==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-APR-12 4EKS . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.MERSKI,B.K.SHOICHET . 349 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17711.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 244 69.9 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 . 22 6.3 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 1.1 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 . 13 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 175 50.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 4 0 2 4 4 0 0 2 2 2 0 0 0 0 0 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 . 2 1 3 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 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 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 -10 A P 0 0 138 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 139.8 27.2 -4.1 12.5 2 -9 A T > - 0 0 79 1,-0.1 4,-2.1 0, 0.0 5,-0.2 -0.282 360.0-100.2 -77.3 170.0 27.6 -5.0 16.2 3 -8 A T H > S+ 0 0 106 1,-0.2 4,-1.3 2,-0.2 3,-0.2 0.951 128.9 51.1 -54.3 -47.4 25.0 -6.9 18.2 4 -7 A E H >> S+ 0 0 73 1,-0.2 4,-1.0 2,-0.2 3,-0.6 0.929 107.5 51.9 -56.6 -48.4 24.0 -3.5 19.6 5 -6 A N H 3> S+ 0 0 82 1,-0.3 4,-0.5 2,-0.2 3,-0.4 0.853 106.9 52.9 -54.5 -40.2 23.7 -1.9 16.0 6 -5 A L H 3< S+ 0 0 116 -4,-2.1 3,-0.3 1,-0.2 4,-0.3 0.755 105.9 55.6 -71.6 -22.9 21.4 -4.7 14.9 7 -4 A Y H XX S+ 0 0 176 -4,-1.3 3,-1.3 -3,-0.6 4,-0.6 0.773 88.2 81.2 -76.1 -23.1 19.2 -4.0 17.9 8 -3 A F H >X S+ 0 0 56 -4,-1.0 3,-1.3 -3,-0.4 4,-1.0 0.833 83.9 56.9 -57.1 -35.7 18.9 -0.3 16.8 9 -2 A Q H 3< S+ 0 0 132 -4,-0.5 3,-0.3 -3,-0.3 -1,-0.3 0.847 102.3 57.2 -69.0 -24.6 16.2 -0.9 14.2 10 -1 A G H <4 S+ 0 0 70 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.628 104.7 51.9 -74.4 -14.4 14.0 -2.4 16.9 11 0 A S H << S+ 0 0 63 -3,-1.3 2,-0.4 -4,-0.6 -1,-0.2 0.646 98.2 81.8 -93.0 -21.1 14.3 0.8 19.0 12 1 A M < + 0 0 16 -4,-1.0 2,-0.3 -3,-0.3 157,-0.0 -0.715 50.3 140.9 -91.1 135.3 13.2 2.9 16.1 13 2 A N > - 0 0 63 -2,-0.4 4,-2.4 95,-0.0 5,-0.2 -0.890 67.0 -77.2-153.6-177.6 9.5 3.4 15.1 14 3 A I H > S+ 0 0 16 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.868 127.6 51.6 -57.7 -39.6 7.3 6.3 13.9 15 4 A F H > S+ 0 0 70 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.946 112.7 43.6 -63.2 -48.7 7.1 7.8 17.4 16 5 A E H > S+ 0 0 93 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.860 114.4 53.4 -63.9 -34.8 10.9 7.8 17.9 17 6 A M H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 3,-0.4 0.969 112.9 39.8 -63.7 -55.5 11.3 9.1 14.4 18 7 A L H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 5,-0.5 0.865 109.0 62.7 -67.3 -31.9 9.0 12.1 14.7 19 8 A R H X S+ 0 0 99 -4,-2.3 4,-1.6 -5,-0.3 -1,-0.2 0.895 108.5 42.8 -58.6 -37.9 10.3 12.8 18.2 20 9 A I H < S+ 0 0 39 -4,-1.5 -2,-0.2 -3,-0.4 -1,-0.2 0.930 117.3 45.3 -72.8 -43.2 13.7 13.4 16.7 21 10 A D H < S+ 0 0 13 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.868 125.9 29.8 -68.1 -34.8 12.5 15.4 13.7 22 11 A E H < S- 0 0 24 -4,-3.0 19,-0.4 1,-0.2 -1,-0.2 0.677 94.8-150.1-100.6 -22.7 10.1 17.6 15.8 23 12 A G < - 0 0 21 -4,-1.6 2,-0.4 -5,-0.5 -1,-0.2 -0.227 25.3 -85.1 73.5-172.1 11.8 17.7 19.1 24 13 A L + 0 0 50 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.965 45.5 172.2-140.8 116.2 9.8 18.1 22.4 25 14 A R E -A 39 0A 122 14,-2.2 14,-2.1 -2,-0.4 4,-0.1 -0.991 20.6-165.1-128.5 133.4 8.8 21.5 23.7 26 15 A L E S+ 0 0 50 -2,-0.4 43,-2.6 12,-0.2 2,-0.3 0.538 75.4 58.5 -96.6 -6.9 6.5 22.0 26.7 27 16 A K E S-C 68 0B 65 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.895 98.8 -90.3-120.7 151.7 5.8 25.7 25.9 28 17 A I E + 0 0 30 39,-1.9 2,-0.3 -2,-0.3 10,-0.2 -0.344 56.1 165.2 -56.5 132.5 4.3 27.3 22.8 29 18 A Y E -A 37 0A 38 8,-2.7 8,-3.3 6,-0.1 2,-0.5 -0.919 38.8-103.7-142.2 