==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 25-SEP-01 1K1Q . COMPND 2 MOLECULE: DBH PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS; . AUTHOR L.F.SILVIAN,E.A.TOTH,P.PHAM,M.F.GOODMAN,T.ELLENBERGER . 674 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33223.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 487 72.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 102 15.1 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 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 . 55 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 83 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 202 30.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.3 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 3 1 2 0 4 1 2 2 0 0 1 3 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 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 0 PARALLEL BRIDGES PER LADDER . 5 3 1 2 7 2 1 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 1 0 2 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 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 91 0, 0.0 2,-0.6 0, 0.0 99,-0.0 0.000 360.0 360.0 360.0 128.5 41.1 16.5 28.8 2 2 A I - 0 0 7 2,-0.0 99,-2.2 106,-0.0 100,-0.4 -0.911 360.0-171.8-123.3 98.3 37.4 15.8 28.5 3 3 A V E -AB 100 136A 0 133,-2.3 133,-2.2 -2,-0.6 2,-0.5 -0.716 9.9-160.2 -91.7 140.0 36.3 17.2 25.2 4 4 A I E -AB 99 135A 0 95,-2.8 95,-3.0 -2,-0.3 2,-0.6 -0.994 5.5-158.1-120.5 126.6 32.6 17.4 24.2 5 5 A F E -AB 98 134A 0 129,-2.3 129,-1.4 -2,-0.5 2,-0.4 -0.924 7.5-163.7-107.0 120.3 31.8 17.7 20.5 6 6 A V E +A 97 0A 0 91,-2.2 91,-2.2 -2,-0.6 2,-0.3 -0.840 10.7 175.5-104.6 143.2 28.4 19.2 19.7 7 7 A D E -A 96 0A 10 125,-0.5 125,-2.8 -2,-0.4 89,-0.2 -0.859 26.2-131.7-153.4 112.0 26.9 18.8 16.3 8 8 A F B > -E 131 0B 1 87,-1.4 3,-0.7 -2,-0.3 2,-0.6 -0.374 33.8-108.8 -65.1 137.0 23.4 19.9 15.2 9 9 A D T 3 S- 0 0 4 121,-1.7 5,-0.4 1,-0.3 121,-0.2 -0.573 81.6 -36.1 -77.0 116.1 21.5 17.3 13.3 10 10 A Y T 3> S- 0 0 94 -2,-0.6 4,-3.9 3,-0.1 -1,-0.3 0.912 85.4-165.5 31.2 64.0 21.0 18.0 9.6 11 11 A F H <> S+ 0 0 2 -3,-0.7 4,-3.3 2,-0.2 5,-0.3 0.903 73.1 45.1 -43.9 -71.1 20.8 21.6 10.8 12 12 A F H > S+ 0 0 65 1,-0.2 4,-2.3 2,-0.2 3,-0.2 0.941 120.2 44.9 -44.5 -54.5 19.3 23.6 7.9 13 13 A A H > S+ 0 0 3 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.924 114.2 47.2 -56.9 -50.2 16.8 20.8 7.4 14 14 A Q H X S+ 0 0 13 -4,-3.9 4,-1.2 -5,-0.4 -1,-0.2 0.822 109.1 55.7 -64.5 -28.5 16.0 20.5 11.1 15 15 A V H >X S+ 0 0 0 -4,-3.3 4,-1.3 -5,-0.2 3,-0.6 0.971 108.9 46.5 -66.4 -51.6 15.6 24.3 11.5 16 16 A E H >X S+ 0 0 3 -4,-2.3 4,-3.9 -5,-0.3 3,-1.7 0.971 108.0 55.1 -51.2 -60.5 13.0 24.4 8.7 17 17 A E H 3< S+ 0 0 11 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.804 106.2 56.1 -43.2 -32.8 11.1 21.5 10.2 18 18 A V H << S+ 0 0 38 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.854 116.3 32.0 -71.2 -36.4 11.0 23.6 13.4 19 19 A L H << S+ 0 0 69 -3,-1.7 -2,-0.2 -4,-1.3 -1,-0.2 0.812 129.0 41.5 -86.7 -37.7 9.3 26.6 11.8 20 20 A N S < S- 0 0 33 -4,-3.9 -1,-0.3 -5,-0.2 -2,-0.1 -0.658 70.1-177.9-110.0 70.1 7.4 24.5 9.3 21 21 A P + 0 0 74 0, 0.0 3,-0.4 0, 0.0 2,-0.2 0.815 65.0 94.6 -38.4 -32.0 6.3 21.6 11.7 22 22 A Q S S+ 0 0 137 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.1 -0.470 75.7 47.7 -62.7 131.1 4.9 20.3 8.4 23 23 A Y + 0 0 13 -2,-0.2 -1,-0.3 5,-0.0 5,-0.1 0.602 66.2 145.7 100.7 24.2 7.6 18.0 7.2 24 24 A K S S- 0 0 159 -3,-0.4 -2,-0.1 1,-0.1 -6,-0.0 0.217 95.6 -0.4 -79.1 24.8 7.9 16.5 10.6 25 25 A G S S+ 0 0 33 1,-0.1 3,-0.2 0, 0.0 -1,-0.1 0.098 103.1 119.7-170.1 -47.2 8.6 13.4 8.5 26 26 A K S S- 0 0 43 1,-0.2 14,-0.1 13,-0.1 -1,-0.1 -0.129 76.7-104.7 -46.6 111.5 8.4 14.5 4.9 27 27 A P - 0 0 39 0, 0.0 35,-1.0 0, 0.0 2,-0.6 -0.089 45.6-162.4 -41.4 99.5 11.8 14.0 3.1 28 28 A L B -f 62 0C 2 33,-0.2 9,-1.9 -3,-0.2 2,-0.4 -0.813 14.8-160.6-103.6 111.2 13.2 17.5 2.9 29 29 A V - 0 0 5 33,-2.4 2,-0.8 -2,-0.6 35,-0.5 -0.717 13.8-145.9 -85.2 135.7 16.0 18.6 0.6 30 30 A V - 0 0 26 -2,-0.4 2,-0.3 33,-0.1 36,-0.1 -0.919 27.3-161.5-101.9 107.1 17.6 21.9 1.7 31 31 A S - 0 0 0 33,-1.9 2,-0.4 -2,-0.8 32,-0.0 -0.668 21.3-172.2 -99.5 149.6 18.5 23.6 -1.5 32 32 A V + 0 0 93 -2,-0.3 19,-0.1 1,-0.1 -2,-0.0 -0.916 19.4 154.0-140.7 107.8 20.9 26.4 -2.5 33 33 A Y 0 0 146 -2,-0.4 -1,-0.1 18,-0.0 18,-0.0 0.712 360.0 360.0 -94.3-107.4 20.9 27.8 -6.0 34 34 A S 0 0 167 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.604 360.0 360.0 143.5 360.0 22.0 31.3 -7.1 35 ! 