==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 30-OCT-10 3PG5 . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM DIPHTHERIAE; . AUTHOR F.FOROUHAR,S.LEW,J.SEETHARAMAN,D.LEE,C.CICCOSANTI,S.SAHDEV,R . 1213 14 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44392.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 913 75.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 125 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 67 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 175 14.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 480 39.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 1.5 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 9 3 3 3 4 0 0 6 1 2 3 5 5 0 0 0 0 0 0 0 0 0 0 0 0 0 4 RESIDUES PER ALPHA HELIX . 2 0 10 3 5 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 PARALLEL BRIDGES PER LADDER . 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 1 0 1 2 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 X 0 0 35 0, 0.0 2,-0.3 0, 0.0 152,-0.2 0.000 360.0 360.0 360.0 105.9 -50.4 30.9 -35.3 2 2 A R E -a 153 0A 62 150,-1.7 152,-1.8 231,-0.0 2,-0.4 -0.760 360.0-149.4-110.0 155.4 -50.5 34.7 -35.8 3 3 A T E +a 154 0A 0 -2,-0.3 171,-1.9 150,-0.2 172,-1.5 -0.992 16.3 179.6-127.7 129.4 -48.4 37.4 -34.2 4 4 A I E -a 155 0A 0 150,-2.2 152,-2.4 -2,-0.4 2,-0.3 -0.832 2.2-177.0-123.5 161.7 -49.7 40.9 -33.6 5 5 A S E -a 156 0A 0 170,-0.3 172,-1.9 -2,-0.3 2,-0.8 -0.971 25.2-137.8-160.1 145.2 -48.1 44.0 -32.0 6 6 A F B -e 177 0B 4 150,-0.6 152,-0.2 -2,-0.3 172,-0.2 -0.740 33.8-177.1-109.6 83.9 -49.0 47.6 -31.1 7 7 A F + 0 0 0 170,-0.8 2,-0.3 -2,-0.8 -2,-0.1 -0.451 8.8 160.6 -82.4 151.9 -46.1 49.7 -32.2 8 8 A N - 0 0 8 151,-0.4 4,-0.1 153,-0.2 172,-0.1 -0.874 37.7-147.3-172.5 134.5 -45.9 53.5 -31.7 9 9 A N S S+ 0 0 4 -2,-0.3 -1,-0.1 1,-0.2 181,-0.1 0.947 101.9 53.9 -68.4 -52.1 -43.1 56.2 -31.7 10 10 A K S S- 0 0 27 176,-0.2 -1,-0.2 169,-0.1 170,-0.1 0.920 89.6-173.9 -48.8 -53.9 -44.9 58.3 -29.0 11 11 A G + 0 0 17 168,-0.3 2,-0.3 148,-0.1 -2,-0.1 0.443 14.9 136.1 65.4 145.9 -45.2 55.5 -26.6 12 12 A G > - 0 0 41 1,-0.1 4,-0.7 -4,-0.1 -1,-0.1 -0.990 64.3 -63.0 171.1-166.9 -47.1 55.7 -23.3 13 13 A V H > S+ 0 0 121 -2,-0.3 4,-1.0 2,-0.2 5,-0.1 0.718 121.3 57.8 -81.5 -24.9 -49.5 54.1 -20.8 14 14 A G H > S+ 0 0 28 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.833 101.0 54.9 -76.0 -33.6 -52.4 54.1 -23.3 15 15 A K H > S+ 0 0 8 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.877 110.5 46.8 -66.7 -36.3 -50.6 52.0 -25.8 16 16 A T H X S+ 0 0 6 -4,-0.7 4,-1.7 2,-0.2 -1,-0.2 0.745 112.3 49.6 -78.3 -23.2 -49.9 49.3 -23.2 17 17 A T H X S+ 0 0 50 -4,-1.0 4,-1.8 2,-0.2 -2,-0.2 0.836 110.3 49.3 -82.3 -35.2 -53.5 49.4 -21.9 18 18 A L H X S+ 0 0 3 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.929 111.4 51.5 -66.8 -44.9 -55.0 49.0 -25.4 19 19 A S H X S+ 0 0 1 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.957 111.4 44.9 -55.9 -57.0 -52.6 46.1 -26.1 20 20 A T H X S+ 0 0 1 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.835 113.2 51.3 -60.0 -35.4 -53.5 44.2 -22.9 21 21 A N H X S+ 0 0 34 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.917 110.6 47.3 -70.2 -41.9 -57.3 44.8 -23.4 22 22 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.946 110.7 53.2 -63.4 -44.7 -57.2 43.5 -27.0 23 23 A A H X S+ 0 0 0 -4,-2.7 4,-1.4 1,-0.2 -1,-0.2 0.903 107.8 51.3 -54.3 -44.0 -55.2 40.5 -25.9 24 24 A H H X S+ 0 0 44 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.901 107.9 52.7 -59.3 -43.8 -57.9 39.8 -23.3 25 25 A Y H X S+ 0 0 41 -4,-2.0 4,-1.6 1,-0.3 3,-0.3 0.923 105.3 52.8 -61.2 -45.7 -60.5 40.0 -25.9 26 26 A F H < S+ 0 0 0 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.838 106.3 56.5 -59.1 -30.8 -58.8 37.5 -28.1 27 27 A A H >X S+ 0 0 23 -4,-1.4 3,-1.1 -5,-0.2 4,-0.8 0.896 102.9 53.1 -67.4 -38.8 -58.8 35.3 -25.1 28 28 A L H 3< S+ 0 0 112 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.824 97.8 65.1 -65.3 -32.2 -62.5 35.5 -24.8 29 29 A Q T 3< S- 0 0 85 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.1 0.102 127.4 -96.9 -77.7 23.9 -62.9 34.4 -28.4 30 30 A G T <4 S+ 0 0 62 -3,-1.1 2,-0.3 1,-0.2 -2,-0.2 0.983 78.1 135.9 58.8 68.0 -61.4 31.1 -27.3 31 31 A K < - 0 0 47 -4,-0.8 2,-0.7 -5,-0.2 -1,-0.2 -0.970 57.2-123.2-148.5 127.8 -57.8 31.4 -28.2 32 32 A R - 0 0 92 -2,-0.3 120,-2.9 69,-0.1 121,-1.9 -0.586 39.6-164.0 -70.7 111.7 -54.7 30.5 -26.3 33 33 A V E -b 153 0A 3 -2,-0.7 69,-0.9 67,-0.3 