168.5 7.1 28.2 20.4 30 19 A K E -A 36 0A 103 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.844 35.0-134.8 -97.8 133.2 7.3 29.2 16.7 31 20 A D > - 0 0 21 4,-2.4 3,-3.4 -2,-0.5 -1,-0.0 -0.138 40.9 -80.5 -77.1 179.6 8.4 26.6 14.2 32 21 A a T 3 S+ 0 0 75 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.641 135.8 46.7 -59.3 -15.7 11.0 27.1 11.4 33 22 A E T 3 S- 0 0 88 2,-0.1 -1,-0.3 120,-0.1 -2,-0.0 0.309 123.7-104.7-104.5 1.9 8.2 28.7 9.3 34 23 A G S < S+ 0 0 36 -3,-3.4 2,-0.4 1,-0.3 -2,-0.1 0.657 72.1 141.7 85.6 18.2 7.0 30.8 12.2 35 24 A Y - 0 0 76 1,-0.1 -4,-2.4 9,-0.0 -1,-0.3 -0.797 60.2-104.9 -96.3 132.9 3.8 28.9 13.1 36 25 A Y E +A 30 0A 30 -2,-0.4 8,-2.5 11,-0.4 9,-1.0 -0.319 52.6 169.9 -56.9 127.8 2.8 28.4 16.8 37 26 A T E -AB 29 43A 3 -8,-3.3 -8,-2.7 6,-0.2 2,-0.3 -0.916 15.2-178.5-141.1 155.6 3.7 24.9 17.8 38 27 A I E > + B 0 42A 0 4,-1.9 4,-2.3 -2,-0.3 2,-0.2 -0.968 51.0 5.0-148.9 165.8 3.9 22.8 21.0 39 28 A G E 4 S-A 25 0A 0 -14,-2.1 -14,-2.2 -2,-0.3 2,-0.8 -0.379 123.6 -10.4 69.4-128.5 4.7 19.4 22.2 40 29 A I T 4 S- 0 0 6 34,-0.4 -1,-0.2 -16,-0.2 -16,-0.1 -0.773 128.8 -48.0-112.3 80.2 6.1 17.1 19.5 41 30 A G T 4 S+ 0 0 12 -2,-0.8 2,-1.0 -19,-0.4 -2,-0.2 0.704 83.8 161.6 69.6 23.9 5.5 19.1 16.4 42 31 A H E < -B 38 0A 29 -4,-2.3 -4,-1.9 -20,-0.1 2,-0.5 -0.666 30.6-148.7 -80.5 105.1 1.9 19.9 17.2 43 32 A L E -B 37 0A 71 -2,-1.0 -6,-0.2 -6,-0.2 3,-0.1 -0.610 13.4-172.3 -70.8 121.0 0.9 22.8 15.0 44 33 A L - 0 0 9 -8,-2.5 2,-0.3 -2,-0.5 -1,-0.2 0.894 59.9 -34.0 -84.5 -40.6 -1.6 24.8 17.0 45 34 A T - 0 0 24 -9,-1.0 -1,-0.4 2,-0.1 -9,-0.3 -0.962 39.2-128.9-171.0 161.6 -2.6 27.3 14.3 46 35 A K S S+ 0 0 111 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.577 76.6 110.3 -98.5 -12.0 -1.2 29.2 11.4 47 36 A S S S- 0 0 41 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.310 70.4-137.4 -58.5 141.6 -2.6 32.5 12.7 48 37 A P S S+ 0 0 116 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 0.469 76.2 105.4 -79.8 -3.5 0.0 34.9 14.0 49 38 A D >> - 0 0 86 1,-0.2 4,-1.5 2,-0.0 3,-1.3 -0.716 58.8-159.9 -83.4 110.3 -2.2 35.6 17.1 50 39 A L H 3> S+ 0 0 62 -2,-0.8 4,-2.9 1,-0.3 5,-0.2 0.842 92.4 62.5 -56.3 -35.8 -0.7 33.9 20.1 51 40 A N H 3> S+ 0 0 111 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.807 102.4 50.5 -60.7 -29.1 -4.2 34.2 21.8 52 41 A A H <> S+ 0 0 28 -3,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.901 110.3 49.3 -72.4 -40.1 -5.5 32.0 19.0 53 42 A A H X S+ 0 0 0 -4,-1.5 4,-2.4 1,-0.2 -2,-0.2 0.916 111.1 49.0 -66.0 -43.1 -2.7 29.5 19.6 54 43 A K H X S+ 0 0 59 -4,-2.9 4,-2.3 1,-0.2 11,-0.2 0.870 109.8 52.5 -65.4 -36.7 -3.4 29.4 23.3 55 44 A S H X S+ 0 0 81 -4,-1.5 4,-1.8 -5,-0.2 -1,-0.2 0.930 109.7 47.9 -63.6 -46.0 -7.1 28.9 22.6 56 45 A E H X S+ 0 0 96 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.894 109.8 54.9 -59.6 -41.2 -6.3 25.9 20.4 57 46 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.4 0.950 107.7 46.7 -58.6 -53.3 -4.0 24.5 23.1 58 47 A D H X S+ 0 0 48 -4,-2.3 4,-2.1 1,-0.2 5,-0.4 0.849 113.7 50.1 -61.2 -34.3 -6.6 24.6 25.8 59 48 A K H < S+ 0 0 76 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.919 113.6 45.0 -65.3 -43.7 -9.1 23.0 23.4 60 49 A A H < S+ 0 0 34 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.849 122.8 34.5 -72.9 -36.7 -6.6 20.2 22.5 61 50 A I H < S- 0 0 34 -4,-2.8 -3,-0.2 2,-0.2 -1,-0.2 0.794 101.3-130.3 -88.3 -34.1 -5.5 19.5 26.0 62 51 A G S < S+ 0 0 65 -4,-2.1 2,-0.3 -5,-0.4 -3,-0.2 0.637 73.8 71.2 93.0 16.8 -8.8 20.1 27.7 63 52 A R S S- 0 0 103 -5,-0.4 2,-1.1 -6,-0.2 -1,-0.3 -0.934 96.3 -79.6-148.5 172.3 -7.7 22.4 30.5 64 53 A N + 0 0 127 -2,-0.3 -9,-0.1 1,-0.2 -10,-0.0 -0.676 53.3 163.7 -76.9 99.9 -6.4 25.9 31.1 65 54 A C > - 0 0 9 -2,-1.1 3,-1.5 -11,-0.2 -1,-0.2 0.684 32.5-148.3 -92.5 -20.5 -2.7 25.5 30.0 66 55 A N T 3 S- 0 