-0.0 -0.929 5.5-168.2-113.5 121.3 5.9 -22.8 -2.7 925 456 B L - 0 0 113 -2,-0.5 2,-0.2 -43,-0.2 -48,-0.1 -0.856 34.8-100.7-106.4 140.0 4.6 -21.2 0.5 926 457 B P - 0 0 46 0, 0.0 2,-0.7 0, 0.0 -49,-0.1 -0.378 30.5-124.8 -62.2 126.8 1.4 -19.2 0.5 927 458 B D > - 0 0 49 -54,-0.3 4,-3.8 1,-0.2 5,-0.2 -0.641 15.6-147.6 -73.8 113.0 1.9 -15.4 0.5 928 459 B A H > S+ 0 0 75 -2,-0.7 4,-2.6 2,-0.2 5,-0.2 0.840 95.2 54.7 -50.2 -38.7 -0.0 -14.2 3.5 929 460 B Q H > S+ 0 0 154 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.994 117.2 31.9 -60.7 -65.6 -0.8 -11.0 1.7 930 461 B R H > S+ 0 0 117 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.867 117.9 59.3 -61.8 -34.5 -2.3 -12.5 -1.4 931 462 B Y H X S+ 0 0 86 -4,-3.8 4,-1.9 1,-0.2 -1,-0.2 0.922 106.8 44.3 -60.1 -47.6 -3.7 -15.4 0.6 932 463 B A H < S+ 0 0 65 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.818 114.5 50.3 -68.3 -30.3 -5.8 -13.3 2.9 933 464 B A H X S+ 0 0 54 -4,-1.6 4,-0.8 -5,-0.2 -1,-0.2 0.793 110.1 52.2 -76.2 -29.6 -7.0 -11.2 -0.0 934 465 B Y H X S+ 0 0 20 -4,-1.9 4,-3.2 -57,-0.2 5,-0.3 0.889 90.9 70.4 -75.5 -43.3 -8.0 -14.4 -1.9 935 466 B Q H < S+ 0 0 48 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.825 107.1 41.0 -47.1 -35.7 -10.1 -16.2 0.6 936 467 B P H >4 S+ 0 0 76 0, 0.0 3,-1.8 0, 0.0 -1,-0.3 0.828 110.8 58.3 -81.2 -31.0 -12.8 -13.6 0.1 937 468 B R H >< S+ 0 0 88 -4,-0.8 3,-0.5 1,-0.3 4,-0.3 0.915 96.2 62.1 -60.4 -41.1 -12.1 -13.7 -3.6 938 469 B R T 3< S+ 0 0 15 -4,-3.2 -1,-0.3 1,-0.3 -3,-0.1 0.388 77.9 92.1 -67.7 9.5 -12.9 -17.4 -3.4 939 470 B E T < S+ 0 0 74 -3,-1.8 4,-0.5 -5,-0.3 -1,-0.3 0.030 75.9 65.1 -90.6 26.3 -16.3 -16.1 -2.3 940 471 B T S <>>S+ 0 0 7 -3,-0.5 5,-1.8 2,-0.2 2,-1.6 0.688 95.2 51.2-106.8 -54.8 -17.1 -16.2 -6.0 941 472 B F T 45S+ 0 0 19 -4,-0.3 2,-0.1 3,-0.2 -2,-0.1 -0.079 112.2 65.4 -75.4 39.2 -16.8 -20.0 -6.1 942 473 B R T >5S- 0 0 101 -2,-1.6 4,-1.0 -3,-0.1 3,-0.4 0.129 126.8 -10.3-123.3-117.3 -19.1 -19.3 -3.3 943 474 B R H >5S+ 0 0 164 -4,-0.5 4,-2.6 1,-0.2 5,-0.2 0.758 133.8 64.1 -62.4 -20.7 -22.5 -17.8 -4.2 944 475 B L H <5S+ 0 0 40 -4,-1.1 4,-0.5 -5,-0.3 -3,-0.2 0.923 104.8 38.7 -72.7 -47.8 -21.2 -17.2 -7.8 945 476 B Y H 4