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 36 46 A A 0 0 47 0, 0.0 -7,-0.2 0, 0.0 -26,-0.1 0.000 360.0 360.0 360.0 122.3 18.8 17.9 3.2 37 47 A N >> - 0 0 1 -9,-1.9 4,-1.8 -27,-0.1 3,-0.5 0.013 360.0 -93.0 -65.1 175.2 17.4 15.9 6.1 38 48 A Y H 3> S+ 0 0 49 2,-0.2 4,-4.4 1,-0.2 5,-0.3 0.876 113.4 64.5 -60.3 -50.4 17.5 12.1 6.3 39 49 A E H 34 S+ 0 0 53 1,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.813 119.4 30.1 -47.8 -34.3 14.1 11.0 4.9 40 50 A A H <4>S+ 0 0 0 -3,-0.5 5,-1.0 -12,-0.2 3,-0.4 0.761 118.1 57.5 -93.2 -30.7 15.2 12.4 1.6 41 51 A R H <5S+ 0 0 36 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.2 0.837 97.7 63.4 -65.8 -34.2 18.9 11.7 2.3 42 52 A K T <5S+ 0 0 139 -4,-4.4 2,-2.3 1,-0.3 -1,-0.2 0.857 89.5 68.3 -57.1 -40.5 18.0 8.0 2.7 43 53 A L T 5S- 0 0 79 -4,-0.4 -1,-0.3 -3,-0.4 -4,-0.0 -0.367 136.2 -82.0 -79.2 57.8 16.9 7.9 -0.9 44 54 A G T 5S+ 0 0 64 -2,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.499 83.5 156.0 56.1 7.5 20.5 8.3 -2.0 45 55 A V < + 0 0 15 -5,-1.0 -1,-0.2 -7,-0.2 2,-0.2 -0.369 14.3 170.7 -69.9 142.8 20.3 12.1 -1.5 46 56 A K - 0 0 60 3,-0.2 2,-0.4 -2,-0.1 -1,-0.1 -0.534 35.7-106.8-131.9-163.7 23.6 14.0 -0.8 47 57 A A S S+ 0 0 104 -2,-0.2 -2,-0.0 1,-0.1 4,-0.0 -0.915 99.1 31.4-138.3 104.7 25.2 17.4 -0.4 48 58 A G S S+ 0 0 88 1,-0.5 -1,-0.1 -2,-0.4 3,-0.0 0.335 92.7 99.0 128.6 -3.6 27.5 18.4 -3.3 49 59 A M S S- 0 0 69 1,-0.1 -1,-0.5 2,-0.0 -3,-0.2 -0.954 88.4 -76.8-116.2 133.9 25.8 16.7 -6.2 50 60 A P > - 0 0 78 0, 0.0 4,-1.0 0, 0.0 3,-0.2 0.196 30.9-128.7 -29.9 133.5 23.4 18.7 -8.5 51 61 A I H > S+ 0 0 55 1,-0.2 4,-1.4 2,-0.2 5,-0.2 0.850 101.4 74.0 -55.6 -37.8 19.9 19.5 -7.2 52 62 A I H 4 S+ 0 0 133 1,-0.2 -1,-0.2 2,-0.2 5,-0.2 0.913 99.0 40.1 -36.8 -73.9 18.5 18.1 -10.5 53 63 A K H >> S+ 0 0 45 -3,-0.2 4,-6.0 3,-0.2 3,-3.1 0.927 111.7 54.1 -44.9 -69.7 19.1 14.4 -9.6 54 64 A A H 3< S+ 0 0 5 -4,-1.0 4,-0.3 1,-0.3 -1,-0.2 0.877 115.3 36.7 -34.3 -76.7 18.1 14.5 -6.0 55 65 A M T 3< S+ 0 0 35 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.331 122.9 48.5 -65.9 11.0 14.6 15.9 -6.4 56 66 A Q T <4 S+ 0 0 58 -3,-3.1 -2,-0.3 -5,-0.2 -1,-0.2 0.652 107.1 52.8-105.5 -56.9 14.5 13.9 -9.5 57 67 A I S < S+ 0 0 69 -4,-6.0 -2,-0.2 1,-0.3 -3,-0.2 0.370 138.8 6.7 -58.9 7.0 15.7 10.8 -7.6 58 68 A A S > S+ 0 0 8 -5,-0.3 3,-4.7 -4,-0.3 -1,-0.3 0.072 71.7 173.1 174.3 53.3 12.8 11.7 -5.3 59 69 A P T 3 S+ 0 0 97 0, 0.0 -4,-0.1 0, 0.0 -2,-0.1 0.598 79.1 73.1 -48.3 -15.7 10.7 14.5 -6.9 60 70 A S T 3 S+ 0 0 106 -4,-0.2 2,-0.3 2,-0.1 -5,-0.1 0.690 79.7 99.3 -72.6 -18.3 8.3 13.9 -4.0 61 71 A A S < S- 0 0 5 -3,-4.7 -33,-0.2 -7,-0.2 -3,-0.1 -0.556 79.0-127.7 -74.8 126.8 11.0 15.5 -2.0 62 72 A I B -f 28 0C 71 -35,-1.0 -33,-2.4 -2,-0.3 -2,-0.1 -0.377 10.3-151.2 -68.2 151.4 10.4 19.2 -1.2 63 73 A Y - 0 0 26 -35,-0.2 -33,-0.1 -4,-0.1 -1,-0.1 -0.377 22.0-166.4-122.7 52.7 13.3 21.6 -2.1 64 74 A V - 0 0 30 -35,-0.5 -33,-1.9 -34,-0.1 -48,-0.0 0.050 27.4 -90.1 -43.5 146.6 12.7 24.3 0.4 65 75 A P - 0 0 85 0, 0.0 2,-0.5 0, 0.0 -34,-0.3 0.317 36.8-105.7 -46.0-179.5 14.6 27.6 0.0 66 76 A M + 0 0 58 -36,-0.1 2,-1.1 1,-0.0 -34,-0.0 -0.756 39.3 172.5-120.0 82.0 18.1 28.5 1.4 67 77 A R >> + 0 0 111 -2,-0.5 3,-1.8 1,-0.2 4,-1.1 -0.390 8.9 160.2 -94.1 63.7 17.6 30.8 4.4 68 78 A K H 3> + 0 0 105 -2,-1.1 4,-1.5 1,-0.3 -1,-0.2 0.665 67.6 66.9 -57.2 -22.0 21.2 31.0 5.8 69 79 A P H 3> S+ 0 0 95 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.905 106.7 42.6 -69.8 -27.5 20.6 34.2 7.7 70 80 A I H <> S+ 0 0 58 -3,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.756 109.7 54.1 -81.0 -30.6 18.2 32.2 10.0 71 81 A Y H X S+ 0 0 10 -4,-1.1 4,-1.5 2,-0.2 -1,-0.2 0.832 111.2 51.3 -70.8 -29.5 20.3 29.2 10.3 72 82 A E H X S+ 0 0 71 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.887 109.2 45.1 -73.0 -45.1 22.9 31.7 11.5 73 83 A A H X S+ 0 0 45 -4,-1.5 4,-0.9 1,-0.2 -1,-0.2 0.782 115.5 50.4 -71.6 -24.8 20.8 33.4 14.1 74 84 A F H X S+ 0 0 23 -4,-1.4 4,-1.3 2,-0.2 -2,-0.2 0.815 113.1 45.3 -79.6 -34.0 19.8 29.9 15.2 75 85 A S H X S+ 0 0 3 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.741 109.0 55.5 -81.2 -24.9 23.4 28.8 15.4 76 86 A N H X S+ 0 0 103 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.815 108.9 49.5 -74.7 -31.4 24.5 32.0 17.2 77 87 A R H X S+ 0 0 103 -4,-0.9 4,-0.9 2,-0.2 -2,-0.2 0.880 111.6 45.6 -75.4 -40.5 22.0 31.4 19.9 78 88 A I H X S+ 0 0 0 -4,-1.3 4,-0.9 1,-0.2 3,-0.3 0.910 110.1 55.7 -69.4 -40.6 23.0 27.7 20.5 79 89 A M H X S+ 0 0 13 -4,-1.8 4,-1.5 1,-0.3 -1,-0.2 0.853 107.7 47.9 -60.8 -36.5 