0 112 1,-0.3 -2,-0.1 -12,-0.1 3,-0.1 0.935 76.7 -50.1 41.9 51.7 -1.7 29.1 29.6 67 56 A G T 3 S+ 0 0 7 -13,-0.2 -39,-1.9 1,-0.1 2,-0.4 0.515 120.7 98.1 77.1 7.4 0.7 28.0 26.9 68 57 A V B < +C 27 0B 71 -3,-1.5 2,-0.3 -41,-0.2 -41,-0.2 -0.988 44.1 178.4-133.8 138.7 2.4 25.2 28.9 69 58 A I - 0 0 7 -43,-2.6 2,-0.2 -2,-0.4 -30,-0.1 -0.824 26.5-107.4-129.5 170.5 1.9 21.5 29.0 70 59 A T > - 0 0 64 -2,-0.3 4,-2.3 1,-0.1 5,-0.1 -0.479 31.9-111.2 -89.7 165.5 3.3 18.4 30.7 71 60 A K H > S+ 0 0 121 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.892 121.2 51.7 -59.6 -42.8 5.5 15.6 29.1 72 61 A D H > S+ 0 0 126 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.878 110.0 48.8 -63.1 -37.7 2.6 13.2 29.5 73 62 A E H > S+ 0 0 40 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.897 108.6 53.2 -69.2 -39.8 0.3 15.7 27.7 74 63 A A H X S+ 0 0 1 -4,-2.3 4,-2.3 1,-0.2 -34,-0.4 0.902 110.0 49.1 -56.9 -43.6 2.7 16.2 24.9 75 64 A E H X S+ 0 0 107 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.878 109.5 50.3 -69.6 -38.2 2.8 12.4 24.4 76 65 A K H X S+ 0 0 126 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.943 113.3 45.7 -63.5 -45.4 -0.9 12.0 24.3 77 66 A L H X S+ 0 0 5 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.886 112.2 52.6 -63.0 -40.6 -1.3 14.8 21.8 78 67 A F H X S+ 0 0 13 -4,-2.3 4,-2.8 -5,-0.2 5,-0.2 0.934 107.4 50.7 -60.7 -47.6 1.5 13.3 19.8 79 68 A N H X S+ 0 0 73 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.911 110.9 49.5 -58.3 -43.2 -0.1 9.9 19.8 80 69 A Q H X S+ 0 0 83 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.907 111.3 49.0 -61.1 -42.8 -3.4 11.5 18.5 81 70 A D H X S+ 0 0 37 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.877 111.1 49.5 -66.1 -39.6 -1.5 13.4 15.8 82 71 A V H X S+ 0 0 1 -4,-2.8 4,-2.4 2,-0.2 5,-0.2 0.951 111.0 49.6 -64.0 -46.7 0.3 10.2 14.6 83 72 A D H X S+ 0 0 72 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.894 109.1 53.1 -59.3 -39.3 -3.0 8.3 14.5 84 73 A A H X S+ 0 0 41 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.882 109.2 48.5 -64.7 -38.4 -4.5 11.1 12.5 85 74 A A H X S+ 0 0 6 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.916 113.1 47.3 -67.9 -43.7 -1.7 10.9 9.9 86 75 A V H X S+ 0 0 35 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.946 113.6 47.4 -62.5 -49.1 -2.0 7.2 9.6 87 76 A R H X S+ 0 0 132 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.872 108.7 56.7 -57.7 -38.2 -5.8 7.4 9.3 88 77 A G H < S+ 0 0 1 -4,-2.1 4,-0.4 -5,-0.2 -1,-0.2 0.873 110.2 43.7 -64.9 -35.5 -5.3 10.2 6.7 89 78 A I H >< S+ 0 0 4 -4,-1.9 3,-1.2 -3,-0.2 7,-0.4 0.943 111.9 51.7 -70.4 -47.9 -3.2 7.9 4.5 90 79 A L H 3< S+ 0 0 72 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.767 110.6 46.9 -68.8 -24.9 -5.3 4.8 4.8 91 80 A R T 3< S+ 0 0 184 -4,-1.6 2,-0.5 -5,-0.2 -1,-0.3 0.575 93.3 94.5 -91.6 -5.1 -8.6 6.5 3.8 92 81 A N <> - 0 0 42 -3,-1.2 4,-2.6 -4,-0.4 -4,-0.0 -0.734 65.6-149.6 -96.0 126.7 -7.0 8.3 0.8 93 82 A A T 4 S+ 0 0 95 -2,-0.5 -1,-0.1 1,-0.2 -4,-0.0 0.722 97.0 44.3 -68.8 -21.1 -7.4 6.6 -2.6 94 83 A K T > S+ 0 0 93 2,-0.1 4,-0.7 3,-0.1 -1,-0.2 0.875 119.1 38.0 -87.0 -46.3 -4.1 8.1 -3.8 95 84 A L H > S+ 0 0 9 -7,-0.2 4,-2.8 1,-0.2 5,-0.2 0.854 103.7 66.7 -77.6 -35.7 -1.9 7.6 -0.8 96 85 A K H X S+ 0 0 79 -4,-2.6 4,-3.1 -7,-0.4 5,-0.2 0.893 99.9 48.4 -58.0 -46.0 -3.0 4.2 0.4 97 86 A P H > S+ 0 0 54 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.868 114.7 47.0 -63.2 -37.5 -1.8 2.1 -2.6 98 87 A V H X S+ 0 0 7 -4,-0.7 4,-0.8 2,-0.2 3,-0.2 0.931 113.2 47.9 -67.2 -45.3 1.6 3.8 -2.4 99 88 A Y H >< S+ 0 0 34 -4,-2.8 3,-1.5 1,-0.2 -1,-0.2 0.938 109.4 53.4 -60.4 -46.9 1.8 3.3 1.3 100 89 A D H 3< S+ 0 0 67 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.843 105.0 55.5 -56.3 -35.3 0.9 -0.3 1.0 101 90 A S H 3< S+ 0 0 43 