2,-0.5 -0.835 15.8-162.5-109.1 139.5 -52.7 33.8 -26.1 34 34 A L E -bc 154 102A 0 119,-2.8 121,-3.0 -2,-0.4 2,-0.6 -0.967 7.2-160.3-116.1 129.5 -49.1 34.4 -25.2 35 35 A Y E -bc 155 103A 0 67,-2.7 69,-3.3 -2,-0.5 2,-0.6 -0.935 3.6-164.9-116.2 113.7 -48.1 37.9 -24.3 36 36 A V E -bc 156 104A 0 119,-2.5 121,-2.3 -2,-0.6 2,-1.1 -0.863 9.0-150.8-101.6 116.8 -44.4 38.7 -24.5 37 37 A D E +b 157 0A 0 67,-2.0 70,-0.2 -2,-0.6 36,-0.2 -0.714 24.7 165.8 -89.1 98.2 -43.2 41.9 -22.7 38 38 A C + 0 0 2 119,-1.7 121,-0.3 -2,-1.1 -1,-0.1 0.077 41.9 107.6 -98.4 23.3 -40.2 43.2 -24.6 39 39 A D > - 0 0 7 119,-0.2 3,-1.7 1,-0.1 68,-0.3 -0.884 64.7-146.1-104.2 130.1 -40.2 46.5 -23.0 40 40 A P T 3 S+ 0 0 25 0, 0.0 -1,-0.1 0, 0.0 70,-0.1 0.860 101.1 62.8 -58.1 -30.3 -37.5 47.2 -20.5 41 41 A Q T 3 S- 0 0 25 66,-0.1 757,-0.1 -3,-0.1 -3,-0.0 0.667 94.8-147.4 -66.3 -19.7 -40.1 49.3 -18.6 42 42 A C <> + 0 0 1 -3,-1.7 4,-1.5 65,-0.1 752,-0.1 0.924 43.3 149.4 49.7 54.6 -42.1 46.2 -18.0 43 43 A N T 4 S+ 0 0 48 2,-0.2 5,-0.1 1,-0.1 -1,-0.1 0.912 70.7 44.7 -82.0 -47.6 -45.4 48.0 -18.1 44 44 A A T >> S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 3,-0.7 0.852 115.2 52.1 -64.9 -32.7 -47.5 45.3 -19.5 45 45 A T H 3> S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.943 107.6 47.2 -69.1 -51.3 -45.8 42.8 -17.1 46 46 A Q H 3< S+ 0 0 48 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.359 115.8 51.7 -74.8 12.9 -46.4 44.8 -13.9 47 47 A L H <4 S+ 0 0 79 -3,-0.7 -2,-0.2 -4,-0.1 -1,-0.2 0.751 112.0 37.0-113.1 -40.7 -49.9 45.2 -15.1 48 48 A X H < S+ 0 0 5 -4,-1.9 50,-0.4 -5,-0.1 2,-0.3 0.714 108.6 70.3 -86.6 -23.5 -51.1 41.7 -15.9 49 49 A L S < S- 0 0 11 -4,-1.8 47,-0.1 -5,-0.2 2,-0.1 -0.776 81.5-122.3-100.2 144.6 -49.3 39.9 -13.1 50 50 A T > - 0 0 66 -2,-0.3 4,-2.5 1,-0.1 3,-0.2 -0.364 31.3-105.8 -76.4 158.5 -50.2 40.2 -9.4 51 51 A E H > S+ 0 0 122 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.790 121.1 62.4 -56.9 -27.6 -47.6 41.4 -6.8 52 52 A E H 4 S+ 0 0 149 1,-0.2 -1,-0.2 2,-0.2 4,-0.2 0.981 109.3 38.0 -58.3 -60.0 -47.4 37.8 -5.7 53 53 A Q H >> S+ 0 0 39 -3,-0.2 4,-0.6 1,-0.2 3,-0.6 0.839 115.5 58.4 -60.1 -37.8 -46.1 36.7 -9.1 54 54 A T H >X S+ 0 0 8 -4,-2.5 3,-2.1 1,-0.2 4,-1.8 0.981 107.1 40.0 -59.6 -65.7 -44.1 39.9 -9.4 55 55 A E H 3< S+ 0 0 88 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.431 106.5 73.5 -67.8 6.5 -41.8 39.7 -6.3 56 56 A S H <4 S+ 0 0 51 -3,-0.6 -1,-0.3 -4,-0.2 -2,-0.2 0.737 105.8 30.8 -87.9 -26.9 -41.6 36.0 -7.2 57 57 A I H << S+ 0 0 3 -3,-2.1 -2,-0.2 -4,-0.6 2,-0.2 0.841 125.5 41.8 -97.5 -48.2 -39.4 36.7 -10.2 58 58 A Y < 0 0 13 -4,-1.8 -1,-0.1 1,-0.1 -2,-0.1 -0.166 360.0 360.0 -94.8 41.0 -37.5 39.8 -8.9 59 59 A L 0 0 116 -3,-0.2 -2,-0.1 -2,-0.2 -3,-0.1 0.852 360.0 360.0 -61.1 360.0 -37.1 38.3 -5.4 60 ! 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 61 64 A D 0 0 151 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -99.9 -30.1 39.2 -2.9 62 65 A E > - 0 0 143 3,-0.1 3,-2.8 2,-0.0 4,-0.4 0.606 360.0 -1.6-100.0-111.6 -26.9 38.8 -4.9 63 66 A V G > S+ 0 0 73 1,-0.3 3,-1.5 2,-0.2 4,-0.2 0.763 122.0 74.7 -56.1 -24.6 -26.3 36.0 -7.5 64 67 A A G > S+ 0 0 33 1,-0.3 3,-0.8 2,-0.2 -1,-0.3 0.653 83.9 67.2 -63.0 -13.8 -29.8 34.8 -6.6 65 68 A E G X> S+ 0 0 44 -3,-2.8 3,-2.5 1,-0.2 4,-0.6 0.815 84.2 69.0 -75.5 -31.5 -31.0 37.8 -8.6 66 69 A R G <4 S+ 0 0 72 -3,-1.5 4,-0.3 -4,-0.4 -1,-0.2 0.552 83.0 76.9 -63.8 -4.6 -29.7 36.1 -11.8 67 70 A N G <> S+ 0 0 89 -3,-0.8 4,-0.5 1,-0.2 3,-0.4 0.695 87.2 58.1 -77.8 -20.6 -32.5 33.7 -11.2 68 71 A S H X> S+ 0 0 0 -3,-2.5 4,-1.1 1,-0.2 3,-1.0 0.867 93.2 65.7 -76.4 -34.6 -34.9 36.3 -12.5 69 72 A L H 3< S+ 0 0 16 -4,-0.6 -1,-0.2 1,-0.3 -2,-0.2 0.722 106.7 43.7 -57.6 -21.2 -33.0 36.4 -15.8 70 73 A A H 34 S+ 0 0 63 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.2 0.593 110.6 53.7 -98.4 -15.9 -34.2 32.8 -16.3 71 74 A K H << S+ 0 0 64 -3,-1.0 -2,-0.2 -4,-0.5 2,-0.1 0.497 108.3 55.3 -96.2 -4.9 -37.7 33.4 -15.2 72 75 A T S >< S- 0 0 3 -4,-1.1 3,-0.8 32,-0.1 4,-0.2 -0.356 103.9 -85.2-111.8-164.4 -38.3 36.3 -17.6 73 76 A V G > S+ 0 0 1 32,-2.0 3,-1.4 1,-0.2 4,-0.4 0.747 113.7 79.5 -75.6 -26.3 -38.0 36.9 -21.4 74 77 A Y G >> S+ 0 0 0 1,-0.3 3,-1.4 31,-0.2 4,-0.7 0.788 80.9 74.8 -50.8 -26.6 -34.3 37.6 -21.1 75 78 A A G X4 S+ 0 0 24 -3,-0.8 3,-1.2 1,-0.3 -1,-0.3 0.881 83.5 59.3 -55.3 -46.4 -34.0 33.9 -20.9 76 79 A I G <4 S+ 0 0 2 -3,-1.4 12,-0.7 1,-0.3 4,-0.4 0.665 105.3 52.6 -63.9 -12.3 -34.6 33.2 -24.5 77 80 A F G <> S+ 0 0 1 -3,-1.4 4,-2.1 -4,-0.4 5,-0.3 0.679 80.0 90.4 -96.5 -17.5 -31.6 35.3 -25.4 78 81 A V H S+ 0 0 19 0, 0.0 5,-1.1 0, 0.0 -1,-0.2 0.934 111.5 52.5 -59.4 -43.7 -28.0 31.3 -25.9 80 83 A L H >45S+ 0 0 2 -4,-0.4 3,-0.6 1,-0.2 -2,-0.2 0.787 109.5 50.7 -60.6 -29.4 -28.0 34.0 -28.7 81 84 A R H 3<5S+ 0 0 9 -4,-2.1 -1,-0.2 -3,-0.4 -3,-0.1 0.872 102.9 58.9 -75.5 -38.7 -25.7 36.1 -26.5 82 85 A E T 3<5S- 0 0 19 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.384 129.0 -92.4 -72.0 4.0 -23.3 33.2 -26.0 83 86 A G T < 5S+ 0 0 1 -3,-0.6 -3,-0.2 1,-0.3 -1,-0.1 -0.046 88.0 122.5 112.3 -34.0 -22.7 33.0 -29.7 84 87 A E < - 0 0 94 -5,-1.1 -1,-0.3 -6,-0.1 305,-0.1 -0.035 56.9-138.6 -58.9 167.0 -25.3 30.4 -30.7 85 88 A S S S+ 0 0 5 -3,-0.1 2,-0.4 1,-0.1 -1,-0.1 0.007 74.9 78.4-121.5 29.8 -28.0 31.3 -33.3 86 89 A Q S S- 0 0 93 -9,-0.1 -2,-0.1 -10,-0.0 -1,-0.1 -0.953 71.5-132.9-143.1 117.2 -31.1 29.6 -31.8 87 90 A I - 0 0 17 -2,-0.4 2,-0.9 1,-0.1 -10,-0.2 0.105 38.0 -92.1 -56.6 176.2 -33.2 31.0 -28.9 88 91 A A - 0 0 12 -12,-0.7 -1,-0.1 1,-0.2 -10,-0.1 -0.843 34.4-171.4 -98.0 102.7 -34.2 28.9 -26.0 89 92 A A + 0 0 35 -2,-0.9 2,-2.3 1,-0.1 -1,-0.2 0.821 66.8 95.4 -60.8 -30.5 -37.6 27.4 -27.0 90 93 A E + 0 0 152 -3,-0.1 2,-0.3 2,-0.1 -1,-0.1 -0.380 58.3 153.7 -62.3 78.1 -37.8 26.1 -23.4 91 94 A I - 0 0 14 -2,-2.3 -20,-0.1 -15,-0.0 -18,-0.1 -0.820 33.1-160.5-112.2 155.0 -39.8 29.0 -22.1 92 95 A T - 0 0 98 -2,-0.3 -2,-0.1 -20,-0.2 0, 0.0 -0.704 14.9-174.5-138.4 85.7 -42.1 29.1 -19.1 93 96 A P - 0 0 16 0, 0.0 2,-0.4 0, 0.0 11,-0.2 -0.107 21.7-116.7 -71.3 173.9 -44.6 31.9 -19.0 94 97 A X B -D 103 0A 44 9,-2.8 9,-3.3 7,-0.1 2,-0.2 -0.946 22.6-114.6-120.6 138.0 -47.0 32.8 -16.3 95 98 A R - 0 0 137 -2,-0.4 2,-0.9 7,-0.3 7,-0.2 -0.445 19.0-142.0 -71.1 136.5 -50.8 32.8 -16.4 96 99 A S >> - 0 0 0 5,-0.3 4,-3.1 1,-0.2 5,-0.5 -0.858 10.3-166.9-102.2 100.2 -52.6 36.1 -15.9 97 100 A E T 45S+ 0 0 172 -2,-0.9 -1,-0.2 2,-0.2 -48,-0.1 0.919 87.0 48.8 -51.3 -48.8 -55.7 35.4 -13.8 98 101 A R T 45S+ 0 0 157 -50,-0.4 -1,-0.2 1,-0.2 -49,-0.1 0.982 125.7 24.3 -54.9 -67.9 -57.1 38.9 -14.7 99 102 A F T 45S- 0 0 10 -51,-0.3 -1,-0.2 2,-0.1 -2,-0.2 0.561 96.5-133.7 -77.8 -11.7 -56.6 38.8 -18.5 100 103 A G T <5 + 0 0 32 -4,-3.1 2,-0.4 1,-0.2 -67,-0.3 0.847 66.1 115.8 59.9 38.3 -56.6 35.0 -18.8 101 104 A V S - 0 0 0 -68,-0.3 3,-2.5 -70,-0.2 4,-0.1 -0.836 23.2-132.1-167.5 125.3 -36.9 42.5 -17.4 108 111 A P G > S+ 0 0 6 0, 0.0 3,-0.7 0, 0.0 -67,-0.1 0.538 101.7 78.6 -58.6 -2.5 -35.1 45.9 -17.3 109 112 A A G > + 0 0 3 1,-0.2 3,-2.1 2,-0.1 4,-0.5 0.467 62.1 93.7 -84.7 -2.3 -32.0 44.0 -18.3 110 113 A L G <> + 0 0 1 -3,-2.5 4,-1.5 1,-0.3 -1,-0.2 0.563 63.5 84.1 -66.2 -5.1 -33.3 43.9 -21.9 111 114 A S G <4 S+ 0 0 11 -3,-0.7 4,-0.5 1,-0.2 -1,-0.3 0.846 89.4 50.4 -64.7 -29.9 -31.2 47.0 -22.3 112 115 A Q T <> S+ 0 0 57 -3,-2.1 4,-1.2 1,-0.2 3,-0.3 0.761 105.8 53.9 -77.2 -27.9 -28.4 44.6 -22.9 113 116 A I H > S+ 0 0 0 -4,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.781 99.7 62.8 -76.5 -24.8 -30.3 42.7 -25.5 114 117 A E H X S+ 0 0 32 -4,-1.5 4,-1.3 1,-0.2 51,-0.2 0.769 105.0 46.8 -68.9 -23.9 -30.9 46.0 -27.3 115 118 A D H > S+ 0 0 57 -4,-0.5 4,-1.9 -3,-0.3 -1,-0.2 0.774 108.3 55.4 -84.6 -30.9 -27.1 46.1 -27.8 116 119 A L H X S+ 0 0 4 -4,-1.2 4,-1.2 1,-0.2 -2,-0.2 0.863 111.0 45.3 -68.6 -35.8 -27.1 42.6 -28.9 117 120 A X H X S+ 0 0 0 -4,-1.9 4,-3.4 2,-0.2 5,-0.2 0.847 109.5 52.3 -78.1 -35.3 -29.6 43.5 -31.6 118 121 A S H X S+ 0 0 29 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.930 112.8 45.8 -65.4 -41.7 -27.9 46.6 -32.8 119 122 A D H X S+ 0 0 22 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.807 116.0 48.1 -67.8 -32.6 -24.6 44.7 -33.2 120 123 A S H X S+ 0 0 2 -4,-1.2 4,-3.1 2,-0.2 5,-0.2 0.955 110.8 47.9 -73.4 -51.2 -26.5 41.9 -35.0 121 124 A W H X S+ 0 0 7 -4,-3.4 4,-1.2 2,-0.2 -2,-0.2 0.896 112.2 52.6 -56.7 -40.2 -28.5 44.2 -37.3 122 125 A Q H >X S+ 0 0 39 -4,-2.2 3,-1.0 -5,-0.2 4,-0.8 0.979 113.4 40.4 -58.6 -59.3 -25.2 46.0 -38.1 123 126 A S H ><>S+ 0 0 3 -4,-1.9 5,-1.0 1,-0.3 3,-1.0 0.855 107.7 62.8 -58.7 -39.2 -23.3 42.8 -39.1 124 127 A A H ><5S+ 0 0 0 -4,-3.1 3,-1.6 1,-0.3 -1,-0.3 0.839 97.1 59.7 -57.4 -31.2 -26.3 41.4 -40.8 125 128 A L H <<5S+ 0 0 14 -4,-1.2 -1,-0.3 -3,-1.0 -2,-0.2 0.858 97.9 58.4 -64.2 -34.2 -26.0 44.4 -43.2 126 129 A G T <<5S- 0 0 22 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.239 125.1-104.2 -79.7 14.9 -22.5 43.2 -44.1 127 130 A R T < 5 + 0 0 45 -3,-1.6 