==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 12-JUN-08 2VVW . COMPND 2 MOLECULE: PROTEIN A52; . SOURCE 2 ORGANISM_SCIENTIFIC: VACCINIA VIRUS; . AUTHOR S.C.GRAHAM,M.W.BAHAR,S.COORAY,R.A.-J.CHEN,D.M.WHALEN, . 300 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15497.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 229 76.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 9 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 174 58.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.7 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 0 0 0 3 1 2 1 1 0 0 0 4 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 40 A I 0 0 155 0, 0.0 273,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 128.7 30.2 1.0 29.6 2 41 A K - 0 0 93 1,-0.1 13,-0.1 13,-0.0 3,-0.0 -0.455 360.0-100.1 -84.3 156.9 31.6 -2.4 28.4 3 42 A P - 0 0 30 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.249 35.7-104.9 -69.6 165.7 35.3 -3.3 28.7 4 43 A D - 0 0 35 1,-0.1 3,-0.2 19,-0.0 16,-0.1 -0.764 26.4-154.3 -85.8 141.7 37.6 -3.0 25.7 5 44 A Y > + 0 0 0 -2,-0.4 3,-0.8 1,-0.1 36,-0.4 0.563 69.4 92.2 -98.0 -7.1 38.5 -6.4 24.3 6 45 A L T 3 S+ 0 0 3 1,-0.3 32,-2.5 31,-0.1 35,-0.2 0.905 108.7 15.0 -55.6 -48.4 41.9 -5.9 22.7 7 46 A E T 3 S+ 0 0 120 30,-0.3 -1,-0.3 -3,-0.2 32,-0.3 0.149 95.3 133.3-111.8 18.3 43.9 -6.9 25.8 8 47 A Y < - 0 0 35 -3,-0.8 32,-1.8 30,-0.2 33,-0.5 -0.497 35.9-168.8 -78.0 135.6 41.0 -8.6 27.7 9 48 A D + 0 0 70 30,-0.2 2,-0.1 -2,-0.2 -1,-0.1 0.479 60.0 58.2-104.2 -5.5 41.9 -12.0 29.2 10 49 A D - 0 0 65 29,-0.0 2,-0.2 2,-0.0 30,-0.1 -0.460 58.1-148.1-118.4-174.8 38.4 -13.3 30.2 11 50 A L + 0 0 3 -2,-0.1 2,-0.2 131,-0.1 134,-0.0 -0.680 30.7 176.8-155.9 94.2 35.0 -14.1 28.8 12 51 A L > - 0 0 72 -2,-0.2 3,-1.5 1,-0.1 130,-0.0 -0.513 45.4 -98.9-104.8 169.5 32.2 -13.4 31.4 13 52 A D T 3 S+ 0 0 142 1,-0.3 -1,-0.1 -2,-0.2 0, 0.0 0.886 122.4 51.6 -54.5 -42.2 28.4 -13.6 31.3 14 53 A R T 3 S+ 0 0 151 2,-0.1 2,-0.7 -12,-0.0 -1,-0.3 0.596 87.1 95.5 -70.8 -17.5 28.1 -9.9 30.7 15 54 A D S < S- 0 0 0 -3,-1.5 2,-0.4 -13,-0.1 3,-0.0 -0.730 75.1-138.6 -81.1 116.1 30.6 -9.9 27.8 16 55 A E > - 0 0 104 -2,-0.7 4,-2.1 1,-0.1 5,-0.2 -0.604 2.4-141.4 -82.8 129.1 28.5 -10.1 24.6 17 56 A M H > S+ 0 0 10 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 0.893 100.4 50.9 -56.8 -42.2 29.8 -12.4 21.9 18 57 A F H > S+ 0 0 46 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.923 110.0 49.3 -66.6 -39.6 28.8 -10.1 19.0 19 58 A T H > S+ 0 0 16 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.896 109.6 53.0 -61.7 -41.2 30.5 -7.0 20.6 20 59 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.927 111.5 45.1 -58.7 -46.8 33.6 -9.1 21.1 21 60 A L H X S+ 0 0 2 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.882 109.4 55.7 -67.8 -37.5 33.6 -10.1 17.4 22 61 A E H X S+ 0 0 68 