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.671 94.6 92.3 -71.5 -18.9 3.7 -0.9 -1.6 102 91 A L S << S- 0 0 8 -3,-1.5 31,-0.0 -4,-0.8 2,-0.0 -0.399 78.2-115.4 -83.9 153.4 6.3 0.4 0.8 103 92 A D > - 0 0 56 -2,-0.1 4,-2.2 1,-0.1 5,-0.2 -0.273 43.0 -92.8 -71.9 171.3 8.5 -1.5 3.3 104 93 A A H > S+ 0 0 77 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.861 123.7 47.0 -59.1 -42.4 8.0 -0.9 7.0 105 94 A V H > S+ 0 0 18 62,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.933 112.9 47.8 -68.6 -44.2 10.7 1.8 7.3 106 95 A R H > S+ 0 0 19 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.842 105.3 61.0 -66.1 -26.8 9.5 3.8 4.3 107 96 A R H X S+ 0 0 84 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.897 103.3 51.3 -64.3 -37.5 6.0 3.5 5.7 108 97 A C H X S+ 0 0 20 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.911 107.7 50.9 -61.0 -43.4 7.3 5.4 8.7 109 98 A A H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.904 109.7 52.3 -62.4 -37.6 8.7 8.1 6.5 110 99 A A H X S+ 0 0 14 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.932 110.2 46.1 -62.1 -46.8 5.3 8.3 4.8 111 100 A I H X S+ 0 0 10 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.924 112.9 51.6 -62.9 -42.6 3.5 8.8 8.0 112 101 A N H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.955 108.3 50.6 -55.7 -50.7 6.1 11.3 9.0 113 102 A H H X S+ 0 0 8 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.919 113.6 44.9 -57.9 -44.6 5.7 13.3 5.7 114 103 A V H X S+ 0 0 8 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.901 109.3 55.6 -68.4 -40.4 1.9 13.4 6.2 115 104 A F H < S+ 0 0 31 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.2 0.928 117.0 38.7 -53.3 -43.4 2.2 14.4 9.9 116 105 A Q H < S+ 0 0 32 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.918 132.5 20.3 -75.2 -45.7 4.4 17.3 8.7 117 106 A M H < S- 0 0 61 -4,-3.1 4,-0.4 -5,-0.2 -3,-0.2 0.609 99.8-122.8-103.4 -18.7 2.6 18.4 5.5 118 107 A G X - 0 0 30 -4,-2.7 4,-2.0 -5,-0.3 5,-0.2 0.065 35.6 -72.8 83.4 161.4 -1.0 17.0 5.8 119 108 A V H > S+ 0 0 37 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.837 126.8 46.1 -58.9 -44.3 -2.8 14.7 3.4 120 109 A T H > S+ 0 0 127 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.884 111.0 53.5 -73.8 -34.7 -3.5 17.1 0.5 121 110 A G H 4 S+ 0 0 25 -4,-0.4 4,-0.3 1,-0.2 3,-0.3 0.946 115.5 39.6 -59.5 -49.6 0.1 18.4 0.5 122 111 A V H >< S+ 0 0 7 -4,-2.0 3,-2.0 1,-0.2 -2,-0.2 0.918 112.6 54.5 -65.9 -45.0 1.5 15.0 0.2 123 112 A A H 3< S+ 0 0 21 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.710 100.0 63.3 -67.2 -17.9 -1.1 13.6 -2.2 124 113 A G T 3< S+ 0 0 52 -4,-1.2 2,-2.3 -3,-0.3 -1,-0.3 0.631 75.8 93.4 -79.6 -13.9 -0.3 16.5 -4.5 125 114 A F <> + 0 0 38 -3,-2.0 4,-2.3 -4,-0.3 5,-0.2 -0.410 53.2 166.4 -76.4 65.1 3.3 15.2 -4.9 126 115 A T H > + 0 0 70 -2,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.870 68.6 44.2 -55.0 -50.3 2.3 13.2 -8.1 127 116 A N H > S+ 0 0 81 -3,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.913 112.9 50.6 -62.7 -46.6 5.8 12.4 -9.4 128 117 A V H > S+ 0 0 7 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.911 109.3 51.7 -58.8 -43.7 7.2 11.4 -6.0 129 118 A L H X S+ 0 0 10 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.908 111.3 47.0 -62.6 -41.4 4.3 9.1 -5.3 130 119 A R H X S+ 0 0 97 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.917 111.9 51.1 -64.8 -43.6 4.8 7.4 -8.7 131 120 A M H <>S+ 0 0 12 -4,-2.6 5,-2.9 2,-0.2 -2,-0.2 0.907 110.8 48.5 -60.1 -42.1 8.6 7.1 -8.1 132 121 A L H ><5S+ 0 0 4 -4,-2.7 3,-1.7 1,-0.2 -2,-0.2 0.939 109.9 50.4 -66.5 -44.0 8.0 5.5 -4.7 133 122 A Q H 3<5S+ 0 0 82 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.842 112.9 48.2 -61.6 -30.8 5.5 3.0 -6.0 134 123 A Q T 3<5S- 0 0 102 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.336 114.6-117.6 -91.0 6.5 