26.7 28.6 20.5 80 90 A N H X S+ 0 0 116 -4,-1.2 4,-1.0 1,-0.2 -1,-0.3 0.763 107.7 56.5 -74.2 -23.7 26.2 31.1 23.3 81 91 A L H < S+ 0 0 29 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.695 110.3 46.3 -77.9 -20.8 24.2 28.5 25.1 82 92 A L H >< S+ 0 0 0 -4,-0.9 3,-0.8 -3,-0.2 -2,-0.2 0.717 99.4 66.8 -92.9 -24.8 27.3 26.3 24.8 83 93 A N H >< S+ 0 0 50 -4,-1.5 3,-1.6 1,-0.2 -2,-0.2 0.916 93.4 59.4 -63.8 -39.7 29.8 28.9 25.9 84 94 A K T 3< S+ 0 0 70 -4,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.767 104.3 54.8 -58.2 -24.3 28.4 29.0 29.4 85 95 A H T < S+ 0 0 33 -3,-0.8 2,-0.4 -4,-0.2 -1,-0.3 0.067 97.8 69.5-100.5 23.6 29.2 25.3 29.7 86 96 A A < - 0 0 13 -3,-1.6 15,-0.2 1,-0.1 3,-0.2 -0.993 66.6-141.5-146.2 138.1 32.9 25.2 28.8 87 97 A D S S- 0 0 64 13,-1.0 2,-0.3 -2,-0.4 14,-0.2 0.882 104.9 -5.6 -58.4 -30.0 36.1 26.2 30.4 88 98 A K E -C 100 0A 56 12,-1.5 12,-2.8 -3,-0.1 2,-0.4 -0.960 69.3-154.2-165.0 148.8 36.6 27.0 26.7 89 99 A I E -C 99 0A 1 -2,-0.3 142,-0.8 10,-0.2 2,-0.6 -0.959 5.5-161.3-130.8 140.7 34.9 26.5 23.4 90 100 A E E -C 98 0A 3 8,-3.1 8,-1.2 -2,-0.4 2,-0.3 -0.849 16.7-149.4-122.7 95.9 36.1 26.3 19.8 91 101 A V E -C 97 0A 15 -2,-0.6 142,-2.1 140,-0.4 6,-0.2 -0.480 18.0-178.2 -64.2 119.9 33.3 27.0 17.4 92 102 A A - 0 0 19 4,-2.3 141,-0.5 -2,-0.3 5,-0.2 0.789 56.3 -19.9 -83.1 -98.4 34.2 24.9 14.3 93 103 A S S > S- 0 0 39 3,-0.1 3,-0.6 139,-0.1 -1,-0.1 0.000 90.0 -70.4 -94.1-157.9 31.6 25.5 11.6 94 104 A I T 3 S+ 0 0 29 1,-0.2 -15,-0.1 -3,-0.1 3,-0.1 0.556 133.0 20.8 -74.9 -9.4 28.1 26.9 11.8 95 105 A D T 3 S+ 0 0 30 1,-0.1 -87,-1.4 -89,-0.0 2,-0.4 0.085 109.7 77.5-149.8 33.1 26.8 23.8 13.5 96 106 A E E < +A 7 0A 48 -3,-0.6 -4,-2.3 -89,-0.2 2,-0.3 -0.986 49.4 169.5-144.7 130.0 29.8 22.1 15.1 97 107 A A E -AC 6 91A 0 -91,-2.2 -91,-2.2 -2,-0.4 2,-0.4 -0.959 22.9-145.6-139.7 158.8 31.6 23.0 18.3 98 108 A Y E -AC 5 90A 30 -8,-1.2 -8,-3.1 -2,-0.3 2,-0.4 -0.993 15.5-167.8-124.6 131.1 34.2 21.6 20.6 99 109 A L E -AC 4 89A 0 -95,-3.0 -95,-2.8 -2,-0.4 2,-0.6 -0.951 12.3-155.3-119.5 140.5 34.1 22.2 24.3 100 110 A D E +AC 3 88A 15 -12,-2.8 -12,-1.5 -2,-0.4 -13,-1.0 -0.986 25.5 161.6-113.3 113.5 36.9 21.5 26.7 101 111 A V > + 0 0 0 -99,-2.2 4,-1.1 -2,-0.6 6,-0.2 0.189 26.8 126.3-117.9 10.9 35.1 21.0 30.0 102 112 A T T 4>S+ 0 0 21 -100,-0.4 5,-3.9 1,-0.2 6,-0.4 0.813 83.9 33.9 -37.4 -46.9 37.9 19.2 31.8 103 113 A N T >45S+ 0 0 101 3,-0.3 3,-2.7 2,-0.2 -1,-0.2 0.847 101.7 68.9 -86.1 -35.7 37.8 21.7 34.7 104 114 A K T 345S+ 0 0 120 1,-0.3 -1,-0.2 -4,-0.1 -2,-0.2 0.741 122.7 27.7 -53.8 -14.0 34.1 22.6 34.8 105 115 A V T ><5S- 0 0 14 -4,-1.1 3,-3.8 -3,-0.1 -1,-0.3 -0.045 108.9-123.7-137.6 32.8 34.3 18.9 36.0 106 116 A E T < 5S- 0 0 188 -3,-2.7 -3,-0.3 1,-0.3 -4,-0.1 0.672 73.6 -55.5 24.1 43.3 37.9 18.7 37.5 107 117 A G T 3 > S+ 0 0 23 -2,-0.9 3,-1.6 1,-0.2 4,-1.6 0.875 86.1 55.0 -57.1 -44.3 34.9 11.7 33.0 110 120 A E H 3> S+ 0 0 98 1,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.878 105.6 55.5 -58.9 -34.4 31.6 10.4 34.3 111 121 A N H <> S+ 0 0 88 -3,-0.5 4,-1.1 1,-0.2 -1,-0.3 0.593 103.8 54.7 -73.5 -11.3 30.7 14.0 35.2 112 122 A G H <> S+ 0 0 0 -3,-1.6 4,-2.9 -4,-0.5 -1,-0.2 0.839 104.1 52.9 -86.6 -38.5 31.3 15.1 31.7 113 123 A I H X S+ 0 0 8 -4,-1.6 4,-1.3 1,-0.2 -2,-0.2 0.797 110.7 48.7 -65.0 -30.1 28.9 12.6 30.3 114 124 A E H X S+ 0 0 98 -4,-1.2 4,-1.7 2,-0.2 -1,-0.2 0.905 109.5 50.7 -76.8 -41.4 26.3 13.9 32.6 115 125 A L H >X S+ 0 0 25 -4,-1.1 4,-3.0 1,-0.2 3,-0.6 0.947 110.0 51.2 -57.5 -48.8 27.0 17.5 31.6 116 126 A A H 3X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.3 -1,-0.2 0.855 106.3 54.0 -56.7 -38.8 26.7 16.4 27.9 117 127 A R H 3X S+ 0 0 126 -4,-1.3 4,-1.5 2,-0.2 -1,-0.3 0.829 112.5 45.6 -66.1 -31.4 23.3 14.8 28.8 118 128 A K H X S+ 0 0 104 -4,-1.5 3,-3.6 1,-0.2 4,-0.8 0.981 111.6 50.4 -53.6 -79.0 18.6 18.6 27.1 122 132 A E H 3X S+ 0 0 39 -4,-1.9 4,-1.5 1,-0.3 3,-0.3 0.711 103.5 56.0 -27.9 -55.5 18.9 22.4 27.4 123 133 A I H 3X S+ 0 0 2 -4,-1.8 4,-2.1 1,-0.2 6,-1.2 0.788 108.0 55.2 -56.8 -23.8 19.4 23.2 23.7 124 134 A L H S- 0 0 5 -135,-0.1 4,-1.2 -136,-0.1 -135,-0.2 -0.647 87.1 -95.8-126.5-171.9 40.7 14.4 22.7 139 149 A K H > S+ 0 0 23 87,-0.5 4,-2.3 -2,-0.2 5,-0.2 0.888 115.9 56.5 -75.2 -39.6 38.8 16.2 19.9 140 150 A I H > S+ 0 0 23 84,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.847 111.3 43.2 -61.1 -36.7 39.3 13.5 17.2 141 151 A L H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.854 110.2 57.0 -77.9 -36.5 37.7 10.8 19.2 142 152 A A H X S+ 0 0 0 -4,-1.2 4,-0.9 