2,-0.9 1,-0.2 -3,-0.2 0.918 63.7 161.8 61.8 46.8 -24.1 39.9 -45.2 128 131 A Q >< - 0 0 36 -5,-1.0 4,-1.6 1,-0.2 -1,-0.2 -0.851 27.9-159.3-100.0 96.8 -23.0 38.0 -42.2 129 132 A T H > S+ 0 0 5 -2,-0.9 4,-1.7 257,-0.2 -1,-0.2 0.821 83.5 64.3 -46.7 -38.3 -25.2 34.9 -42.2 130 133 A G H >4 S+ 0 0 3 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.971 111.6 29.1 -52.2 -74.2 -24.6 34.4 -38.4 131 134 A P H >> S+ 0 0 6 0, 0.0 4,-1.2 0, 0.0 3,-0.9 0.651 109.6 76.4 -63.7 -13.6 -26.2 37.5 -36.9 132 135 A F H >< S+ 0 0 0 -4,-1.6 3,-0.7 1,-0.3 4,-0.3 0.973 98.9 39.9 -60.8 -52.2 -28.5 37.5 -39.9 133 136 A R T << S+ 0 0 17 -4,-1.7 -1,-0.3 -3,-0.7 -3,-0.1 0.353 106.6 68.3 -79.6 8.1 -30.6 34.7 -38.4 134 137 A R T X4 S+ 0 0 12 -3,-0.9 3,-1.2 -4,-0.2 -1,-0.2 0.774 87.6 61.9 -93.8 -31.1 -30.3 36.2 -35.0 135 138 A I T X< S+ 0 0 0 -4,-1.2 3,-0.6 -3,-0.7 -2,-0.2 0.675 94.0 70.2 -67.7 -10.9 -32.4 39.3 -35.7 136 139 A H T 3> + 0 0 5 -4,-0.3 4,-2.2 1,-0.2 -1,-0.3 0.068 58.1 117.8 -93.0 25.8 -35.2 36.8 -36.3 137 140 A W H <> + 0 0 0 -3,-1.2 4,-1.5 2,-0.2 -1,-0.2 0.874 69.9 60.8 -60.4 -33.5 -35.4 35.8 -32.7 138 141 A A H X> S+ 0 0 0 30,-0.6 4,-2.1 -3,-0.6 3,-0.9 0.974 110.8 35.8 -56.9 -60.1 -39.0 37.1 -32.7 139 142 A G H 3> S+ 0 0 2 1,-0.2 4,-2.7 2,-0.2 91,-0.5 0.812 109.9 65.9 -63.2 -31.0 -40.3 34.7 -35.3 140 143 A Q H 3X S+ 0 0 10 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.834 106.4 42.7 -60.2 -32.2 -38.0 32.0 -33.9 141 144 A L H S+ 0 0 0 -4,-2.1 5,-2.1 2,-0.2 6,-0.3 0.959 112.2 48.2 -71.0 -52.5 -44.8 27.9 -30.1 146 149 A E H ><5S+ 0 0 75 -4,-2.4 3,-0.5 1,-0.2 -2,-0.2 0.838 111.7 52.2 -54.6 -39.3 -46.7 27.1 -33.3 147 150 A R H 3<5S+ 0 0 175 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.868 114.3 39.5 -68.8 -42.3 -44.7 23.8 -33.7 148 151 A D T 3<5S- 0 0 105 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.344 108.6-128.9 -88.0 5.4 -45.5 22.6 -30.2 149 152 A D T < 5 + 0 0 107 -3,-0.5 -3,-0.2 -4,-0.3 -4,-0.1 0.883 63.1 138.8 47.6 49.6 -49.0 24.0 -30.6 150 153 A R < + 0 0 83 -5,-2.1 2,-0.3 1,-0.2 -4,-0.1 0.735 63.8 21.2 -93.0 -27.4 -48.8 25.9 -27.3 151 154 A Y - 0 0 16 -6,-0.3 -1,-0.2 -9,-0.1 -118,-0.2 -0.981 48.0-157.8-144.3 156.0 -50.4 29.1 -28.4 152 155 A D S S+ 0 0 37 -120,-2.9 -150,-1.7 -2,-0.3 2,-0.3 0.678 85.8 22.9-100.5 -29.0 -52.8 30.4 -31.1 153 156 A V E -ab 2 33A 0 -121,-1.9 -119,-2.8 -152,-0.2 2,-0.5 -0.999 61.9-158.3-144.1 142.6 -51.8 34.1 -30.8 154 157 A I E -ab 3 34A 0 -152,-1.8 -150,-2.2 -2,-0.3 2,-0.7 -0.978 5.9-156.8-126.0 125.0 -48.7 36.0 -29.6 155 158 A F E -ab 4 35A 0 -121,-3.0 -119,-2.5 -2,-0.5 2,-0.8 -0.876 4.8-158.8-101.1 117.5 -48.7 39.7 -28.6 156 159 A F E -ab 5 36A 0 -152,-2.4 2,-0.8 -2,-0.7 -150,-0.6 -0.843 6.8-161.1 -95.4 107.5 -45.4 41.4 -28.8 157 160 A D E - b 0 37A 4 -121,-2.3 -119,-1.7 -2,-0.8 2,-0.1 -0.796 16.4-173.8 -91.1 109.0 -45.5 44.5 -26.5 158 161 A V - 0 0 1 -2,-0.8 -119,-0.2 -152,-0.2 -152,-0.0 -0.471 17.5-116.4 -97.9 171.1 -42.7 46.8 -27.6 159 162 A G - 0 0 3 -121,-0.3 -151,-0.4 -2,-0.1 -1,-0.1 -0.253 35.8 -91.8 -95.8-173.2 -41.4 50.0 -26.1 160 163 A P S S+ 0 0 36 0, 0.0 -149,-0.1 0, 0.0 -1,-0.0 0.840 93.4 100.0 -69.5 -33.4 -41.3 53.6 -27.3 161 164 A S - 0 0 35 1,-0.1 -153,-0.2 -151,-0.0 -2,-0.1 -0.068 53.7-164.2 -52.0 151.7 -37.9 53.2 -28.9 162 165 A L + 0 0 5 4,-0.1 -1,-0.1 3,-0.0 -153,-0.0 -0.312 47.5 111.5-137.4 54.7 -37.5 52.6 -32.6 163 166 A G S > S- 0 0 6 560,-0.0 4,-1.6 561,-0.0 558,-0.0 -0.261 86.6 -53.9-108.3-163.0 -34.0 51.4 -33.0 164 167 A P H > S+ 0 0 19 0, 0.0 4,-1.7 0, 0.0 -49,-0.1 0.818 129.2 51.6 -44.1 -46.6 -32.4 48.0 -34.0 165 168 A F H >> S+ 0 0 4 -51,-0.2 4,-0.8 1,-0.2 3,-0.7 0.989 108.3 45.6 -60.9 -66.2 -34.2 46.0 -31.3 166 169 A N H >> S+ 0 0 3 1,-0.3 4,-1.5 2,-0.2 3,-0.5 0.784 109.0 59.7 -50.4 -29.5 -37.8 47.0 -31.9 167 170 A R H >X S+ 0 0 14 -4,-1.6 4,-1.8 1,-0.2 3,-0.7 0.962 102.1 51.7 -61.9 -50.9 -37.2 46.5 -35.6 168 171 A T H << S+ 0 0 0 -4,-1.7 -30,-0.6 -3,-0.7 -1,-0.2 0.590 105.7 58.1 -62.4 -11.5 -36.3 42.9 -35.0 169 172 A V H X< S+ 0 0 0 -4,-0.8 3,-1.3 -3,-0.5 4,-0.3 0.845 102.6 50.8 -85.9 -36.9 -39.5 42.6 -33.1 170 173 A L H X< S+ 0 0 0 -4,-1.5 3,-2.4 -3,-0.7 -2,-0.2 0.888 97.7 68.5 -66.0 -36.9 -41.6 43.7 -36.1 171 174 A L T 3< S+ 0 0 21 -4,-1.8 -1,-0.3 1,-0.3 61,-0.2 0.692 101.7 48.3 -54.7 -16.1 -39.8 41.0 -38.2 172 175 A G T < S+ 0 0 0 -3,-1.3 2,-0.3 -4,-0.1 -1,-0.3 0.477 95.7 93.9-102.9 -2.7 -41.7 38.5 -36.1 173 176 A C < - 0 0 3 -3,-2.4 -169,-0.2 -4,-0.3 3,-0.1 -0.702 54.4-163.6 -94.8 140.2 -45.0 40.1 -36.5 174 177 A D S S- 0 0 4 -171,-1.9 66,-1.1 -2,-0.3 2,-0.3 0.724 81.7 -5.9 -88.1 -26.2 -47.6 39.2 -39.1 175 178 A A E - f 0 240B 2 -172,-1.5 -170,-0.3 64,-0.2 2,-0.3 -0.951 62.8-165.4-157.6 171.7 -49.4 42.4 -38.4 176 179 A F E - f 0 241B 0 64,-1.3 66,-2.3 -2,-0.3 67,-0.6 -0.968 11.1-144.1-165.9 150.7 -49.5 45.5 -36.2 177 180 A V E -ef 6 243B 0 -172,-1.9 -170,-0.8 -2,-0.3 67,-0.2 -0.822 13.7-143.7-114.5 156.7 -51.6 48.5 -35.1 178 181 A T E - f 0 244B 0 65,-1.6 67,-1.4 -2,-0.3 2,-0.3 -0.869 11.3-162.2-127.0 99.8 -50.4 52.0 -34.3 179 182 A P E + f 0 245B 1 0, 0.0 -168,-0.3 0, 0.0 67,-0.2 -0.645 17.8 177.2 -81.2 133.2 -52.3 53.8 -31.5 180 183 A T E - f 0 246B 3 65,-3.5 67,-1.3 -2,-0.3 7,-0.1 -0.573 33.6-129.0-123.7-172.4 -51.7 57.6 -31.5 181 184 A A - 0 0 38 66,-0.3 3,-0.1 65,-0.2 65,-0.1 0.680 27.5-136.3-115.2 -26.4 -52.9 60.7 -29.6 182 185 A T + 0 0 21 1,-0.3 68,-0.3 2,-0.1 69,-0.2 0.280 63.6 118.3 85.8 -11.1 -54.0 63.2 -32.1 183 186 A D S > S- 0 0 65 66,-0.1 4,-2.5 1,-0.1 -1,-0.3 -0.249 80.7 -95.1 -78.2 176.3 -52.3 66.3 -30.5 184 187 A L H > S+ 0 0 13 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.972 122.4 38.4 -58.0 -62.8 -49.6 68.3 -32.3 185 188 A F H > S+ 0 0 9 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.858 115.1 56.1 -58.2 -37.0 -46.5 66.6 -30.9 186 189 A S H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.942 112.9 40.4 -60.9 -48.6 -48.2 63.2 -31.1 187 190 A F H X S+ 0 0 11 -4,-2.5 4,-2.1 2,-0.2 5,-0.2 0.913 109.1 57.7 -67.9 -44.4 -48.9 63.6 -34.8 188 191 A H H X S+ 0 0 9 -4,-3.0 4,-1.2 1,-0.2 -1,-0.2 0.826 111.7 46.0 -54.6 -30.2 -45.6 65.2 -35.7 189 192 A A H X S+ 0 0 1 -4,-1.4 4,-1.6 -5,-0.2 -1,-0.2 0.887 107.6 54.6 -76.8 -44.5 -44.1 62.0 -34.2 190 193 A F H X S+ 0 0 1 -4,-1.9 4,-1.3 1,-0.2 -2,-0.2 0.738 107.3 53.6 -62.0 -25.5 -46.6 59.7 -36.1 191 194 A G H X S+ 0 0 4 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.913 107.0 48.2 -75.3 -45.4 -45.4 61.4 -39.3 192 195 A N H X S+ 0 0 12 -4,-1.2 4,-1.9 1,-0.2 -2,-0.2 0.775 105.8 62.8 -64.7 -25.1 -41.8 60.7 -38.6 193 196 A L H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.940 100.2 50.0 -65.7 -47.6 -42.9 57.2 -37.8 194 197 A A H X S+ 0 0 1 -4,-1.3 4,-1.7 1,-0.2 5,-0.3 0.938 109.2 52.5 -56.5 -46.6 -44.1 56.6 -41.4 195 198 A R H X S+ 0 0 76 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.919 107.2 53.9 -54.7 -43.8 -40.8 57.9 -42.7 196 199 A W H X S+ 0 0 21 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.912 106.3 50.8 -58.7 -46.7 -39.0 55.4 -40.5 197 200 A F H X S+ 0 0 0 -4,-2.1 4,-3.0 1,-0.2 5,-0.5 0.990 107.4 50.6 -55.6 -66.1 -40.9 52.4 -41.8 198 201 A D H X S+ 0 0 63 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.842 114.1 51.0 -39.0 -40.5 -40.3 53.1 -45.4 199 202 A A H X S+ 0 0 39 -4,-1.7 4,-1.5 -5,-0.3 3,-0.3 0.984 116.5 31.8 -64.8 -64.0 -36.7 53.4 -44.4 200 203 A W H X S+ 0 0 8 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.829 113.0 61.6 -69.4 -32.0 -35.9 50.3 -42.5 201 204 A V H X S+ 0 0 35 -4,-3.0 4,-2.4 -5,-0.3 -1,-0.2 0.896 107.9 45.4 -61.1 -37.8 -38.3 48.1 -44.4 202 205 A T H X S+ 0 0 69 -4,-1.2 4,-1.2 -5,-0.5 -1,-0.2 0.876 110.7 53.0 -70.2 -38.6 -36.3 48.8 -47.5 203 206 A Q H X S+ 0 0 22 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.873 111.9 46.4 -63.2 -38.5 -33.0 48.2 -45.7 204 207 A Y H X S+ 0 0 34 -4,-2.5 4,-3.2 2,-0.2 5,-0.3 0.919 100.6 64.6 -70.1 -46.5 -34.4 44.8 -44.5 205 208 A A H X S+ 0 0 56 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.861 110.4 40.8 -45.4 -35.8 -35.6 44.0 -47.9 206 209 A E H X S+ 0 0 38 -4,-1.2 4,-3.2 2,-0.2 5,-0.4 0.927 109.3 57.7 -77.8 -47.5 -31.8 44.0 -48.8 207 210 A I H X S+ 0 0 5 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.883 112.7 43.3 -45.8 -46.0 -30.8 42.3 -45.6 208 211 A H H >X S+ 0 0 57 -4,-3.2 4,-2.6 2,-0.2 3,-0.6 0.995 117.4 41.5 -64.4 -67.2 -33.0 39.5 -46.6 209 212 A E H 3X S+ 0 0 131 -4,-1.8 4,-2.3 -5,-0.3 5,-0.2 0.923 118.0 47.7 -47.5 -55.6 -32.2 39.2 -50.3 210 213 A G H 3X S+ 0 0 4 -4,-3.2 4,-0.8 1,-0.2 -1,-0.2 0.750 115.7 42.9 -61.8 -29.3 -28.4 39.7 -49.7 211 214 A N H < S+ 0 0 5 -4,-2.9 3,-2.8 1,-0.2 4,-0.4 0.979 109.3 56.6 -57.8 -57.6 -26.0 31.6 -47.6 216 219 A K H >< S+ 0 0 81 -4,-2.6 3,-0.8 1,-0.3 -1,-0.2 0.745 99.1 59.9 -44.1 -35.4 -27.5 29.6 -50.4 217 220 A K T 3< S+ 0 0 109 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.342 111.7 40.5 -81.2 8.3 -24.2 29.8 -52.4 218 221 A Y T < S+ 0 0 69 -3,-2.8 2,-0.3 1,-0.3 -1,-0.2 