8.1 2.1 -8.7 135 124 A K T < 5 + 0 0 128 -3,-1.7 2,-1.5 1,-0.2 -3,-0.2 0.762 63.9 148.2 61.6 30.2 10.9 1.8 -6.2 136 125 A R >< + 0 0 48 -5,-2.9 4,-2.5 1,-0.2 -1,-0.2 -0.596 15.4 165.0 -89.3 73.0 12.8 4.7 -7.9 137 126 A W H > + 0 0 64 -2,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.857 65.8 49.1 -69.8 -38.5 14.3 5.7 -4.5 138 127 A D H > S+ 0 0 70 -3,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.928 114.9 45.7 -67.0 -42.7 17.1 8.0 -5.7 139 128 A E H > S+ 0 0 52 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.888 111.3 52.4 -66.2 -40.8 14.7 9.9 -8.0 140 129 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.924 111.0 47.2 -60.0 -45.9 12.1 10.1 -5.3 141 130 A A H X S+ 0 0 8 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.904 110.6 51.6 -65.7 -42.0 14.6 11.6 -2.9 142 131 A V H < S+ 0 0 86 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.906 111.7 48.0 -60.6 -42.0 15.9 14.1 -5.4 143 132 A N H >< S+ 0 0 37 -4,-2.4 3,-1.6 1,-0.2 4,-0.4 0.896 107.9 53.3 -68.2 -35.7 12.4 15.3 -6.1 144 133 A L H >< S+ 0 0 0 -4,-2.4 3,-1.5 1,-0.3 6,-0.5 0.867 102.3 60.9 -63.8 -33.5 11.5 15.6 -2.5 145 134 A A T 3< S+ 0 0 10 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.548 97.8 58.9 -74.5 -3.7 14.6 17.8 -2.1 146 135 A K T < S+ 0 0 107 -3,-1.6 -1,-0.3 -4,-0.2 -2,-0.2 0.588 87.5 106.7 -89.6 -13.9 13.1 20.2 -4.6 147 136 A S S <> S- 0 0 13 -3,-1.5 4,-2.6 -4,-0.4 5,-0.2 -0.205 75.1-130.3 -76.8 154.5 10.0 20.8 -2.5 148 137 A R H > S+ 0 0 181 2,-0.2 4,-2.8 1,-0.2 5,-0.4 0.877 108.1 64.4 -62.4 -37.8 9.1 23.9 -0.4 149 138 A W H > S+ 0 0 19 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.934 112.8 32.2 -51.0 -52.5 8.5 21.6 2.5 150 139 A Y H >4 S+ 0 0 2 -6,-0.5 3,-0.9 1,-0.2 7,-0.2 0.960 120.5 50.0 -69.2 -51.1 12.2 20.5 2.6 151 140 A N H 3< S+ 0 0 1 -4,-2.6 117,-2.8 1,-0.3 118,-0.2 0.780 108.6 49.5 -67.6 -30.0 13.7 23.8 1.4 152 141 A Q H 3< S+ 0 0 90 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.1 0.730 132.7 15.6 -77.2 -22.1 12.0 26.1 3.8 153 142 A a S XX S+ 0 0 10 -3,-0.9 4,-0.9 -4,-0.6 3,-0.9 -0.446 71.6 168.2-151.1 67.5 12.9 23.9 6.7 154 143 A P H 3> S+ 0 0 6 0, 0.0 4,-2.6 0, 0.0 3,-0.5 0.807 71.8 59.2 -61.9 -34.7 15.6 21.5 5.8 155 144 A D H 34 S+ 0 0 77 1,-0.2 4,-0.4 2,-0.2 -5,-0.1 0.831 106.8 48.2 -66.4 -29.6 16.6 20.2 9.3 156 145 A R H <4 S+ 0 0 25 -3,-0.9 -1,-0.2 -6,-0.2 4,-0.2 0.729 123.4 32.0 -80.1 -21.7 13.0 18.9 10.0 157 146 A A H X S+ 0 0 0 -4,-0.9 4,-2.0 -3,-0.5 3,-0.3 0.621 93.9 85.7-110.9 -18.7 12.8 17.1 6.6 158 147 A K H X S+ 0 0 51 -4,-2.6 4,-2.2 1,-0.2 5,-0.2 0.860 91.4 48.5 -60.0 -38.3 16.3 16.0 5.8 159 148 A R H > S+ 0 0 53 -4,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.860 109.0 53.9 -71.7 -32.4 16.1 12.7 7.7 160 149 A V H > S+ 0 0 0 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.920 108.8 49.2 -65.5 -43.8 12.8 11.8 6.2 161 150 A I H X S+ 0 0 4 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.944 110.8 49.1 -61.5 -48.5 14.2 12.3 2.7 162 151 A T H X S+ 0 0 38 -4,-2.2 4,-2.4 1,-0.2 5,-0.3 0.892 109.4 54.1 -57.6 -38.4 17.2 10.1 3.5 163 152 A T H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.901 106.6 50.3 -65.4 -40.5 14.9 7.5 4.9 164 153 A F H < S+ 0 0 3 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.862 112.4 49.4 -62.5 -34.9 12.9 7.4 1.6 165 154 A R H < S+ 0 0 111 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.929 127.5 19.5 -68.4 -42.3 16.1 7.0 -0.3 166 155 A T H < S- 0 0 44 -4,-2.4 -2,-0.2 2,-0.2 -3,-0.2 0.713 81.1-139.3-104.8 -26.1 17.5 4.1 1.9 167 156 A G S < S+ 0 0 13 -4,-2.8 2,-0.3 -5,-0.3 -62,-0.2 0.737 71.1 106.0 62.2 22.1 14.7 2.5 3.7 168 157 A T S S- 0 0 53 -6,-0.3 3,-0.4 -5,-0.2 -1,-0.3 -0.786 80.1-120.1-119.4 174.7 17.0 2.2 6.8 169 158 A W S > S+ 0 0 15 -2,-0.3 3,-2.4 1,-0.2 4,-0.2 0.269 74.0 117.7 -94.6 13.5 17.1 4.1 