2,-0.2 -2,-0.2 0.902 114.0 39.5 -61.4 -40.2 35.0 13.1 20.4 143 153 A K H >X S+ 0 0 38 -4,-2.3 4,-2.3 2,-0.2 3,-0.9 0.973 112.9 52.5 -73.3 -53.6 34.0 13.7 16.8 144 154 A I H 3X S+ 0 0 4 -4,-2.3 4,-1.3 1,-0.3 -2,-0.2 0.799 113.6 46.1 -50.6 -34.4 34.5 10.1 15.4 145 155 A I H 3< S+ 0 0 22 -4,-2.0 -1,-0.3 2,-0.2 9,-0.2 0.733 106.5 58.2 -83.5 -22.1 32.3 8.8 18.2 146 156 A A H X< S+ 0 0 1 -3,-0.9 3,-1.5 -4,-0.9 7,-0.2 0.946 107.4 47.9 -70.4 -45.4 29.6 11.5 17.6 147 157 A D H >< S+ 0 0 55 -4,-2.3 3,-2.1 1,-0.3 -2,-0.2 0.886 96.4 68.7 -62.3 -40.9 29.2 10.4 14.0 148 158 A K T 3< S+ 0 0 109 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.621 121.8 20.9 -57.3 -7.9 28.9 6.7 14.9 149 159 A S T <> S+ 0 0 46 -3,-1.5 4,-1.1 -4,-0.2 -1,-0.3 -0.126 78.6 147.0-151.1 48.2 25.6 7.8 16.4 150 160 A K T <4 + 0 0 95 -3,-2.1 2,-3.0 1,-0.2 -2,-0.1 0.732 47.4 94.3 -59.4 -24.3 24.8 11.1 14.7 151 161 A P T 4 S- 0 0 113 0, 0.0 -1,-0.2 0, 0.0 -20,-0.1 -0.300 127.4 -54.2 -73.8 72.2 21.1 10.6 14.8 152 162 A N T 4 S+ 0 0 79 -2,-3.0 -2,-0.2 -22,-0.1 -21,-0.1 0.793 103.8 151.5 68.4 28.6 20.5 12.5 18.0 153 163 A G < - 0 0 10 -4,-1.1 -20,-0.8 -7,-0.2 -22,-0.1 0.346 46.3-147.6 -75.0-157.2 23.1 10.3 19.7 154 164 A L E -d 133 0A 28 -9,-0.2 -20,-0.2 -22,-0.2 -8,-0.1 -0.228 19.9-167.5-178.3 71.6 25.6 10.7 22.5 155 165 A G E -d 134 0A 12 -22,-1.5 -20,-2.1 -10,-0.1 2,-0.3 -0.225 0.3-165.0 -67.7 159.4 28.8 8.7 22.0 156 166 A V E -d 135 0A 31 -22,-0.2 2,-0.7 -11,-0.1 -20,-0.2 -0.873 12.9-176.8-151.3 112.7 31.2 8.2 24.8 157 167 A I - 0 0 1 -22,-2.4 5,-0.1 -2,-0.3 -16,-0.0 -0.923 22.9-150.8-110.4 107.1 34.8 7.0 24.5 158 168 A R > - 0 0 85 -2,-0.7 3,-2.4 -22,-0.1 4,-0.1 -0.423 26.5-107.7 -76.4 152.4 36.2 6.7 28.0 159 169 A P G > S+ 0 0 78 0, 0.0 3,-1.0 0, 0.0 4,-0.3 0.872 118.9 46.9 -41.5 -49.9 40.0 7.2 28.7 160 170 A T G 3 S+ 0 0 140 1,-0.2 4,-0.1 2,-0.1 -2,-0.0 0.400 106.9 55.6 -78.7 0.2 40.5 3.4 29.3 161 171 A E G <> S+ 0 0 69 -3,-2.4 4,-1.7 2,-0.1 -1,-0.2 0.089 83.8 93.8-118.1 22.0 38.6 2.2 26.2 162 172 A V H <> S+ 0 0 5 -3,-1.0 4,-3.4 2,-0.2 5,-0.3 0.974 80.0 46.5 -77.2 -63.5 40.6 4.2 23.8 163 173 A Q H > S+ 0 0 100 -4,-0.3 4,-1.3 2,-0.2 -1,-0.1 0.803 116.2 51.2 -53.6 -28.7 43.4 1.9 22.6 164 174 A D H >> S+ 0 0 62 2,-0.2 4,-1.5 1,-0.2 3,-1.4 0.993 110.7 45.1 -68.3 -66.1 40.6 -0.7 22.1 165 175 A F H 3< S+ 0 0 36 -4,-1.7 -2,-0.2 1,-0.3 -3,-0.2 0.843 109.9 57.0 -42.0 -46.4 38.3 1.6 20.1 166 176 A L H >< S+ 0 0 5 -4,-3.4 3,-1.4 1,-0.2 28,-0.4 0.891 103.2 55.0 -57.1 -39.9 41.3 2.7 18.0 167 177 A N H << S+ 0 0 88 -3,-1.4 27,-0.5 -4,-1.3 -2,-0.2 0.963 110.2 42.9 -59.3 -53.6 42.0 -0.9 17.1 168 178 A E T 3< S+ 0 0 135 -4,-1.5 2,-0.6 24,-0.1 -1,-0.3 0.138 90.7 119.6 -82.6 24.7 38.6 -1.6 15.7 169 179 A L < - 0 0 1 -3,-1.4 24,-4.1 -5,-0.2 25,-0.4 -0.813 54.2-144.1 -96.2 122.3 38.6 1.7 13.9 170 180 A D B -G 192 0D 45 -2,-0.6 22,-0.3 22,-0.3 3,-0.2 -0.074 17.9-122.8 -72.8 174.3 38.2 1.7 10.1 171 181 A I S > S+ 0 0 1 20,-1.8 3,-1.5 1,-0.2 6,-0.1 0.830 109.6 60.9 -85.0 -36.3 39.9 4.0 7.6 172 182 A D T 3 S+ 0 0 110 19,-0.4 -1,-0.2 1,-0.3 20,-0.1 0.443 99.1 58.6 -72.5 2.0 36.5 5.1 6.1 173 183 A E T 3 S+ 0 0 55 -3,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.159 82.6 105.9-114.3 16.8 35.5 6.5 9.5 174 184 A I X - 0 0 9 -3,-1.5 3,-1.3 4,-0.1 8,-0.1 -0.880 67.7-123.8-110.4 125.3 38.3 9.0 9.9 175 185 A P T 3 S+ 0 0 34 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.228 92.1 23.5 -57.4 136.9 37.9 12.8 9.6 176 186 A G T 3 S+ 0 0 60 1,-0.3 2,-0.4 0, 0.0 36,-0.0 0.115 93.1 110.4 93.8 -24.1 40.1 14.6 7.1 177 187 A I S < S- 0 0 20 -3,-1.3 -1,-0.3 -6,-0.1 2,-0.1 -0.699 70.4-125.4 -83.2 136.4 40.7 11.6 5.0 178 188 A G > - 0 0 28 -2,-0.4 4,-2.6 1,-0.1 5,-0.1 -0.442 8.5-127.0 -80.5 159.2 39.0 11.8 1.7 179 189 A S H > S+ 0 0 85 2,-0.2 4,-2.0 1,-0.2 -1,-0.1 0.832 116.3 50.8 -71.1 -29.8 36.6 9.2 0.4 180 190 A V H > S+ 0 0 102 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.889 113.8 43.0 -72.1 -39.1 38.7 9.1 -2.7 181 191 A L H > S+ 0 0 31 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.829 111.4 55.2 -74.8 -32.3 41.8 8.7 -0.6 182 192 A A H X S+ 0 0 7 -4,-2.6 4,-1.8 1,-0.2 5,-0.2 0.925 104.5 53.8 -65.3 -44.0 40.1 6.2 1.6 183 193 A R H < S+ 0 0 137 -4,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.798 108.5 50.6 -58.9 -30.8 39.2 4.1 -1.4 184 194 A R H >X S+ 0 0 104 -4,-0.9 4,-1.6 1,-0.2 3,-0.5 0.889 109.2 49.9 -74.7 -40.4 42.9 4.1 -2.4 185 195 A L H 3<>S+ 0 0 2 -4,-1.9 5,-3.2 1,-0.2 -2,-0.2 0.762 108.4 52.8 -69.3 -27.5 44.0 3.0 1.1 186 196 A N T 3<5S+ 