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.946 112.9 41.9 -55.5 -50.2 32.9 -6.5 16.3 23 62 A E H X S+ 0 0 22 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.852 111.9 55.6 -68.9 -36.8 36.0 -5.3 18.3 24 63 A Y H X S+ 0 0 0 -4,-2.3 4,-2.7 -5,-0.2 5,-0.4 0.954 112.6 41.1 -59.0 -51.4 38.1 -8.3 17.1 25 64 A F H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.893 115.5 52.0 -66.3 -35.0 37.4 -7.5 13.4 26 65 A M H X S+ 0 0 9 -4,-2.2 4,-1.6 -5,-0.3 5,-0.3 0.965 115.9 39.2 -63.0 -52.2 37.9 -3.8 14.0 27 66 A Y H X>S+ 0 0 0 -4,-3.0 4,-2.7 2,-0.2 5,-1.0 0.897 121.2 42.2 -70.5 -42.6 41.2 -4.2 15.7 28 67 A R H X5S+ 0 0 2 -4,-2.7 4,-0.8 -5,-0.3 -1,-0.2 0.926 116.7 49.6 -68.1 -43.7 42.6 -6.9 13.5 29 68 A G H <5S+ 0 0 2 -4,-2.4 -2,-0.2 -5,-0.4 -1,-0.2 0.760 124.2 28.4 -64.5 -27.5 41.2 -5.2 10.4 30 69 A L H <5S+ 0 0 8 -4,-1.6 -2,-0.2 -5,-0.2 -3,-0.2 0.809 135.6 22.7-104.9 -39.4 42.7 -1.8 11.3 31 70 A L H <5S- 0 0 30 -4,-2.7 3,-0.3 -5,-0.3 -3,-0.2 0.701 91.7-152.3-100.4 -29.1 45.9 -2.6 13.4 32 71 A G << - 0 0 2 -5,-1.0 -1,-0.2 -4,-0.8 -2,-0.1 -0.365 38.4 -55.5 82.9-163.2 46.7 -6.1 12.3 33 72 A L S S+ 0 0 62 1,-0.2 2,-1.3 -2,-0.1 -1,-0.2 0.483 107.0 88.0-103.9 -6.1 48.5 -8.8 14.3 34 73 A R S S+ 0 0 128 -3,-0.3 2,-0.3 2,-0.1 -1,-0.2 -0.361 78.3 94.6 -84.8 53.9 51.8 -7.2 15.3 35 74 A I S S- 0 0 40 -2,-1.3 2,-0.4 -3,-0.1 229,-0.0 -0.985 88.1 -99.8-146.0 140.8 50.0 -6.0 18.4 36 75 A K - 0 0 70 -2,-0.3 2,-0.3 -29,-0.0 -2,-0.1 -0.568 43.9-172.4 -66.2 119.5 49.6 -7.3 21.9 37 76 A Y - 0 0 21 -2,-0.4 -30,-0.3 -4,-0.1 -31,-0.1 -0.830 19.6-119.7-107.8 153.7 46.3 -9.2 22.2 38 77 A G > - 0 0 5 -32,-2.5 4,-2.0 -33,-0.4 -29,-0.2 -0.124 39.7 -90.0 -78.8-176.9 44.7 -10.6 25.4 39 78 A R H > S+ 0 0 113 -32,-0.3 4,-1.7 2,-0.2 -30,-0.2 0.830 123.6 58.5 -65.7 -32.4 43.9 -14.2 25.9 40 79 A L H > S+ 0 0 0 -32,-1.8 4,-1.8 2,-0.2 3,-0.4 0.977 111.0 37.9 -64.1 -58.3 40.4 -13.7 24.5 41 80 A F H > S+ 0 0 0 -33,-0.5 4,-2.6 -36,-0.4 -1,-0.2 0.865 112.0 60.9 -58.5 -38.2 41.5 -12.5 21.1 42 81 A N H X S+ 0 0 61 -4,-2.0 4,-0.7 1,-0.2 -1,-0.2 0.853 106.2 46.7 -61.1 -32.1 44.4 -15.0 21.1 43 82 A E H >< S+ 0 0 9 -4,-1.7 3,-0.6 -3,-0.4 4,-0.4 0.907 111.1 50.4 -71.3 -42.5 41.8 -17.8 21.3 44 83 A I H >< S+ 0 0 0 -4,-1.8 3,-2.0 1,-0.2 -2,-0.2 0.890 103.4 61.2 -63.3 -36.9 39.7 -16.3 18.5 45 84 A K H >< S+ 0 0 71 -4,-2.6 3,-1.8 1,-0.3 -1,-0.2 0.807 91.3 67.0 -59.2 -30.6 42.8 -16.1 16.4 46 85 A K T XX S+ 0 0 103 -4,-0.7 3,-1.3 -3,-0.6 4,-0.6 0.721 81.1 78.9 -63.3 -20.1 43.2 -19.9 16.7 47 86 A F H <> S+ 0 0 0 -3,-2.0 4,-1.8 -4,-0.4 53,-0.3 0.641 74.1 78.7 -61.5 -15.5 40.0 -20.0 14.5 48 87 A D H <> S+ 0 0 29 -3,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.848 88.3 54.9 -61.7 -37.5 42.2 -19.3 11.5 49 88 A N H <> S+ 0 0 112 -3,-1.3 4,-2.0 -4,-0.2 -1,-0.2 0.913 106.8 50.2 -60.1 -46.0 43.3 -22.9 11.4 50 89 A D H X S+ 0 0 