10.0 170 159 A D G > + 0 0 94 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.770 66.1 61.3 -58.1 -31.6 20.7 5.4 9.5 171 160 A A G 3 S+ 0 0 25 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.641 102.4 54.2 -70.3 -11.4 19.7 9.1 9.4 172 161 A Y G < S+ 0 0 3 -3,-2.4 3,-0.3 -13,-0.1 -1,-0.3 0.362 90.0 97.1-104.9 3.1 18.4 8.8 13.0 173 162 A K S < S+ 0 0 71 -3,-1.5 -3,-0.0 -4,-0.2 0, 0.0 -0.485 79.9 18.9 -87.2 159.3 21.7 7.3 14.4 174 163 A N 0 0 154 -2,-0.2 -1,-0.2 1,-0.1 -4,-0.0 0.908 360.0 360.0 50.2 59.5 24.3 9.3 16.2 175 164 A L 0 0 172 -3,-0.3 -1,-0.1 0, 0.0 -3,-0.1 -0.206 360.0 360.0 -64.2 360.0 22.3 12.4 17.1 176 !* 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 0.0 177 -9 B T > 0 0 110 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 110.8 51.7 38.4 -15.0 178 -8 B T H > + 0 0 97 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.814 360.0 58.3 -68.0 -28.6 49.3 39.7 -17.6 179 -7 B E H > S+ 0 0 79 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.901 106.0 46.7 -69.5 -40.6 48.5 36.1 -18.5 180 -6 B N H > S+ 0 0 53 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.857 108.7 56.9 -69.0 -30.8 47.4 35.3 -15.0 181 -5 B L H X S+ 0 0 123 -4,-1.7 4,-1.4 1,-0.2 -2,-0.2 0.937 112.6 40.8 -65.8 -42.8 45.4 38.5 -14.9 182 -4 B Y H X S+ 0 0 176 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.915 115.8 50.4 -69.0 -40.7 43.4 37.3 -17.9 183 -3 B F H X S+ 0 0 43 -4,-2.7 4,-1.0 1,-0.2 3,-0.2 0.945 110.4 47.7 -63.3 -47.5 43.2 33.7 -16.7 184 -2 B Q H < S+ 0 0 40 -4,-2.9 3,-0.3 1,-0.2 -1,-0.2 0.865 115.4 48.5 -59.0 -36.2 41.9 34.6 -13.3 185 -1 B G H < S+ 0 0 64 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.830 107.0 55.3 -72.1 -32.0 39.4 36.9 -15.0 186 0 B S H < S+ 0 0 75 -4,-1.9 -1,-0.2 -3,-0.2 -2,-0.2 0.619 81.0 103.3 -83.9 -15.0 38.2 34.4 -17.6 187 1 B M < + 0 0 18 -4,-1.0 2,-0.3 -3,-0.3 157,-0.0 -0.316 40.2 162.4 -73.3 157.2 37.1 31.5 -15.4 188 2 B N > - 0 0 72 95,-0.0 4,-2.4 1,-0.0 5,-0.2 -0.928 54.7 -83.6-159.1 174.6 33.5 30.7 -14.7 189 3 B I H > S+ 0 0 16 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.842 123.7 53.5 -59.5 -34.9 31.3 27.8 -13.4 190 4 B F H > S+ 0 0 69 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.942 111.5 42.9 -66.8 -46.6 31.1 26.2 -16.9 191 5 B E H > S+ 0 0 71 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.891 114.1 53.6 -66.3 -36.8 34.9 26.1 -17.5 192 6 B M H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.943 112.2 42.1 -62.1 -50.5 35.4 24.9 -13.9 193 7 B L H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.5 0.869 108.7 59.8 -69.3 -34.3 33.0 22.0 -14.2 194 8 B R H X S+ 0 0 76 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.912 109.9 44.0 -56.1 -43.2 34.3 21.1 -17.7 195 9 B I H < S+ 0 0 30 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.948 117.4 43.9 -66.7 -47.2 37.7 20.6 -16.1 196 10 B D H < S+ 0 0 13 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.849 127.6 27.6 -67.9 -36.5 36.5 18.7 -13.1 197 11 B E H < S- 0 0 22 -4,-3.0 19,-0.4 -5,-0.1 -3,-0.2 0.683 94.2-149.9 -97.6 -25.7 34.0 16.4 -15.0 198 12 B G < - 0 0 30 -4,-1.9 2,-0.5 -5,-0.5 18,-0.2 -0.052 25.7 -86.3 72.6 175.9 35.6 16.2 -18.5 199 13 B L + 0 0 66 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.989 47.5 170.5-122.3 122.9 33.5 15.8 -21.6 200 14 B R E -D 214 0C 133 14,-1.9 14,-2.2 -2,-0.5 4,-0.1 -0.991 20.7-164.8-134.2 129.1 32.6 12.2 -22.7 201 15 B L E S+ 0 0 58 -2,-0.4 43,-2.7 12,-0.2 2,-0.3 0.555 73.7 59.4 -92.7 -6.3 30.1 11.5 -25.4 202 16 B K E S-F 243 0D 132 41,-0.2 41,-0.2 12,-0.1 10,-0.1 -0.902 99.2 -89.0-120.4 151.2 29.6 7.8 -24.6 203 17 B I E + 0 0 30 39,-2.0 2,-0.3 -2,-0.3 10,-0.2 -0.301 54.9 169.1 -58.1 133.9 28.3 6.3 -21.4 204 18 B Y E -D 212 0C 27 8,-2.4 8,-2.9 6,-0.1 2,-0.5 -0.954 36.9-107.6-140.6 161.5 31.2 5.6 -18.9 205 19 B K E -D 211 