0.252 123.1 23.4-134.1 7.2 -22.4 28.0 -49.5 219 222 A S < - 0 0 27 -3,-0.8 -1,-0.3 -4,-0.4 0, 0.0 -0.976 47.6-155.4-166.6 159.9 -25.1 25.4 -48.5 220 223 A A S > S+ 0 0 95 -2,-0.3 3,-0.9 -3,-0.1 4,-0.1 0.624 93.4 65.0-114.4 -25.3 -28.1 23.5 -49.9 221 224 A D T >> S+ 0 0 99 1,-0.2 4,-2.3 2,-0.1 3,-1.4 0.282 72.0 105.3 -81.5 11.1 -29.9 22.7 -46.6 222 225 A V H 3> + 0 0 3 1,-0.3 4,-0.8 2,-0.2 -1,-0.2 0.768 68.3 63.9 -62.6 -27.2 -30.3 26.5 -46.3 223 226 A E H <4 S+ 0 0 116 -3,-0.9 -1,-0.3 1,-0.2 -2,-0.1 0.734 112.0 35.8 -71.0 -19.5 -34.0 26.1 -47.2 224 227 A A H X4 S+ 0 0 47 -3,-1.4 3,-1.2 2,-0.2 -2,-0.2 0.778 110.5 57.4-101.3 -36.2 -34.5 24.1 -44.1 225 228 A K H 3< S+ 0 0 58 -4,-2.3 -2,-0.2 1,-0.3 -3,-0.2 0.667 108.1 53.3 -69.4 -12.0 -32.2 25.8 -41.7 226 229 A T T 3< S+ 0 0 11 -4,-0.8 3,-0.4 -5,-0.2 5,-0.4 0.490 87.0 81.4-100.5 -6.4 -34.2 28.9 -42.5 227 230 A R S < S+ 0 0 180 -3,-1.2 4,-0.2 1,-0.2 -2,-0.2 0.925 80.5 63.5 -66.9 -45.9 -37.6 27.5 -41.7 228 231 A P S S+ 0 0 29 0, 0.0 2,-1.1 0, 0.0 -85,-0.3 0.766 92.8 68.2 -52.9 -27.8 -37.4 28.0 -37.9 229 232 A L S S- 0 0 0 -3,-0.4 2,-1.2 -4,-0.1 -89,-0.2 -0.756 97.0-128.3 -95.3 92.7 -37.2 31.7 -38.3 230 233 A R > - 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0 0 2 5,-0.9 -50,-0.1 1,-0.2 -1,-0.1 -0.445 6.0-154.3 -87.7 167.4 4.3 15.9 -45.9 402 100 B E S S+ 0 0 148 -52,-0.8 3,-0.4 -2,-0.1 -1,-0.2 0.799 86.4 38.1-104.5 -80.4 7.3 14.3 -47.6 403 101 B R S S+ 0 0 158 1,-0.2 -52,-0.1 2,-0.1 -53,-0.0 0.550 134.5 32.3 -51.4 -6.8 10.5 16.4 -47.7 404 102 B F S S- 0 0 4 -54,-0.2 -1,-0.2 2,-0.1 -75,-0.2 0.612 89.9-140.8-126.8 -22.9 9.4 17.5 -44.1 405 103 B G + 0 0 28 -3,-0.4 2,-0.3 1,-0.2 -70,-0.3 0.963 58.9 123.8 56.3 53.9 7.6 14.6 -42.5 406 104 B V - 0 0 0 -56,-0.1 -5,-0.9 -7,-0.1 2,-0.3 -0.991 69.8-106.8-147.0 134.7 4.9 16.8 -40.8 407 105 B D E -kL 336 400C 23 -72,-1.6 -70,-3.4 -2,-0.3 2,-0.4 -0.479 42.4-158.6 -63.2 120.9 1.1 16.7 -41.0 408 106 B V E -kL 337 399C 0 -9,-3.1 -9,-0.8 -2,-0.3 -70,-0.2 -0.826 19.2-152.0-108.8 142.8 0.1 19.7 -43.2 409 107 B L E -k 338 0C 2 -72,-3.4 -70,-1.9 -2,-0.4 -31,-0.3 -0.807 32.2-132.6-110.7 87.1 -3.3 21.4 -43.3 410 108 B P - 0 0 2 0, 0.0 -32,-1.9 0, 0.0 2,-0.1 0.046 20.2-131.7 -39.2 141.1 -3.3 22.8 -46.9 411 109 B G - 0 0 0 -34,-0.2 -71,-0.1 -33,-0.1 3,-0.1 -0.256 13.8-148.2 -91.0-177.6 -4.4 26.4 -47.3 412 110 B H > - 0 0 0 -73,-0.4 3,-2.4 -71,-0.1 -68,-0.1 -0.937 21.7-132.3-156.3 131.9 -6.9 28.0 -49.6 413 111 B P T > S+ 0 0 7 0, 0.0 3,-1.8 0, 0.0 4,-0.1 0.771 100.1 79.3 -53.7 -25.1 -7.2 31.4 -51.2 414 112 B A T >> + 0 0 1 1,-0.3 3,-2.5 2,-0.2 4,-0.6 0.627 66.4 87.8 -58.0 -16.3 -10.8 31.5 -50.0 415 113 B L H <> + 0 0 0 -3,-2.4 4,-2.0 1,-0.3 -1,-0.3 0.619 65.5 84.0 -60.5 -10.8 -9.5 32.5 -46.6 416 114 B S H <4 S+ 0 0 9 -3,-1.8 4,-0.4 1,-0.2 -1,-0.3 0.836 90.5 49.7 -60.3 -29.8 -9.7 36.0 -48.0 417 115 B Q H X> S+ 0 0 37 -3,-2.5 4,-1.0 1,-0.2 3,-0.7 0.822 105.8 53.7 -77.2 -32.8 -13.3 35.8 -46.9 418 116 B I H 3X S+ 0 0 1 -4,-0.6 4,-2.3 1,-0.2 5,-0.3 0.841 98.4 65.2 -69.7 -32.0 -12.5 34.6 -43.4 419 117 B E H 3X S+ 0 0 34 -4,-2.0 4,-0.7 1,-0.3 51,-0.5 0.767 105.0 45.6 -60.4 -23.8 -10.2 37.6 -43.1 420 118 B D H <> S+ 0 0 57 -3,-0.7 4,-1.3 -4,-0.4 -1,-0.3 0.738 106.6 58.8 -87.7 -29.3 -13.4 39.7 -43.3 421 119 B L H X S+ 0 0 10 -4,-1.0 4,-1.4 1,-0.2 -2,-0.2 0.894 110.2 42.6 -66.3 -41.8 -15.2 37.4 -40.9 422 120 B X H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.780 105.4 63.1 -76.2 -28.3 -12.6 38.1 -38.2 423 121 B S H X S+ 0 0 28 -4,-0.7 4,-0.8 -5,-0.3 -1,-0.2 0.865 111.1 39.5 -63.9 -34.5 -12.5 41.8 -39.1 424 122 B D H X S+ 0 0 23 -4,-1.3 4,-1.5 2,-0.2 -2,-0.2 0.783 114.7 53.2 -85.2 -27.7 -16.2 41.9 -38.0 425 123 B S H X S+ 0 0 2 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.869 106.6 50.6 -75.7 -36.6 -15.7 39.6 -35.0 426 124 B W H X S+ 0 0 9 -4,-2.7 4,-1.5 2,-0.2 -1,-0.2 0.884 109.8 51.5 -66.8 -39.5 -12.8 41.5 -33.5 427 125 B Q H X S+ 0 0 36 -4,-0.8 4,-0.9 -5,-0.3 -1,-0.2 0.911 113.9 43.5 -63.6 -42.3 -14.9 44.7 -33.7 428 126 B S H ><>S+ 0 0 4 -4,-1.5 5,-1.5 1,-0.2 3,-0.7 0.889 104.5 64.5 -70.0 -39.0 -17.8 43.0 -31.9 429 127 B A H ><5S+ 0 0 0 -4,-2.6 3,-1.2 1,-0.3 -1,-0.2 0.875 99.0 54.6 -50.8 -40.6 -15.4 41.4 -29.4 430 128 B L H 3<5S+ 0 0 10 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.867 96.6 64.8 -62.1 -37.4 -14.6 44.9 -28.2 431 129 B G T <<5S- 0 0 19 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.139 121.2-109.9 -73.3 23.4 -18.3 45.5 -27.7 432 130 B R T < 5 + 0 0 31 -3,-1.2 2,-1.3 1,-0.2 -3,-0.2 0.769 61.4 163.6 54.5 27.1 -18.1 42.8 -25.0 433 131 B Q >< - 0 0 17 -5,-1.5 4,-1.6 1,-0.2 -1,-0.2 -0.638 26.9-160.2 -79.3 94.7 -20.1 40.5 -27.3 434 132 B T H > S+ 0 0 0 -2,-1.3 4,-0.6 1,-0.2 -1,-0.2 0.549 83.3 64.3 -54.4 -6.9 -19.4 37.2 -25.6 435 133 B G H >> S+ 0 0 3 2,-0.2 3,-1.0 -354,-0.1 4,-0.7 0.968 108.1 32.2 -81.3 -64.6 -20.5 35.5 -28.9 436 134 B P H 3> S+ 0 0 12 0, 0.0 4,-1.8 0, 0.0 -2,-0.2 0.674 108.4 74.5 -66.3 -15.3 -17.8 36.7 -31.4 437 135 B F H 3< S+ 0 0 0 -4,-1.6 4,-0.4 1,-0.2 -2,-0.2 0.927 97.1 46.3 -61.8 -41.6 -15.4 36.7 -28.4 438 136 B R H << S+ 0 0 13 -3,-1.0 -1,-0.2 -4,-0.6 3,-0.2 0.747 107.9 57.9 -73.1 -22.4 -15.3 32.9 -28.7 439 137 B R H >< S+ 0 0 15 -4,-0.7 3,-1.5 1,-0.2 -1,-0.2 0.860 96.5 59.6 -74.4 -38.4 -14.9 33.0 -32.4 440 138 B I T 3< S+ 0 0 0 -4,-1.8 3,-0.4 1,-0.3 -1,-0.2 0.692 100.0 61.9 -65.8 -13.8 -11.7 35.1 -32.3 441 139 B H T 3> + 0 0 4 -4,-0.4 4,-1.8 -3,-0.2 -1,-0.3 -0.036 64.0 119.4-100.3 31.6 -10.3 32.3 -30.3 442 140 B W H <> S+ 0 0 0 -3,-1.5 4,-2.5 1,-0.2 -1,-0.2 0.848 70.9 58.5 -64.3 -30.9 -10.7 29.8 -33.1 443 141 B A H > S+ 0 0 0 30,-0.5 4,-1.9 -3,-0.4 -1,-0.2 0.946 108.4 41.6 -63.9 -49.8 -7.0 29.2 -33.0 444 142 B G H > S+ 0 0 1 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.826 111.7 59.9 -65.2 -31.1 -6.8 28.1 -29.4 445 143 B Q H X S+ 0 0 15 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.956 104.5 47.2 -60.9 -51.2 -10.0 26.1 -30.1 446 144 B L H X S+ 0 0 1 -4,-2.5 4,-1.9 1,-0.2 3,-0.4 0.894 112.1 51.6 -56.9 -42.7 -8.3 24.0 -32.8 447 145 B A H X S+ 0 0 0 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.952 105.8 52.8 -59.5 -52.3 -5.3 23.4 -30.5 448 146 B H H X S+ 0 0 16 -4,-2.6 4,-1.8 85,-0.3 -1,-0.2 0.762 108.2 53.9 -56.8 -24.4 -7.5 22.3 -27.6 449 147 B A H X S+ 0 0 2 -4,-1.2 4,-1.3 -3,-0.4 -1,-0.2 0.918 107.8 47.2 -76.5 -44.4 -9.0 19.8 -30.0 450 148 B X H <>S+ 0 0 0 -4,-1.9 5,-2.8 1,-0.2 6,-0.9 0.721 114.0 50.4 -68.4 -21.8 -5.7 18.3 -31.1 451 149 B E H ><5S+ 0 0 85 -4,-1.7 3,-1.1 3,-0.2 -2,-0.2 0.899 108.1 48.1 -82.9 -46.0 -4.7 18.0 -27.5 452 150 B R H 3<5S+ 0 0 148 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.1 0.754 119.5 42.2 -66.6 -23.7 -7.8 16.3 -26.2 453 151 B D T 3<5S- 0 0 79 -4,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.371 105.6-138.6 -99.7 1.1 -7.4 13.9 -29.1 454 152 B D T < 5 + 0 0 105 -3,-1.1 -3,-0.2 1,-0.1 -4,-0.1 0.901 56.6 137.2 37.7 66.3 -3.7 13.7 -28.5 455 153 B R < + 0 0 83 -5,-2.8 2,-0.3 1,-0.2 -4,-0.1 0.581 63.2 19.5-111.7 -18.3 -2.9 13.9 -32.2 456 154 B Y - 0 0 7 -6,-0.9 -1,-0.2 -9,-0.1 -121,-0.2 -0.964 45.9-155.7-149.1 165.7 0.0 16.4 -32.1 457 155 B D S S+ 0 0 36 -123,-3.4 -153,-2.5 1,-0.4 2,-0.3 0.599 86.8 24.0-112.9 -26.3 2.6 18.0 -29.9 458 156 B V E -hj 304 335C 1 -124,-1.6 -122,-2.5 -155,-0.2 2,-0.5 -0.995 61.8-160.3-145.7 139.2 3.2 21.2 -31.8 459 157 B I E -hj 305 336C 0 -155,-1.5 -153,-1.9 -2,-0.3 2,-0.3 -0.982 9.5-152.5-124.4 126.0 1.2 23.2 -34.3 460 158 B F E -hj 306 337C 2 -124,-3.3 -122,-2.9 -2,-0.5 2,-0.5 -0.761 2.8-160.4 -95.9 141.7 2.7 25.7 -36.7 461 159 B F E - j 0 338C 3 -155,-1.3 2,-0.7 -2,-0.3 -153,-0.5 -0.926 4.9-163.3-123.4 104.4 0.6 28.6 -37.9 462 160 B D E - j 0 339C 1 -124,-2.1 -122,-1.2 -2,-0.5 -121,-0.3 -0.782 17.0-176.1 -90.0 118.2 2.0 30.2 -41.1 463 161 B V - 0 0 0 -2,-0.7 -122,-0.2 -155,-0.2 -155,-0.0 -0.454 21.5-106.4-106.7-179.0 0.5 33.6 -41.7 464 162 B G - 0 0 3 -124,-0.3 -154,-0.4 -2,-0.1 -151,-0.1 -0.393 37.0 -98.0 -98.1 179.7 0.7 36.3 -44.4 465 163 B P S S+ 0 0 34 0, 0.0 -152,-0.1 0, 0.0 -1,-0.1 0.713 93.3 103.7 -68.7 -21.4 2.5 39.7 -44.5 466 164 B S - 0 0 43 1,-0.1 -156,-0.1 -154,-0.1 -2,-0.1 -0.196 57.2-160.1 -61.0 150.1 -0.7 41.3 -43.6 467 165 B L + 0 0 13 -156,-0.1 -1,-0.1 4,-0.1 -156,-0.1 -0.289 47.1 121.0-129.6 53.2 -1.3 42.6 -40.0 468 166 B G S > S- 0 0 12 567,-0.0 4,-1.5 568,-0.0 568,-0.0 -0.089 80.5 -65.9 -98.4-163.2 -5.0 42.8 -39.9 469 167 B P H >> S+ 0 0 19 0, 0.0 4,-1.6 0, 0.0 3,-0.6 0.949 127.1 51.9 -52.0 -57.6 -7.8 41.3 -37.8 470 168 B F H >> S+ 0 0 2 -51,-0.5 3,-1.5 1,-0.3 4,-0.8 0.934 109.8 46.1 -45.4 -66.7 -7.3 37.7 -39.0 471 169 B N H >> S+ 0 0 0 1,-0.3 4,-1.5 2,-0.2 3,-0.5 0.781 107.9 60.5 -49.5 -30.6 -3.6 37.5 -38.3 472 170 B R H < S+ 0 0 0 -4,-1.5 3,-1.6 1,-0.2 -2,-0.2 0.789 100.8 65.6 -64.0 -27.6 -1.4 34.9 -32.6 476 174 B L H 3< S+ 0 0 22 -4,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.972 99.7 50.0 -57.8 -52.1 -4.1 34.6 -29.9 477 175 B G T 3< S+ 0 0 1 -4,-1.0 2,-0.3 -3,-0.2 -1,-0.3 0.256 98.7 103.8 -72.3 17.5 -4.1 30.8 -30.3 478 176 B C < - 0 0 1 -3,-1.6 -172,-0.2 1,-0.1 3,-0.1 -0.751 55.9-163.8-105.7 148.5 -0.3 30.9 -30.0 479 177 B D S S- 0 0 5 -174,-2.5 66,-1.1 1,-0.4 2,-0.3 0.769 80.6 -16.5 -92.8 -31.9 2.0 30.0 -27.2 480 178 B A E -im 306 545C 1 -175,-1.6 -173,-0.9 64,-0.2 -1,-0.4 -0.988 58.9-165.0-166.4 163.1 4.9 31.8 -28.7 481 179 B F E -im 307 546C 0 64,-1.7 66,-2.8 -2,-0.3 67,-0.5 -0.990 9.4-146.0-154.5 158.8 6.3 33.3 -31.9 482 180 B V E -im 308 548C 1 -175,-1.5 -173,-0.5 -2,-0.3 67,-0.2 -0.863 14.6-138.3-123.1 158.8 9.5 34.7 -33.5 483 181 B T E - m 0 549C 1 65,-2.1 67,-0.9 -2,-0.3 2,-0.2 -0.786 12.5-164.5-126.0 93.8 9.9 37.5 -36.0 484 182 B P E - m 0 550C 0 0, 0.0 2,-0.3 0, 0.0 -172,-0.3 -0.517 15.4-170.1 -73.7 137.0 12.3 37.1 -38.9 485 183 B T E - m 0 551C 2 65,-1.5 67,-2.0 -2,-0.2 7,-0.1 -0.792 29.3-131.5-123.6 168.8 13.3 40.3 -40.6 486 184 B A - 0 0 40 -2,-0.3 -1,-0.1 65,-0.2 6,-0.0 0.831 39.0-132.1 -88.4 -35.7 15.1 41.3 -43.8 487 185 B T + 0 0 24 1,-0.3 2,-0.3 64,-0.1 68,-0.1 0.965 58.6 99.3 80.7 81.3 17.5 43.9 -42.4 488 186 B D S > S- 0 0 54 1,-0.1 4,-2.9 68,-0.1 5,-0.3 -0.952 86.0 -71.2-177.2 169.4 17.6 47.1 -44.5 489 187 B L H > S+ 0 0 24 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.881 129.3 33.8 -40.5 -59.3 16.1 50.6 -44.6 490 188 B F H > S+ 0 0 10 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.964 116.7 51.7 -66.7 -53.2 12.6 49.5 -45.4 491 189 B S H > S+ 0 0 4 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.820 111.6 51.4 -53.4 -32.1 12.5 46.2 -43.5 492 190 B F H X S+ 0 0 41 -4,-2.9 4,-1.7 2,-0.2 -1,-0.2 0.961 108.2 47.6 -71.6 -50.1 13.7 48.1 -40.5 493 191 B H H X S+ 0 0 38 -4,-2.1 4,-0.5 -5,-0.3 -2,-0.2 0.752 115.1 51.3 -61.8 -19.1 11.0 50.9 -40.8 494 192 B A H >X S+ 0 0 2 -4,-1.9 4,-2.5 2,-0.2 3,-1.3 0.950 106.3 50.4 -78.3 -54.1 8.6 47.9 -41.2 495 193 B F H 3X S+ 0 0 4 -4,-2.8 4,-1.3 1,-0.3 -2,-0.2 0.711 108.1 55.4 -56.6 -25.3 9.8 46.0 -38.1 496 194 B G H 3X S+ 0 0 5 -4,-1.7 4,-1.1 2,-0.2 -1,-0.3 0.741 107.9 48.1 -81.5 -25.6 9.4 49.2 -36.1 497 195 B N H XX S+ 0 0 14 -3,-1.3 4,-2.9 -4,-0.5 3,-0.9 0.965 110.7 49.8 -74.9 -54.9 5.8 49.5 -37.1 498 196 B L H 3X S+ 0 0 1 -4,-2.5 4,-1.7 1,-0.3 -2,-0.2 0.845 109.3 54.2 -48.3 -38.5 5.1 45.8 -36.3 499 197 B A H 3X S+ 0 0 8 -4,-1.3 4,-1.5 -5,-0.2 -1,-0.3 0.868 112.6 41.4 -65.2 -38.9 6.7 46.5 -32.9 500 198 B R H X S+ 0 0 15 -4,-1.3 3,-2.0 2,-0.2 4,-1.9 0.961 109.3 48.6 -70.0 -52.0 -6.3 46.3 -26.5 509 207 B Y H 3X S+ 0 0 36 -4,-3.4 4,-2.2 1,-0.3 5,-0.2 0.803 100.8 65.4 -58.0 -29.9 -6.9 42.5 -26.4 510 208 B A H 3X S+ 0 0 58 -4,-1.7 4,-1.4 -5,-0.2 -1,-0.3 0.803 108.1 43.2 -60.5 -27.1 -5.9 42.6 -22.7 511 209 B E H < S+ 0 0 21 -4,-1.8 3,-0.9 2,-0.2 4,-0.4 0.903 108.8 52.4 -67.7 -45.1 -19.6 40.2 -18.7 520 218 B W H >X S+ 0 0 0 -4,-3.6 3,-2.0 1,-0.3 4,-1.1 0.932 103.1 57.7 -59.4 -47.3 -20.1 36.5 -19.3 521 219 B K H 3< S+ 0 0 92 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.755 93.4 72.8 -55.1 -24.3 -20.1 35.7 -15.7 522 220 B K T << S+ 0 0 106 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.724 115.3 14.3 -66.1 -23.6 -23.0 38.1 -15.3 523 221 B Y T <4 S+ 0 0 14 -3,-2.0 2,-0.4 -4,-0.4 -1,-0.2 0.358 117.0 65.3-135.4 8.6 -25.6 35.8 -16.9 524 222 B S < - 0 0 14 -4,-1.1 3,-0.2 1,-0.2 -1,-0.2 -0.997 49.2-164.8-137.4 136.6 -24.0 32.4 -17.1 525 223 B A S S+ 0 0 67 -2,-0.4 2,-1.8 1,-0.2 3,-0.4 0.958 85.3 59.3 -78.9 -57.7 -23.0 29.9 -14.4 526 224 B D > + 0 0 114 1,-0.2 4,-0.8 2,-0.1 -1,-0.2 -0.551 62.9 133.5 -77.9 84.0 -20.9 27.5 -16.4 527 225 B V H > S+ 0 0 7 -2,-1.8 4,-1.0 2,-0.2 -1,-0.2 0.840 70.3 50.2 -97.0 -49.7 -18.2 30.0 -17.6 528 226 B E H > S+ 0 0 115 -3,-0.4 4,-1.4 1,-0.2 -2,-0.1 0.762 110.9 58.0 -61.0 -22.4 -15.0 28.1 -16.9 529 227 B A H >4 S+ 0 0 52 2,-0.2 3,-0.6 1,-0.2 -1,-0.2 0.987 108.1 38.6 -71.2 -62.0 -16.8 25.3 -18.7 530 228 B K H 3< S+ 0 0 70 -4,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.543 116.7 58.6 -67.6 -5.3 -17.5 27.0 -22.1 531 229 B T H >< S+ 0 0 15 -4,-1.0 3,-2.4 2,-0.1 5,-0.4 0.785 85.1 72.2 -93.4 -35.8 -14.0 28.6 -21.7 532 230 B R T << S+ 0 0 172 -4,-1.4 4,-0.2 -3,-0.6 -2,-0.1 0.900 89.3 61.6 -50.0 -46.9 -11.7 25.6 -21.5 533 231 B P T 3 S+ 0 0 29 0, 0.0 2,-0.6 0, 0.0 -1,-0.3 0.619 95.9 74.6 -59.0 -7.0 -12.2 24.7 -25.2 534 232 B L S < S- 0 0 3 -3,-2.4 2,-3.8 -86,-0.1 -89,-0.1 -0.938 89.9-132.8-107.7 115.5 -10.6 28.1 -25.8 535 233 B R > - 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