42 -4,-0.6 4,-2.4 1,-0.2 5,-0.2 0.896 109.9 52.0 -57.6 -44.3 39.7 -24.1 11.3 51 90 A A H X>S+ 0 0 4 -4,-1.8 4,-3.2 2,-0.2 5,-0.6 0.893 109.4 47.3 -59.4 -47.6 39.0 -21.7 8.4 52 91 A E H X5S+ 0 0 114 -4,-2.0 4,-1.1 3,-0.2 -1,-0.2 0.881 113.9 48.1 -67.0 -38.8 42.0 -22.9 6.3 53 92 A E H <5S+ 0 0 92 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.904 122.1 34.1 -66.6 -41.6 41.1 -26.6 6.8 54 93 A Q H <5S+ 0 0 74 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.875 134.4 20.0 -84.1 -39.0 37.4 -26.1 6.0 55 94 A F H <5S- 0 0 14 -4,-3.2 -3,-0.2 1,-0.3 2,-0.1 0.569 105.3-113.0-113.1 -15.1 37.5 -23.3 3.3 56 95 A G << - 0 0 21 -4,-1.1 -1,-0.3 -5,-0.6 -2,-0.1 -0.448 49.9 -32.7 106.4-178.5 41.0 -23.4 1.9 57 96 A T > - 0 0 49 -2,-0.1 4,-1.9 1,-0.1 3,-0.2 -0.324 49.5-120.4 -78.6 157.4 44.0 -21.1 1.9 58 97 A I H > S+ 0 0 46 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.845 113.5 59.3 -65.7 -30.7 43.8 -17.3 1.9 59 98 A E H > S+ 0 0 133 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.893 106.6 47.1 -65.8 -38.0 45.7 -17.3 -1.4 60 99 A E H > S+ 0 0 101 -3,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.917 115.9 44.4 -64.7 -45.3 43.1 -19.4 -3.1 61 100 A L H X S+ 0 0 3 -4,-1.9 4,-3.0 2,-0.2 6,-0.2 0.905 108.6 56.3 -68.8 -43.6 40.2 -17.3 -1.7 62 101 A K H <>S+ 0 0 101 -4,-3.1 5,-1.5 2,-0.2 4,-0.4 0.920 116.4 37.7 -51.9 -48.0 42.0 -14.0 -2.6 63 102 A Q H ><5S+ 0 0 149 -4,-1.6 3,-1.2 -5,-0.2 -2,-0.2 0.969 117.2 49.3 -66.8 -57.3 42.2 -15.1 -6.2 64 103 A K H 3<5S+ 0 0 93 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.851 122.8 32.9 -49.4 -46.4 38.8 -16.9 -6.4 65 104 A L T 3<5S- 0 0 13 -4,-3.0 -1,-0.3 -5,-0.2 10,-0.2 0.363 97.6-132.5 -97.6 3.3 36.9 -13.9 -4.9 66 105 A R T X 5 - 0 0 157 -3,-1.2 3,-2.1 -4,-0.4 6,-0.3 0.925 34.1-175.7 41.2 56.0 39.1 -11.1 -6.3 67 106 A L T 3 S+ 0 0 108 1,-0.2 4,-2.5 -5,-0.2 -1,-0.3 0.415 83.9 107.3 -94.8 1.2 33.7 -6.0 -6.2 72 111 A G H <> S+ 0 0 0 -3,-1.7 4,-2.0 -6,-0.3 -1,-0.2 0.783 76.8 48.2 -56.9 -40.9 35.7 -7.9 -3.6 73 112 A A H > S+ 0 0 4 -4,-0.3 4,-2.1 -3,-0.3 -1,-0.2 0.926 114.6 46.3 -67.3 -45.3 33.5 -7.3 -0.6 74 113 A D H > S+ 0 0 94 -4,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.864 111.0 53.1 -63.5 -38.7 30.3 -8.2 -2.5 75 114 A N H X S+ 0 0 37 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.873 108.2 51.7 -60.3 -40.7 32.1 -11.3 -3.8 76 115 A F H X S+ 0 0 0 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.932 110.4 46.8 -61.0 -47.1 33.0 -12.3 -0.2 77 116 A I H X S+ 0 0 12 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.910 110.5 52.8 -62.8 -42.8 29.3 -11.9 0.9 78 117 A D H X S+ 0 0 102 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.936 109.5 51.0 -56.8 -44.6 28.2 -14.0 -2.1 79 118 A Y H X S+ 0 0 14 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.866 105.8 53.3 -60.6 -42.7 30.7 -16.7 -1.1 