0 0 52 -4,-1.8 -1,-0.2 3,-0.2 3,-0.2 0.618 106.5 54.3 -83.2 -13.1 41.5 0.1 1.1 187 197 A E T <45S+ 0 0 124 -3,-0.5 -2,-0.2 -4,-0.4 -1,-0.2 0.860 104.9 51.8 -85.1 -36.5 42.8 -1.0 -2.2 188 198 A L T <5S- 0 0 88 -4,-1.6 -1,-0.2 2,-0.1 -2,-0.2 0.307 128.6 -99.5 -79.9 8.0 46.4 -1.2 -0.9 189 199 A G T 5S+ 0 0 45 -3,-0.2 2,-0.9 1,-0.2 -3,-0.2 0.677 79.4 136.1 85.1 17.6 45.0 -3.3 2.0 190 200 A I < + 0 0 16 -5,-3.2 -1,-0.2 1,-0.2 -2,-0.1 -0.835 12.8 148.7-101.7 98.8 44.6 -0.7 4.7 191 201 A Q + 0 0 91 -2,-0.9 -20,-1.8 1,-0.1 -19,-0.4 0.849 59.1 42.5 -95.3 -45.2 41.2 -1.4 6.3 192 202 A K B >> S-G 170 0D 62 -22,-0.3 4,-0.5 -21,-0.1 3,-0.5 -0.748 83.9-116.6-106.2 152.9 41.7 -0.5 9.9 193 203 A L G >4 S+ 0 0 1 -24,-4.1 3,-2.1 -2,-0.3 4,-0.4 0.922 116.9 61.9 -50.5 -42.2 43.5 2.5 11.3 194 204 A R G >4 S+ 0 0 34 -27,-0.5 3,-2.6 -28,-0.4 4,-0.4 0.901 88.8 65.2 -50.6 -49.7 45.8 -0.1 12.9 195 205 A D G X> S+ 0 0 60 -3,-0.5 3,-1.2 1,-0.3 4,-1.0 0.681 84.4 79.0 -51.3 -15.3 46.9 -1.4 9.5 196 206 A I G X< S+ 0 0 1 -3,-2.1 3,-0.5 -4,-0.5 -1,-0.3 0.915 86.9 57.6 -58.6 -41.9 48.5 2.0 9.0 197 207 A L G <4 S+ 0 0 92 -3,-2.6 -1,-0.3 -4,-0.4 -2,-0.2 0.661 94.6 64.9 -65.7 -17.5 51.3 0.9 11.3 198 208 A S G <4 S+ 0 0 93 -3,-1.2 -1,-0.2 -4,-0.4 -2,-0.2 0.922 93.9 68.2 -71.8 -42.8 52.1 -2.1 9.0 199 209 A K S << S- 0 0 37 -4,-1.0 2,-0.5 -3,-0.5 3,-0.0 -0.255 88.3-122.4 -69.6 164.8 53.2 0.2 6.2 200 210 A N >> - 0 0 108 1,-0.1 3,-2.7 0, 0.0 4,-0.7 -0.961 33.5-100.9-114.0 130.3 56.3 2.3 6.6 201 211 A Y H 3> S+ 0 0 60 -2,-0.5 4,-3.7 1,-0.3 3,-0.4 0.515 116.1 51.1 -17.6 -54.4 55.9 6.1 6.2 202 212 A N H 3> S+ 0 0 107 1,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.872 107.3 54.7 -64.2 -32.5 57.2 6.8 2.7 203 213 A E H <4 S+ 0 0 44 -3,-2.7 4,-0.5 1,-0.2 -1,-0.3 0.820 117.5 40.0 -65.6 -29.1 54.9 4.1 1.4 204 214 A L H >X S+ 0 0 4 -4,-0.7 4,-2.1 -3,-0.4 3,-0.6 0.894 111.3 51.5 -86.6 -48.1 52.2 6.1 3.2 205 215 A E H 3< S+ 0 0 79 -4,-3.7 -3,-0.2 1,-0.2 -2,-0.2 0.861 103.4 61.6 -57.9 -38.4 53.2 9.8 2.5 206 216 A K T 3< S+ 0 0 160 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.895 118.0 29.0 -54.3 -41.5 53.4 8.9 -1.2 207 217 A I T <4 S+ 0 0 47 -3,-0.6 -2,-0.2 -4,-0.5 -3,-0.1 0.966 122.1 41.3 -83.6 -73.0 49.6 8.1 -1.1 208 218 A T S < S- 0 0 5 -4,-2.1 -31,-0.0 2,-0.1 3,-0.0 0.107 107.2 -88.5 -61.7-172.8 48.0 10.2 1.7 209 219 A G - 0 0 45 1,-0.1 -1,-0.0 0, 0.0 0, 0.0 0.907 43.5-115.8 -63.4 -90.9 49.1 13.8 1.8 210 220 A K S > S+ 0 0 33 -3,-0.0 4,-2.4 -4,-0.0 5,-0.2 -0.196 116.9 57.0-177.3 -44.0 52.2 13.7 4.1 211 221 A A H > S+ 0 0 79 1,-0.2 4,-1.4 2,-0.2 -6,-0.0 0.823 108.1 48.0 -69.6 -31.6 50.4 15.9 6.7 212 222 A K H > S+ 0 0 65 2,-0.2 4,-3.7 3,-0.2 5,-0.3 0.797 107.1 57.8 -78.6 -27.5 47.7 13.2 6.7 213 223 A A H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.972 109.2 42.4 -64.2 -51.2 50.4 10.6 7.1 214 224 A L H X S+ 0 0 108 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.874 116.9 52.2 -60.2 -36.5 51.7 12.2 10.3 215 225 A Y H X S+ 0 0 28 -4,-1.4 4,-3.4 -5,-0.2 5,-0.2 0.979 111.4 42.6 -61.5 -62.0 48.1 12.6 11.3 216 226 A L H X S+ 0 0 0 -4,-3.7 4,-3.8 1,-0.2 -2,-0.2 0.909 115.9 49.5 -53.6 -48.4 47.0 9.0 10.8 217 227 A L H X S+ 0 0 41 -4,-2.8 4,-1.8 -5,-0.3 -1,-0.2 0.954 113.6 45.3 -58.7 -49.7 50.2 7.7 12.4 218 228 A K H X>S+ 0 0 20 -4,-2.4 5,-2.4 -5,-0.3 4,-0.5 0.958 115.3 47.3 -56.6 -54.0 49.7 9.9 15.4 219 229 A L H ><5S+ 0 0 1 -4,-3.4 3,-2.8 1,-0.2 -2,-0.2 0.956 106.0 60.9 -50.7 -53.9 46.0 9.1 15.6 220 230 A A H 3<5S+ 0 0 8 -4,-3.8 -1,-0.2 1,-0.3 -2,-0.2 0.860 113.7 34.1 -40.2 -50.2 47.0 5.4 15.3 221 231 A Q H 3<5S- 0 0 115 -4,-1.8 -1,-0.3 -3,-0.3 -2,-0.2 0.333 114.0-116.0 -92.2 6.7 49.0 5.5 18.5 222 232 A N T <<5S+ 0 0 60 -3,-2.8 -3,-0.2 -4,-0.5 -2,-0.1 0.956 79.7 124.8 57.8 50.5 46.7 8.0 20.1 223 233 A K < + 0 0 58 -5,-2.4 2,-1.0 -6,-0.1 -4,-0.2 0.808 38.3 101.4 -96.6 -53.5 49.4 10.7 20.3 224 234 A Y + 0 0 87 -9,-0.2 2,-0.6 1,-0.2 -84,-0.3 0.055 37.8 153.8 -34.3 72.6 47.3 13.3 18.5 225 235 A S + 0 0 60 -2,-1.0 -1,-0.2 -87,-0.1 -6,-0.0 -0.494 16.1 174.3-106.6 59.1 46.1 15.3 21.5 226 236 A E - 0 0 33 -2,-0.6 -87,-0.5 1,-0.1 -86,-0.1 -0.552 29.7-120.4 -70.6 121.9 45.5 18.6 19.7 227 237 A P - 0 0 87 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.115 17.0-107.9 -56.5 169.2 44.0 21.2 22.1 228 238 A V - 0 0 0 -89,-0.0 2,-0.7 2,-0.0 -128,-0.1 -0.916 34.6-145.6-100.6 126.6 40.7 23.0 21.9 229 239 A E - 0 0 41 -2,-0.5 2,-1.8 2,-0.1 -131,-0.1 -0.851 15.4-126.7-104.9 116.6 41.3 26.6 21.1 230 240 A N S S+ 0 0 42 -2,-0.7 103,-1.1 -140,-0.1 