0C 125 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.777 36.2-138.4 -89.9 134.4 31.4 4.6 -15.3 206 20 B D > - 0 0 23 4,-2.8 3,-2.0 -2,-0.5 -1,-0.1 0.032 39.1 -75.9 -81.5-168.1 32.6 7.3 -13.1 207 21 B b T 3 S+ 0 0 71 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.689 134.5 45.7 -69.5 -16.3 35.1 7.1 -10.3 208 22 B E T 3 S- 0 0 76 2,-0.1 -1,-0.3 120,-0.1 120,-0.0 0.244 124.6-101.5-104.9 6.4 32.5 5.5 -8.0 209 23 B G S < S+ 0 0 39 -3,-2.0 2,-0.4 1,-0.3 -2,-0.1 0.545 75.7 141.2 88.9 10.1 31.4 3.1 -10.7 210 24 B Y - 0 0 65 -5,-0.1 -4,-2.8 1,-0.1 -1,-0.3 -0.693 58.5-108.4 -94.9 135.9 28.3 5.0 -11.7 211 25 B Y E +DE 205 220C 23 9,-0.5 8,-2.6 11,-0.4 9,-1.1 -0.399 51.0 163.7 -63.4 128.7 27.1 5.3 -15.3 212 26 B T E -DE 204 218C 4 -8,-2.9 -8,-2.4 6,-0.3 2,-0.3 -0.885 15.5-174.7-143.5 161.0 27.6 8.9 -16.4 213 27 B I E > + E 0 217C 0 4,-1.8 4,-2.3 -2,-0.3 -12,-0.2 -0.971 50.5 9.8-154.2 167.0 27.7 10.9 -19.7 214 28 B G E 4 S-D 200 0C 0 -14,-2.2 -14,-1.9 -2,-0.3 2,-0.9 -0.381 124.0 -12.9 68.3-133.7 28.4 14.3 -21.1 215 29 B I T 4 S- 0 0 2 34,-0.4 -1,-0.2 -16,-0.2 -16,-0.1 -0.768 128.3 -48.3-105.9 80.0 29.9 16.7 -18.6 216 30 B G T 4 S+ 0 0 12 -2,-0.9 2,-1.0 -19,-0.4 -2,-0.2 0.720 83.8 159.4 65.4 26.1 29.3 14.8 -15.4 217 31 B H E < -E 213 0C 31 -4,-2.3 -4,-1.8 -20,-0.1 2,-0.3 -0.689 32.3-147.1 -83.0 104.3 25.7 14.0 -16.0 218 32 B L E -E 212 0C 75 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.550 15.4-173.3 -71.4 129.2 25.0 11.0 -13.7 219 33 B L E - 0 0 13 -8,-2.6 2,-0.3 1,-0.4 -7,-0.2 0.851 58.5 -32.1 -92.8 -39.7 22.5 8.7 -15.4 220 34 B T E -E 211 0C 31 -9,-1.1 -9,-0.5 2,-0.1 -1,-0.4 -0.957 35.4-132.1-171.5 156.3 21.8 6.2 -12.6 221 35 B K S S+ 0 0 75 -2,-0.3 -1,-0.0 -11,-0.1 7,-0.0 0.448 73.2 115.9 -96.1 -0.5 23.4 4.4 -9.6 222 36 B S - 0 0 38 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.364 69.8-135.0 -62.7 143.4 22.0 1.1 -10.9 223 37 B P S S+ 0 0 123 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.495 78.0 101.9 -75.0 -3.2 24.7 -1.4 -11.9 224 38 B D >> - 0 0 80 1,-0.2 4,-1.5 -13,-0.0 3,-0.7 -0.739 60.2-158.1 -93.4 116.5 22.7 -2.2 -15.0 225 39 B L H 3> S+ 0 0 66 -2,-0.6 4,-2.5 1,-0.2 5,-0.2 0.863 94.9 60.2 -58.9 -35.6 23.9 -0.6 -18.3 226 40 B N H 3> S+ 0 0 110 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.862 102.2 52.5 -61.6 -33.1 20.5 -1.0 -19.8 227 41 B A H <> S+ 0 0 27 -3,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.895 109.3 49.4 -67.0 -41.1 19.1 1.2 -17.0 228 42 B A H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.909 111.4 48.8 -61.0 -43.3 21.7 3.8 -17.8 229 43 B K H X S+ 0 0 71 -4,-2.5 4,-2.7 2,-0.2 11,-0.3 0.884 110.0 52.2 -66.3 -37.2 20.8 3.7 -21.5 230 44 B S H X S+ 0 0 71 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.926 111.0 46.4 -64.3 -44.8 17.1 3.9 -20.7 231 45 B E H X S+ 0 0 52 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.881 112.4 51.9 -62.0 -40.0 17.7 7.1 -18.6 232 46 B L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.4 0.953 109.5 47.9 -64.4 -49.7 19.8 8.5 -21.3 233 47 B D H X>S+ 0 0 41 -4,-2.7 4,-2.3 1,-0.2 5,-0.9 0.875 112.8 50.2 -59.0 -36.5 17.2 8.0 -24.0 234 48 B K H <5S+ 0 0 129 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.901 111.2 48.1 -66.4 -41.2 14.6 9.5 -21.7 235 49 B A H <5S+ 0 0 48 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.869 122.8 32.0 -69.0 -38.5 16.8 12.6 -21.0 236 50 B I H <5S- 0 0 40 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.760 102.1-129.4 -91.7 -29.3 17.6 13.3 -24.7 237 51 B G T <5S+ 0 0 63 -4,-2.3 2,-0.3 -5,-0.4 -3,-0.2 0.830 74.5 75.5 81.3 34.5 14.3 12.0 -26.1 238 52 B R S - 0 0 5 -2,-1.0 3,-1.4 -11,-0.3 -1,-0.2 0.668 31.0-142.0 -90.5 -17.4 21.0 7.2 -28.3 241 55 B N T 3 S- 0 0 119 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.888 75.1 -56.8 53.4 38.0 22.5 3.7 -28.1 242 