80 119 A I H X S+ 0 0 1 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.900 109.0 50.4 -59.0 -43.6 29.4 -16.7 2.5 81 120 A K H X S+ 0 0 118 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.896 108.4 53.1 -62.2 -41.1 25.9 -17.3 1.1 82 121 A V H X S+ 0 0 54 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.956 109.4 47.7 -54.2 -54.0 27.2 -20.1 -1.0 83 122 A Q H X S+ 0 0 34 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.920 110.8 50.7 -59.5 -43.9 28.8 -21.9 2.0 84 123 A K H < S+ 0 0 108 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.896 112.0 48.6 -61.6 -37.5 25.6 -21.5 4.0 85 124 A Q H < S+ 0 0 164 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.871 112.9 46.9 -65.6 -39.0 23.7 -23.1 1.1 86 125 A D H < S+ 0 0 108 -4,-2.3 2,-0.5 -5,-0.1 -2,-0.2 0.702 90.0 91.9 -84.4 -19.3 26.2 -26.0 0.7 87 126 A I < - 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0 0 111 -2,-0.3 4,-2.1 1,-0.1 3,-0.3 -0.734 4.9-148.1 -86.6 123.5 23.5 10.0 14.1 168 56 B M H > S+ 0 0 6 -2,-0.5 4,-2.3 1,-0.2 5,-0.2 0.854 97.7 53.4 -58.6 -39.0 26.0 12.5 15.4 169 57 B F H > S+ 0 0 41 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.911 108.5 49.5 -65.2 -40.2 27.2 10.2 18.2 170 58 B T H > S+ 0 0 23 -3,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.900 109.2 52.8 -62.8 -42.5 27.8 7.3 15.7 171 59 B I H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.931 111.5 46.0 -55.8 -50.4 29.8 9.7 13.5 172 60 B L H X S+ 0 0 1 -4,-2.3 4,-2.6 2,-0.2 5,-0.3 0.886 109.5 54.6 -63.9 -39.8 32.0 10.7 16.4 173 61 B E H X S+ 0 0 69 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.963 113.2 42.3 -56.3 -50.9 32.4 7.1 17.5 174 62 B E H X S+ 0 0 20 -4,-2.6 4,-2.8 1,-0.2 5,-0.3 0.845 111.8 55.9 -64.5 -37.5 33.7 6.2 14.0 175 63 B Y H X S+ 0 0 0 -4,-2.6 4,-2.8 -5,-0.2 5,-0.4 0.943 111.8 41.3 -59.2 -50.7 35.8 9.4 13.8 176 64 B F H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.858 115.2 52.9 -68.5 -32.1 37.7 8.6 17.1 177 65 B M H X S+ 0 0 10 -4,-2.2 4,-2.1 -5,-0.3 5,-0.4 0.987 116.4 36.6 -64.0 -57.4 38.0 4.9 16.0 178 66 B Y H X>S+ 0 0 1 -4,-2.8 4,-2.7 2,-0.2 5,-1.3 0.930 122.9 42.7 -66.8 -44.5 39.5 5.6 12.6 179 67 B R H X5S+ 0 0 1 -4,-2.8 4,-0.6 -5,-0.3 -1,-0.2 0.934 117.5 48.7 -65.6 -41.7 41.6 8.6 13.7 180 68 B G H <5S+ 0 0 1 -4,-2.1 -2,-0.2 -5,-0.4 -1,-0.2 0.758 124.0 28.4 -69.3 -27.8 42.7 6.8 16.9 181 69 B L H <5S+ 0 0 7 -4,-2.1 -2,-0.2 -5,-0.1 -3,-0.2 0.781 134.3 24.8-103.9 -35.2 43.7 3.5 15.2 182 70 B L H <5S- 0 0 34 -4,-2.7 3,-0.4 -5,-0.4 -3,-0.2 0.767 92.4-149.6-101.5 -35.8 44.8 4.6 11.6 183 71 B G << - 0 0 2 -5,-1.3 -1,-0.2 -4,-0.6 3,-0.1 -0.393 39.8 -55.7 91.4-170.1 45.8 8.2 12.1 184 72 B L S S+ 0 0 59 1,-0.2 2,-0.5 -2,-0.1 -1,-0.2 0.372 106.9 91.8 -96.6 4.1 45.7 11.1 9.7 185 73 B R S S+ 0 0 247 -3,-0.4 2,-0.3 2,-0.1 -1,-0.2 -0.152 76.3 88.9 -86.4 44.0 47.7 9.5 6.8 186 