2,-0.3 -0.329 76.7 103.6 -54.0 85.5 39.0 29.3 22.6 231 241 A K E -H 332 0E 31 -2,-1.8 2,-0.5 -142,-0.8 -140,-0.4 -0.962 69.7-120.4-168.1 151.9 38.4 30.7 19.1 232 242 A S E -H 331 0E 22 99,-1.8 99,-1.7 -2,-0.3 98,-0.3 -0.859 9.3-161.7-101.7 132.4 35.8 30.8 16.2 233 243 A K + 0 0 92 -142,-2.1 -141,-0.1 -141,-0.5 -1,-0.1 0.385 60.8 109.8 -90.9 2.8 36.8 29.5 12.9 234 244 A I - 0 0 51 -143,-0.2 97,-0.3 -141,-0.1 -2,-0.1 -0.676 61.4-147.0 -81.3 127.2 34.0 31.3 11.2 235 245 A P - 0 0 62 0, 0.0 2,-0.3 0, 0.0 94,-0.2 -0.355 12.0-161.8 -88.8 173.1 35.3 34.2 9.1 236 246 A H E -I 328 0E 70 92,-1.9 92,-2.2 -2,-0.1 2,-0.3 -0.968 8.3-174.1-153.9 137.8 33.9 37.6 8.3 237 247 A G E -I 327 0E 17 -2,-0.3 2,-0.4 90,-0.3 90,-0.2 -0.997 11.3-165.4-141.8 146.3 34.9 40.0 5.6 238 248 A R E -I 326 0E 100 88,-1.2 88,-1.1 -2,-0.3 2,-0.4 -0.999 11.8-174.8-131.5 129.1 34.0 43.5 4.5 239 249 A Y E -I 325 0E 81 -2,-0.4 2,-0.3 86,-0.2 86,-0.3 -0.976 7.4-156.7-128.3 141.9 34.9 45.0 1.1 240 250 A L E -I 324 0E 32 84,-2.7 84,-1.2 -2,-0.4 2,-0.4 -0.833 19.1-123.1-115.5 150.9 34.4 48.5 -0.3 241 251 A T - 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0 0 89 -3,-2.6 3,-1.4 -6,-0.2 4,-1.3 -0.638 37.7-160.9 -79.6 96.0 28.2 14.0 97.8 452 119 B F H 3> S+ 0 0 16 -2,-1.1 4,-1.1 1,-0.3 -1,-0.2 0.739 89.9 52.6 -49.2 -31.4 28.3 12.9 94.1 453 120 B E H 3> S+ 0 0 91 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.833 108.0 50.6 -76.8 -29.5 24.9 11.3 94.2 454 121 B N H <> S+ 0 0 41 -3,-1.4 4,-1.6 1,-0.2 -2,-0.2 0.704 107.8 56.3 -75.4 -20.0 23.4 14.5 95.7 455 122 B G H X S+ 0 0 0 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.784 104.3 51.0 -79.3 -29.2 25.2 16.1 92.7 456 123 B I H < S+ 0 0 22 -4,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.815 110.7 48.2 -76.5 -32.1 23.4 13.9 90.3 457 124 B E H >X S+ 0 0 133 -4,-1.4 4,-1.5 2,-0.2 3,-1.3 0.894 108.8 55.3 -72.7 -41.4 20.0 14.8 91.8 458 125 B L H >X S+ 0 0 32 -4,-1.6 4,-2.4 1,-0.3 3,-1.0 0.962 103.9 51.5 -54.2 -55.8 20.9 18.5 91.7 459 126 B A H 3X S+ 0 0 0 -4,-1.9 4,-0.8 1,-0.3 -1,-0.3 0.604 105.8 61.2 -58.2 -8.8 21.6 18.3 88.0 460 127 B R H <> S+ 0 0 150 -3,-1.3 4,-1.5 2,-0.2 -1,-0.3 0.870 105.7 42.8 -84.1 -41.4 18.2 16.8 88.0 461 128 B K H S+ 0 0 1 -4,-1.9 4,-2.8 -5,-0.4 5,-0.7 0.960 112.5 47.0 -63.3 -50.5 15.1 25.4 83.4 467 134 B L H X5S+ 0 0 73 -4,-2.1 4,-2.1 4,-0.2 -2,-0.2 0.980 115.0 48.6 -50.6 -58.1 12.4 23.5 81.6 468 135 B E H <5S+ 0 0 138 -4,-3.7 -2,-0.2 1,-0.2 -1,-0.2 0.833 121.4 32.3 -51.3 -43.3 9.9 25.1 84.0 469 136 B K H <5S+ 0 0 130 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.902 134.5 20.7 -89.0 -42.7 11.1 28.6 83.7 470 137 B E H <5S- 0 0 30 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.392 95.8-125.1-106.7 4.1 12.4 29.1 80.1 471 138 B K << + 0 0 54 -4,-2.1 2,-0.4 -5,-0.7 -4,-0.2 0.925 67.8 130.7 53.2 48.6 10.5 26.2 78.6 472 139 B I - 0 0 0 -6,-0.6 2,-0.3 -9,-0.1 -1,-0.2 -0.995 50.5-147.0-137.7 134.5 13.7 24.7 77.3 473 140 B T + 0 0 30 -2,-0.4 -129,-1.4 -129,-0.2 2,-0.3 -0.745 23.9 175.2 -96.0 149.9 15.2 21.3 77.5 474 141 B V E -O 343 0F 0 -2,-0.3 2,-0.5 -131,-0.2 -131,-0.3 -0.861 28.9-116.9-142.4 171.7 19.0 21.0 77.7 475 142 B T E -O 342 0F 0 -133,-3.4 -133,-1.8 -2,-0.3 2,-0.2 -0.979 31.5-170.4-119.3 129.2 21.5 18.1 78.2 476 143 B V E -Or 341 497F 0 20,-1.9 22,-2.7 -2,-0.5 2,-0.4 -0.724 9.8-151.2-116.2 168.3 23.7 18.0 81.2 477 144 B G E -Or 340 498F 0 -137,-2.0 -137,-3.0 -2,-0.2 2,-0.6 -0.980 0.4-159.8-142.3 128.7 26.6 16.0 82.4 478 145 B V E +Or 339 499F 0 20,-2.9 22,-1.9 -2,-0.4 -139,-0.2 -0.926 32.7 133.8-112.9 119.4 27.8 15.0 85.8 479 146 B A E -O 338 0F 0 -141,-1.8 -141,-2.8 -2,-0.6 6,-0.1 -0.984 65.4 -98.1-156.9 158.8 31.4 13.9 86.3 480 147 B P S S+ 0 0 19 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.873 105.7 15.9 -45.3 -46.7 34.5 14.4 88.5 481 148 B N S > S- 0 0 7 -144,-0.1 4,-1.1 1,-0.1 -143,-0.1 -0.731 85.0 -98.9-127.1 176.4 35.9 16.9 86.1 482 149 B K H >> S+ 0 0 27 87,-0.6 4,-2.7 -2,-0.2 3,-1.9 0.981 111.1 51.0 -57.6 -72.1 35.0 19.1 83.1 483 150 B I H 3> S+ 0 0 20 84,-0.3 4,-2.9 1,-0.3 -1,-0.2 0.828 116.8 44.4 -37.6 -45.7 36.1 17.2 80.0 484 151 B L H 3> S+ 0 0 1 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.754 109.2 55.2 -74.0 -26.3 34.3 14.1 81.3 485 152 B A H X S+ 0 0 32 -4,-2.7 4,-2.2 2,-0.2 3,-0.6 0.959 110.2 53.2 -70.4 -54.4 31.2 17.4 78.6 487 154 B I H 3X S+ 0 0 3 -4,-2.9 4,-1.1 1,-0.3 5,-0.2 0.921 109.3 48.2 -48.9 -54.0 31.9 14.0 76.9 488 155 B I H 3X S+ 0 0 21 -4,-1.6 4,-1.7 1,-0.2 -1,-0.3 0.832 111.2 53.7 -59.1 -29.9 29.0 12.2 78.7 489 156 B A H - 0 0 89 -2,-0.3 3,-0.9 -22,-0.1 4,-0.5 -0.405 31.9-103.7 -80.4 160.1 30.8 8.4 89.0 502 169 B P T 3 S+ 0 0 80 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.222 122.5 50.3 -68.7 16.7 34.3 8.6 90.5 503 170 B T T 3 S+ 0 0 103 2,-0.1 4,-0.4 3,-0.0 3,-0.1 0.541 108.4 47.2-123.5 -29.6 34.3 4.8 90.5 504 171 B E S <> S+ 0 0 61 -3,-0.9 4,-3.2 1,-0.1 5,-0.1 0.312 91.3 89.3 -95.8 8.3 33.3 4.3 86.9 505 172 B V H > S+ 0 0 9 -4,-0.5 4,-2.2 2,-0.2 5,-0.3 0.980 86.8 45.0 -68.0 -57.2 35.8 6.9 85.7 506 173 B Q H > S+ 0 0 143 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.936 119.4 48.3 -46.7 -50.1 38.9 4.5 85.3 507 174 B D H >> S+ 0 0 72 -4,-0.4 4,-1.5 2,-0.2 3,-0.9 0.936 107.8 50.4 -56.1 -60.1 36.4 2.3 83.6 508 175 B F H 3X S+ 0 0 38 -4,-3.2 4,-0.6 1,-0.2 3,-0.3 0.950 106.4 54.6 -45.9 -64.4 34.8 4.9 81.3 509 176 B L H 3< S+ 0 0 8 -4,-2.2 3,-0.5 1,-0.2 27,-0.4 0.734 104.3 57.5 -45.3 -30.8 38.1 6.2 79.9 510 177 B N H << S+ 0 0 75 -4,-1.1 27,-0.9 -3,-0.9 26,-0.4 0.992 110.8 38.5 -66.8 -59.0 39.0 2.7 78.9 511 178 B E H < S+ 0 0 132 -4,-1.5 2,-0.7 -3,-0.3 -1,-0.2 0.320 88.4 123.7 -74.8 9.1 36.0 2.0 76.7 512 179 B L < - 0 0 2 -4,-0.6 24,-1.9 -3,-0.5 25,-0.1 -0.622 59.5-133.8 -79.9 112.6 36.0 5.6 75.3 513 180 B D B > -V 535 0H 71 -2,-0.7 3,-1.3 22,-0.2 22,-0.3 -0.247 11.6-126.8 -61.6 148.8 36.3 5.6 71.5 514 181 B I G > S+ 0 0 0 20,-3.2 3,-1.4 1,-0.2 6,-0.2 0.926 107.9 66.0 -59.4 -43.9 38.7 8.0 69.9 515 182 B D G 3 S+ 0 0 73 19,-0.4 -1,-0.2 1,-0.3 10,-0.1 0.617 94.4 57.7 -53.9 -20.1 35.9 9.3 67.8 516 183 B E G < S+ 0 0 65 -3,-1.3 -1,-0.3 2,-0.1 -2,-0.1 -0.034 80.3 108.7-104.3 31.5 34.0 10.8 70.8 517 184 B I X - 0 0 7 -3,-1.4 3,-1.7 3,-0.1 42,-0.0 -0.911 68.7-124.5-117.0 114.5 36.8 13.1 72.0 518 185 B P T 3 S+ 0 0 37 0, 0.0 2,-0.1 0, 0.0 3,-0.1 -0.077 94.3 27.9 -47.6 144.9 36.5 16.9 71.6 519 186 B G T 3 S+ 0 0 62 1,-0.2 2,-0.6 0, 0.0 36,-0.1 -0.097 90.4 110.7 91.4 -38.4 39.3 18.6 69.7 520 187 B I < - 0 0 20 -3,-1.7 -1,-0.2 -6,-0.2 -3,-0.1 -0.614 69.4-131.1 -73.8 117.6 40.1 15.5 67.6 521 188 B G > - 0 0 33 -2,-0.6 4,-2.3 1,-0.1 5,-0.2 -0.197 12.5-119.6 -65.0 161.8 39.0 16.3 64.1 522 189 B S H > S+ 0 0 101 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.962 115.8 48.6 -67.2 -48.1 36.9 13.8 62.1 523 190 B V H > S+ 0 0 92 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.884 113.1 47.7 -57.7 -41.7 39.7 13.5 59.5 524 191 B L H >> S+ 0 0 29 2,-0.2 4,-3.5 1,-0.2 3,-0.7 0.903 113.4 45.8 -66.0 -45.8 42.4 12.9 62.2 525 192 B A H 3X S+ 0 0 5 -4,-2.3 4,-2.8 1,-0.3 -1,-0.2 0.782 108.7 58.1 -68.2 -26.8 40.4 10.3 64.1 526 193 B R H 3X S+ 0 0 148 -4,-2.0 4,-0.6 -5,-0.2 -1,-0.3 0.711 111.8 41.4 -75.2 -18.3 39.6 8.8 60.8 527 194 B R H S+ 0 0 2 -4,-3.5 5,-2.3 1,-0.2 -2,-0.2 0.933 108.1 54.4 -54.4 -49.4 44.0 7.4 63.9 529 196 B N H ><5S+ 0 0 45 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.885 109.3 49.2 -51.9 -43.2 41.3 4.7 63.7 530 197 B E H 3<5S+ 0 0 112 -4,-0.6 2,-0.4 1,-0.3 -1,-0.2 0.970 103.6 58.8 -63.2 -52.1 43.0 3.3 60.6 531 198 B L T 3<5S- 0 0 80 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.229 130.4 -90.3 -64.2 17.4 46.4 3.2 62.3 532 199 B G T < 5S+ 0 0 51 -3,-1.1 2,-0.8 -2,-0.4 -3,-0.2 0.586 88.5 127.2 89.6 8.3 45.0 0.9 64.9 533 200 B I < + 0 0 16 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.1 -0.865 16.7 143.2-107.0 104.1 43.8 3.4 67.5 534 201 B Q + 0 0 95 -2,-0.8 -20,-3.2 1,-0.1 -19,-0.4 0.853 62.9 28.6-100.6 -58.3 40.2 2.8 68.4 535 202 B K B S-V 513 0H 6 -22,-0.3 3,-0.5 -21,-0.1 -22,-0.2 -0.499 87.3-105.8 -99.7 174.7 39.6 3.4 72.1 536 203 B L S > S+ 0 0 0 -24,-1.9 3,-1.9 -26,-0.4 4,-0.3 0.886 116.2 64.4 -69.7 -37.4 41.5 5.8 74.3 537 204 B R G >> S+ 0 0 133 -27,-0.9 3,-3.2 -28,-0.3 4,-0.6 0.797 82.0 79.1 -56.9 -28.0 43.5 3.0 76.0 538 205 B D G 34 S+ 0 0 49 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.484 84.2 63.7 -62.4 2.5 45.0 2.2 72.6 539 206 B I G <4 S+ 0 0 10 -3,-1.9 3,-0.3 1,-0.1 -1,-0.3 0.610 82.1 76.4 -96.4 -16.7 47.3 5.2 73.4 540 207 B L T <4 S+ 0 0 94 -3,-3.2 2,-0.6 1,-0.3 -2,-0.2 0.857 103.9 40.6 -57.8 -33.6 48.7 3.3 76.4 541 208 B S S < S+ 0 0 86 -4,-0.6 -1,-0.3 1,-0.1 3,-0.0 -0.850 82.7 102.3-119.1 93.8 50.6 1.3 73.7 542 209 B K S S- 0 0 29 -2,-0.6 2,-4.2 -3,-0.3 -1,-0.1 0.181 76.5-123.0-160.0 26.7 51.9 3.7 71.0 543 210 B N - 0 0 168 -3,-0.1 2,-0.1 3,-0.1 -4,-0.0 -0.065 50.9-118.1 62.7 -48.1 55.6 4.4 71.4 544 211 B Y S S+ 0 0 75 -2,-4.2 5,-0.1 -5,-0.0 12,-0.0 -0.257 95.9 42.2 93.5-177.5 54.7 8.2 71.5 545 212 B N S S+ 0 0 86 1,-0.3 -2,-0.1 -2,-0.1 -3,-0.0 0.674 102.5 71.8 2.1 68.9 56.0 10.6 68.9 546 213 B E S S+ 0 0 34 -4,-0.1 -1,-0.3 0, 0.0 -3,-0.1 -0.284 107.6 39.5-166.3 -19.0 55.2 7.9 66.5 547 214 B L S > S+ 0 0 5 2,-0.1 4,-2.5 3,-0.1 5,-0.3 0.595 109.6 57.2-108.3 -30.9 51.9 9.4 67.7 548 215 B E H > S+ 0 0 9 1,-0.2 4,-0.7 2,-0.2 6,-0.1 0.748 98.4 62.5 -75.2 -25.5 53.1 13.0 67.7 549 216 B K H 4 S+ 0 0 162 2,-0.1 -1,-0.2 3,-0.1 -2,-0.1 0.813 117.7 29.1 -67.0 -32.3 54.0 12.7 64.0 550 217 B I H 4 S+ 0 0 46 -3,-0.2 -2,-0.2 -4,-0.0 -3,-0.1 0.924 127.2 38.5 -88.2 -70.5 50.3 12.1 63.4 551 218 B T H < S- 0 0 12 -4,-2.5 4,-0.2 1,-0.1 -3,-0.2 0.893 101.6-120.1 -50.0 -55.8 48.5 14.0 66.2 552 219 B G < - 0 0 51 -4,-0.7 -4,-0.2 -5,-0.3 2,-0.1 0.255 38.7 -98.5 127.3 -11.5 50.7 17.0 66.3 553 220 B K S > S+ 0 0 99 -6,-0.3 4,-1.6 1,-0.1 5,-0.2 -0.153 117.1 75.9 90.5 -36.7 51.9 16.9 69.9 554 221 B A H > S+ 0 0 81 2,-0.2 4,-1.7 1,-0.2 3,-0.4 0.992 113.2 26.5 -63.3 -57.1 49.4 19.4 71.3 555 222 B K H > S+ 0 0 67 1,-0.2 4,-3.2 2,-0.2 5,-0.4 0.754 113.2 68.4 -73.5 -28.6 46.7 16.6 71.0 556 223 B A H > S+ 0 0 0 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.880 109.5 37.7 -58.2 -35.0 49.4 14.0 71.4 557 224 B L H X S+ 0 0 79 -4,-1.6 4,-3.0 -3,-0.4 5,-0.3 0.861 113.5 56.1 -80.1 -41.7 49.7 15.3 75.0 558 225 B Y H X S+ 0 0 35 -4,-1.7 4,-3.1 1,-0.2 5,-0.2 0.951 111.3 43.2 -53.8 -53.8 46.0 15.9 75.4 559 226 B L H X S+ 0 0 2 -4,-3.2 4,-2.8 2,-0.2 -1,-0.2 0.865 113.4 53.3 -62.7 -38.6 45.1 12.3 74.6 560 227 B L H X S+ 0 0 44 -4,-1.0 4,-0.6 -5,-0.4 -2,-0.2 0.966 114.9 38.5 -61.8 -53.8 48.0 11.1 76.7 561 228 B K H ><>S+ 0 0 98 -4,-3.0 5,-2.5 2,-0.2 3,-1.5 0.937 117.2 49.9 -63.2 -49.4 46.9 13.0 79.8 562 229 B L H ><5S+ 0 0 4 -4,-3.1 3,-2.4 -5,-0.3 -1,-0.2 0.945 105.2 58.8 -54.1 -49.3 43.2 12.3 79.2 563 230 B A H 3<5S+ 0 0 30 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.667 114.5 37.2 -53.7 -22.2 43.9 8.6 78.7 564 231 B Q T <<5S- 0 0 139 -3,-1.5 -1,-0.3 -4,-0.6 -2,-0.2 0.271 114.8-115.2-113.3 4.9 45.4 8.6 82.2 565 232 B N T < 5S+ 0 0 66 -3,-2.4 -3,-0.2 -4,-0.4 3,-0.1 0.913 78.6 127.1 59.8 46.3 42.8 11.0 83.7 566 233 B K < + 0 0 62 -5,-2.5 -4,-0.2 1,-0.1 -1,-0.1 -0.292 44.1 88.7-124.1 42.5 45.5 13.7 84.3 567 234 B Y + 0 0 94 -6,-0.2 2,-1.4 -5,-0.2 -84,-0.3 -0.199 50.1 142.5-130.0 36.2 43.7 16.5 82.5 568 235 B S + 0 0 59 -3,-0.1 -6,-0.0 -86,-0.1 0, 0.0 -0.531 21.9 173.5 -87.6 76.2 41.7 17.7 85.5 569 236 B E - 0 0 43 -2,-1.4 -87,-0.6 1,-0.1 2,-0.2 -0.429 30.9-113.7 -78.6 153.0 41.5 21.5 85.2 570 237 B P - 0 0 78 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.623 28.4-104.6 -90.0 149.2 39.3 23.5 87.7 571 238 B V - 0 0 3 -2,-0.2 2,-0.2 -140,-0.1 -128,-0.1 -0.572 35.6-148.8 -74.4 119.1 36.2 25.5 86.7 572 239 B E - 0 0 89 -2,-0.5 2,-1.6 -141,-0.1 -131,-0.1 -0.587 20.2-122.0 -87.2 153.0 36.9 29.3 86.7 573 240 B N S S+ 0 0 36 -2,-0.2 103,-3.4 103,-0.2 2,-0.3 -0.468 73.7 121.7 -88.9 61.7 34.2 31.8 87.5 574 241 B K E - S 0 675F 27 -2,-1.6 -140,-2.1 101,-0.3 2,-0.5 -0.879 56.6-134.7-127.5 161.0 34.7 33.5 84.1 575 242 B S E -qS 434 674F 22 99,-1.3 99,-1.6 -2,-0.3 98,-0.6 -0.900 4.0-164.5-123.8 109.3 32.6 34.3 81.0 576 243 B K + 0 0 97 -142,-3.0 -139,-0.1 -2,-0.5 -141,-0.1 0.081 56.3 114.7 -76.3 27.2 33.8 33.6 77.4 577 244 B I - 0 0 47 -2,-0.4 94,-0.1 -141,-0.1 -1,-0.1 -0.809 62.5-136.1-106.5 100.5 31.2 35.9 75.9 578 245 B P - 0 0 64 0, 0.0 2,-0.3 0, 0.0 94,-0.2 0.020 18.3-170.5 -48.6 155.1 32.6 39.0 74.2 579 246 B H E +W 671 0I 60 92,-1.1 92,-3.3 2,-0.0 2,-0.3 -0.961 13.7 179.5-146.4 135.2 31.1 42.4 74.6 580 247 B G E -W 670 0I 22 -2,-0.3 2,-0.4 90,-0.3 90,-0.2 -0.941 25.1-151.4-143.0 167.2 32.2 45.3 72.5 581 248 B R E -W 669 0I 87 88,-2.0 88,-1.8 -2,-0.3 2,-0.3 -0.984 16.2-174.5-139.8 124.5 31.8 49.0 71.7 582 249 B Y E -W 668 0I 73 -2,-0.4 2,-0.3 86,-0.3 86,-0.3 -0.728 3.8-168.2-112.4 163.8 32.5 50.5 68.3 583 250 B L E -W 667 0I 20 84,-2.7 84,-3.2 -2,-0.3 2,-0.3 -0.967 19.4-124.3-156.9 139.7 32.4 54.1 67.4 584 251 B T - 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0 0 29 -98,-0.6 2,-0.8 -2,-0.3 -58,-0.3 0.995 69.3-161.5 59.6 78.1 37.0 36.2 79.2 674 341 B I E -S 575 0F 4 -99,-1.6 -99,-1.3 -60,-0.2 2,-0.3 -0.829 12.9-136.6 -96.5 106.6 35.5 38.3 82.0 675 342 B I E -S 574 0F 54 -62,-2.4 -62,-0.4 -2,-0.8 -101,-0.3 -0.458 34.6-173.3 -63.4 119.8 36.5 37.1 85.4 676 343 B I 0 0 41 -103,-3.4 -103,-0.2 -2,-0.3 -64,-0.1 -0.569 360.0 360.0-115.2 176.5 33.4 37.2 87.6 677 344 B N 0 0 123 -66,-0.3 -1,-0.1 -2,-0.2 -103,-0.1 -0.577 360.0 360.0 98.1 360.0 32.2 36.7 91.2