74 B I S S- 0 0 44 -2,-0.5 2,-0.3 -3,-0.1 -73,-0.0 -0.961 88.4-100.3-141.1 144.5 44.4 8.3 5.3 187 75 B K - 0 0 103 -2,-0.3 2,-0.3 -29,-0.0 -2,-0.1 -0.573 40.1-165.0 -69.8 129.0 41.9 9.8 2.9 188 76 B Y - 0 0 16 -2,-0.3 -30,-0.3 -4,-0.1 -31,-0.1 -0.830 16.7-121.6-107.3 155.0 38.9 11.3 4.8 189 77 B G > - 0 0 3 -32,-2.3 4,-2.1 -33,-0.4 -29,-0.2 -0.242 42.6 -89.2 -81.2-179.8 35.6 12.3 3.3 190 78 B R H > S+ 0 0 52 -32,-0.2 4,-1.9 1,-0.2 -30,-0.2 0.843 124.9 57.9 -63.1 -32.8 34.2 15.8 3.6 191 79 B L H > S+ 0 0 0 -32,-1.9 4,-2.1 2,-0.2 3,-0.3 0.965 110.3 39.7 -61.5 -55.0 32.5 14.9 6.9 192 80 B F H > S+ 0 0 0 -33,-0.5 4,-2.4 -36,-0.4 -1,-0.2 0.844 112.5 58.6 -67.0 -32.1 35.6 13.8 8.8 193 81 B N H X S+ 0 0 66 -4,-2.1 4,-0.7 2,-0.2 -1,-0.2 0.853 106.5 47.7 -66.3 -33.2 37.5 16.7 7.1 194 82 B E H >< S+ 0 0 11 -4,-1.9 3,-0.8 -3,-0.3 4,-0.3 0.919 111.3 49.7 -67.9 -45.6 35.1 19.2 8.7 195 83 B I H >< S+ 0 0 0 -4,-2.1 3,-2.1 1,-0.2 4,-0.3 0.895 103.6 61.7 -61.1 -37.0 35.4 17.5 12.1 196 84 B K H >< S+ 0 0 75 -4,-2.4 3,-1.8 1,-0.3 4,-0.3 0.814 91.0 67.3 -56.8 -31.8 39.2 17.7 11.7 197 85 B K T XX S+ 0 0 95 -3,-0.8 3,-1.0 -4,-0.7 4,-0.7 0.651 81.7 77.0 -66.6 -14.6 38.9 21.5 11.6 198 86 B F H <> S+ 0 0 0 -3,-2.1 4,-1.9 -4,-0.3 53,-0.3 0.706 76.2 76.4 -67.1 -21.4 37.8 21.4 15.3 199 87 B D H <> S+ 0 0 26 -3,-1.8 4,-2.1 -4,-0.3 -1,-0.2 0.825 89.1 57.0 -57.0 -35.7 41.5 20.8 16.2 200 88 B N H <> S+ 0 0 104 -3,-1.0 4,-1.7 -4,-0.3 -1,-0.2 0.940 106.8 47.6 -63.1 -45.8 42.1 24.5 15.6 201 89 B D H X S+ 0 0 48 -4,-0.7 4,-2.5 1,-0.2 5,-0.2 0.872 110.0 54.2 -59.9 -42.2 39.4 25.5 18.1 202 90 B A H X>S+ 0 0 2 -4,-1.9 4,-3.0 1,-0.2 5,-0.5 0.915 106.8 49.4 -59.8 -47.1 40.9 23.0 20.7 203 91 B E H X5S+ 0 0 105 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.887 113.4 48.0 -62.0 -37.8 44.4 24.5 20.5 204 92 B E H <5S+ 0 0 167 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.917 119.4 36.2 -70.5 -43.4 42.9 28.0 20.9 205 93 B Q H <5S+ 0 0 73 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.866 134.0 21.0 -79.4 -38.3 40.7 27.1 23.9 206 94 B F H <5S- 0 0 21 -4,-3.0 -3,-0.2 1,-0.3 -2,-0.2 0.507 106.0-115.9-114.0 -7.2 42.9 24.6 25.8 207 95 B G << - 0 0 23 -4,-1.4 -1,-0.3 -5,-0.5 -2,-0.1 -0.400 53.7 -26.8 99.1-177.7 46.4 25.2 24.5 208 96 B T > - 0 0 36 1,-0.1 4,-1.9 -2,-0.1 5,-0.1 -0.328 51.1-125.8 -71.7 152.8 48.9 23.2 22.5 209 97 B I H > S+ 0 0 34 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.843 111.1 60.6 -65.0 -32.1 48.8 19.4 22.6 210 98 B E H > S+ 0 0 127 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.959 106.5 44.4 -60.7 -49.5 52.5 19.5 23.6 211 99 B E H > S+ 0 0 126 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.897 116.0 47.8 -60.2 -42.5 51.7 21.4 26.8 212 100 B L H X S+ 0 0 7 -4,-1.9 4,-2.8 2,-0.2 6,-0.3 0.888 106.1 57.6 -65.7 -41.8 48.7 19.2 27.5 213 101 B K H X>S+ 0 0 81 -4,-3.2 5,-1.4 2,-0.2 4,-0.6 0.914 114.2 39.0 -53.5 -45.5 50.8 16.0 26.9 214 102 B Q H ><5S+ 0 0 134 -4,-1.9 3,-0.7 -5,-0.2 -2,-0.2 0.947 115.2 50.9 -73.4 -48.5 53.2 17.2 29.6 215 103 B K H 3<5S+ 0 0 149 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.926 121.8 32.3 -53.9 -49.3 50.6 18.6 32.0 216 104 B L H 3<5S- 0 0 12 -4,-2.8 -1,-0.2 -5,-0.2 10,-0.2 0.442 97.7-131.2 -91.9 -0.0 48.5 15.4 32.0 217 105 B R T X<5 - 0 0 144 -3,-0.7 3,-2.3 -4,-0.6 6,-0.3 0.940 34.1-174.7 46.3 51.9 51.3 12.9 31.5 218 106 B L T 3 S+ 0 0 76 -5,-0.2 4,-2.7 1,-0.2 -1,-0.3 0.364 84.0 107.3 -96.7 1.3 47.4 7.2 34.6 223 111 B G H <> S+ 0 0 0 -3,-1.4 4,-2.0 -6,-0.3 -1,-0.2 0.796 77.6 46.8 -54.5 -41.9 47.2 9.3 31.4 224 112 B A H > S+ 0 0 4 -4,-0.3 4,-2.1 -3,-0.2 -1,-0.2 0.875 114.6 47.7 -71.0 -39.0 43.7 8.4 30.3 225 113 B D H > S+ 0 0 99 -3,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.881 110.4 53.0 -67.6 -39.2 42.3 9.0 33.8 226 114 B N H X S+ 0 0 52 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.898 108.6 50.3 -61.0 -41.4 44.2 12.3 33.9 227 115 B F H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.921 110.3 49.0 -61.6 -45.8 42.5 13.3 30.6 228 116 B I H X S+ 0 0 13 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.914 110.8 50.4 -61.5 -42.1 39.0 12.4 32.0 229 117 B D H X S+ 0 0 97 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.937 108.9 52.4 -59.9 -47.0 39.7 14.4 35.1 230 118 B Y H X S+ 0 0 16 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.908 109.2 49.1 -54.1 -47.2 40.8 17.3 33.0 231 119 B I H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.879 109.8 51.5 -61.9 -39.7 37.5 17.1 31.0 232 120 B K H X S+ 0 0 115 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.865 107.0 53.9 -64.1 -37.1 35.5 17.0 34.3 233 121 B V H X S+ 0 0 57 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.904 110.3 46.9 -62.4 -42.8 37.3 20.1 35.5 234 122 B Q H X S+ 0 0 39 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.942 113.1 48.2 -64.6 -47.8 36.3 21.9 32.3 235 123 B K H < S+ 0 0 96 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.886 115.1 46.7 -59.2 -41.5 32.7 20.7 32.6 236 124 B Q H < S+ 0 0 156 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.898 119.2 39.0 -64.0 -41.8 32.7 21.8 36.3 237 125 B D H < S+ 0 0 106 -4,-2.3 2,-0.4 -5,-0.1 -2,-0.2 0.784 84.7 94.1 -92.7 -30.3 34.2 25.2 35.6 238 126 B I < - 0 0 37 -4,-2.6 3,-0.4 -5,-0.2 -4,-0.0 -0.517 62.4-155.5 -67.2 120.0 32.8 26.6 32.4 239 127 B V S S+ 0 0 151 -2,-0.4 2,-0.5 1,-0.3 -1,-0.2 0.950 80.3 17.7 -68.7 -51.6 29.9 28.7 33.7 240 128 B K S S- 0 0 76 -3,-0.1 -1,-0.3 2,-0.0 2,-0.2 -0.893 83.7-145.8-125.9 97.1 27.7 28.7 30.6 241 129 B L - 0 0 43 -2,-0.5 2,-0.3 -3,-0.4 -6,-0.0 -0.423 17.3-165.6 -65.7 129.7 28.6 25.9 28.2 242 130 B T >> - 0 0 59 -2,-0.2 4,-1.7 1,-0.1 3,-0.7 -0.745 37.2-107.9-110.9 162.6 28.3 26.7 24.5 243 131 B V H 3> S+ 0 0 5 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.835 121.6 59.0 -54.9 -29.3 28.2 24.4 21.4 244 132 B Y H 3> S+ 0 0 118 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.829 99.7 53.9 -74.8 -30.6 31.7 26.0 20.7 245 133 B D H <> S+ 0 0 21 -3,-0.7 4,-2.0 2,-0.2 -1,-0.2 0.910 112.1 46.6 -59.8 -43.0 33.1 24.7 24.0 246 134 B C H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.892 110.3 51.5 -69.7 -42.0 31.9 21.3 22.8 247 135 B I H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.933 111.9 47.3 -56.3 -48.1 33.4 21.7 19.4 248 136 B S H X S+ 0 0 6 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.866 109.9 53.6 -62.3 -37.2 36.7 22.7 21.0 249 137 B M H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.895 105.6 52.4 -66.9 -39.9 36.4 19.7 23.3 250 138 B I H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.948 110.7 49.1 -57.9 -46.1 35.9 17.3 20.3 251 139 B G H X S+ 0 0 0 -4,-2.0 4,-2.2 -53,-0.3 -2,-0.2 0.840 109.0 52.2 -60.0 -37.7 39.1 18.8 18.8 252 140 B L H X S+ 0 0 4 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.931 108.2 50.5 -66.9 -44.2 41.0 18.3 22.1 253 141 B C H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.834 110.2 51.9 -58.7 -35.6 40.0 14.6 22.2 254 142 B A H X S+ 0 0 0 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.909 110.4 46.0 -70.7 -45.3 41.2 14.2 18.6 255 143 B C H X S+ 0 0 23 -4,-2.2 4,-0.9 1,-0.2 -2,-0.2 0.819 114.2 50.1 -65.4 -32.9 44.6 15.8 19.4 256 144 B V H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 3,-0.4 0.885 104.6 56.0 -71.1 -42.5 44.8 13.6 22.5 257 145 B V H X S+ 0 0 2 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.872 102.9 58.3 -62.5 -31.6 43.9 10.4 20.6 258 146 B D H X S+ 0 0 26 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.878 103.7 51.0 -58.7 -43.4 46.9 11.2 18.3 259 147 B V H X S+ 0 0 12 -4,-0.9 4,-1.1 -3,-0.4 -2,-0.2 0.958 112.5 46.4 -62.2 -46.6 49.3 11.1 21.2 260 148 B W H <>S+ 0 0 1 -4,-1.9 5,-2.8 1,-0.2 4,-0.4 0.876 111.9 50.4 -64.4 -39.6 48.0 7.8 22.4 261 149 B R H ><5S+ 0 0 37 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.927 107.6 52.9 -64.2 -46.5 48.1 6.3 18.9 262 150 B N H 3<5S+ 0 0 111 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.735 111.6 47.2 -59.1 -26.1 51.7 7.4 18.4 263 151 B E T 3<5S- 0 0 102 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.463 116.2-116.8 -92.3 -4.7 52.6 5.6 21.6 264 152 B K T < 5S+ 0 0 143 -3,-1.6 2,-1.3 -4,-0.4 3,-0.2 0.699 71.9 137.2 68.9 26.9 50.6 2.4 20.6 265 153 B L > < + 0 0 50 -5,-2.8 3,-1.8 1,-0.2 4,-0.2 -0.486 25.1 163.1 -92.3 62.9 48.1 2.8 23.4 266 154 B F G > + 0 0 25 -2,-1.3 3,-1.5 1,-0.3 -1,-0.2 0.824 59.5 59.2 -61.9 -39.6 45.5 1.9 20.9 267 155 B S G > S+ 0 0 30 1,-0.3 3,-1.4 -3,-0.2 -1,-0.3 0.612 85.0 81.4 -66.4 -13.7 42.6 1.0 23.2 268 156 B R G X> + 0 0 30 -3,-1.8 3,-2.1 1,-0.3 4,-0.6 0.682 66.2 85.2 -69.9 -16.5 42.6 4.5 24.8 269 157 B W H X> S+ 0 0 13 -3,-1.5 3,-1.0 1,-0.3 4,-0.8 0.810 77.7 70.9 -51.2 -27.4 40.6 5.9 22.0 270 158 B K H X> S+ 0 0 46 -3,-1.4 4,-1.6 1,-0.2 3,-0.5 0.813 87.0 63.6 -59.1 -32.4 37.6 4.6 24.0 271 159 B Y H <> S+ 0 0 74 -3,-2.1 4,-3.1 1,-0.2 -1,-0.2 0.816 91.4 64.0 -64.0 -31.5 38.2 7.3 26.6 272 160 B C H - 0 0 93 -2,-0.6 4,-2.4 -3,-0.1 5,-0.2 -0.141 39.7 -93.8 -76.9 179.7 24.6 16.3 25.9 282 170 B D H > S+ 0 0 123 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.863 125.1 56.7 -66.4 -33.7 22.1 15.4 23.2 283 171 B H H > S+ 0 0 122 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.922 110.5 43.9 -60.7 -45.1 21.0 19.0 22.8 284 172 B M H > S+ 0 0 21 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.870 109.3 56.1 -71.2 -37.4 24.6 20.0 22.1 285 173 B L H X S+ 0 0 12 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.918 107.1 51.3 -56.5 -43.2 25.2 17.0 19.7 286 174 B D H X S+ 0 0 99 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.900 110.2 48.8 -60.9 -39.8 22.2 18.3 17.7 287 175 B K H X S+ 0 0 91 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.904 110.9 49.2 -68.5 -40.7 23.7 21.8 17.6 288 176 B I H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.907 109.5 53.6 -62.1 -44.3 27.1 20.5 16.5 289 177 B K H X S+ 0 0 26 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.923 108.9 48.0 -53.8 -50.5 25.3 18.4 13.8 290 178 B S H X S+ 0 0 59 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.866 110.5 52.0 -61.7 -39.2 23.5 21.5 12.4 291 179 B I H X S+ 0 0 25 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.949 111.1 47.0 -60.5 -50.0 26.8 23.4 12.4 292 180 B L H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.906 110.4 52.8 -59.4 -42.6 28.5 20.7 10.4 293 181 B Q H X S+ 0 0 40 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.938 110.9 46.9 -60.0 -46.8 25.5 20.4 8.0 294 182 B N H X S+ 0 0 113 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.914 112.4 49.9 -60.7 -43.4 25.7 24.2 7.3 295 183 B R H X S+ 0 0 77 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.865 110.5 49.3 -64.5 -38.4 29.5 24.1 6.8 296 184 B L H X S+ 0 0 3 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.902 109.2 52.3 -68.4 -41.2 29.3 21.2 4.4 297 185 B V H X S+ 0 0 62 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.908 110.3 49.4 -57.2 -40.7 26.6 23.0 2.4 298 186 B Y H < S+ 0 0 191 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.893 109.1 51.5 -68.0 -39.2 29.0 26.0 2.2 299 187 B V H < S+ 0 0 68 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.914 112.0 47.4 -60.7 -44.6 31.8 23.7 1.1 300 188 B E H < 0 0 108 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.963 360.0 360.0 -58.5 -52.1 29.6 22.4 -1.7 301 189 B M < 0 0 179 -4,-2.7 -3,-0.1 -5,-0.2 -4,-0.0 0.670 360.0 360.0 -95.3 360.0 28.5 25.8 -2.7