56 B G T 3 S+ 0 0 5 -13,-0.2 -39,-2.0 1,-0.1 2,-0.4 0.611 120.1 99.6 71.0 15.9 24.6 5.1 -25.3 243 57 B V B < -F 202 0D 58 -3,-1.4 2,-0.3 -41,-0.2 -41,-0.2 -0.997 45.7-176.4-137.7 134.5 26.1 8.0 -27.3 244 58 B I - 0 0 5 -43,-2.7 2,-0.1 -2,-0.4 -30,-0.1 -0.824 26.3-108.2-124.1 168.7 25.3 11.7 -27.6 245 59 B T > - 0 0 64 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.446 32.6-109.8 -87.8 165.2 26.4 14.7 -29.6 246 60 B K H > S+ 0 0 120 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.917 121.7 52.7 -61.0 -41.4 28.5 17.6 -28.2 247 61 B D H > S+ 0 0 138 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.880 109.0 49.6 -59.7 -41.5 25.4 19.8 -28.5 248 62 B E H > S+ 0 0 41 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.916 110.4 49.9 -62.9 -44.4 23.4 17.3 -26.5 249 63 B A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -34,-0.4 0.912 111.0 50.2 -59.4 -43.3 26.1 17.2 -23.8 250 64 B E H X S+ 0 0 37 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.882 109.3 50.0 -66.2 -39.0 26.1 20.9 -23.6 251 65 B K H X S+ 0 0 134 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.942 113.0 46.7 -62.5 -47.6 22.3 21.2 -23.3 252 66 B L H X S+ 0 0 5 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.890 111.9 52.9 -58.1 -43.2 22.3 18.6 -20.5 253 67 B F H X S+ 0 0 1 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.943 108.9 47.4 -61.8 -47.3 25.2 20.5 -18.9 254 68 B N H X S+ 0 0 80 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.885 112.4 50.9 -61.6 -39.0 23.4 23.8 -18.9 255 69 B Q H X S+ 0 0 89 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.909 111.0 48.2 -62.6 -41.7 20.4 22.2 -17.5 256 70 B D H X S+ 0 0 39 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.870 111.6 49.0 -71.6 -37.8 22.4 20.5 -14.7 257 71 B V H X S+ 0 0 7 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.938 111.2 50.6 -65.1 -46.0 24.2 23.8 -13.8 258 72 B D H X S+ 0 0 81 -4,-2.5 4,-2.9 -5,-0.2 5,-0.2 0.903 109.1 50.8 -56.5 -44.2 20.8 25.6 -13.7 259 73 B A H X S+ 0 0 42 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.862 110.0 50.4 -63.6 -35.9 19.4 22.9 -11.4 260 74 B A H X S+ 0 0 6 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.928 113.0 45.1 -69.8 -44.3 22.4 23.2 -9.0 261 75 B V H X S+ 0 0 37 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.939 115.1 47.2 -62.2 -46.5 22.1 27.0 -8.8 262 76 B R H X S+ 0 0 106 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.893 109.0 57.1 -61.3 -38.8 18.3 26.9 -8.4 263 77 B G H < S+ 0 0 1 -4,-2.2 4,-0.4 -5,-0.2 -1,-0.2 0.887 109.7 43.6 -59.9 -42.8 18.9 24.2 -5.8 264 78 B I H >< S+ 0 0 4 -4,-1.9 3,-1.3 1,-0.2 7,-0.5 0.949 111.5 52.3 -65.4 -49.1 21.1 26.5 -3.7 265 79 B L H 3< S+ 0 0 70 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.758 109.3 47.9 -69.1 -26.9 19.0 29.6 -4.0 266 80 B R T 3< S+ 0 0 81 -4,-1.8 2,-0.5 -5,-0.2 -1,-0.3 0.565 92.1 97.0 -86.5 -10.0 15.7 28.0 -2.8 267 81 B N <> - 0 0 1 -3,-1.3 4,-2.7 -4,-0.4 -115,-0.2 -0.703 65.8-147.2 -91.0 127.0 17.3 26.3 0.2 268 82 B A T 4 S+ 0 0 48 -117,-2.8 -1,-0.1 -2,-0.5 -116,-0.1 0.763 98.9 40.8 -62.4 -27.7 17.1 27.9 3.6 269 83 B K T > S+ 0 0 53 -118,-0.2 4,-0.6 2,-0.1 -1,-0.2 0.869 120.2 40.5 -87.9 -39.5 20.5 26.6 4.8 270 84 B L H > S+ 0 0 8 -7,-0.2 4,-2.9 -6,-0.2 3,-0.3 0.894 103.3 64.9 -79.0 -41.5 22.5 27.1 1.6 271 85 B K H X S+ 0 0 82 -4,-2.7 4,-3.0 -7,-0.5 5,-0.2 0.895 100.8 47.2 -56.9 -47.6 21.2 30.5 0.3 272 86 B P H > S+ 0 0 56 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.886 115.6 46.6 -65.3 -31.7 22.5 32.7 3.1 273 87 B V H X S+ 0 0 8 -4,-0.6 4,-0.9 -3,-0.3 3,-0.3 0.951 113.2 49.0 -70.6 -45.3 25.9 31.0 3.0 274 88 B Y H >< S+ 0 0 32 -4,-2.9 3,-1.2 1,-0.2 -1,-0.2 0.920 108.6 53.3 -55.6 -47.9 26.0 31.3 -0.8 275 89 B D H 3< S+ 0 0 65 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.836 105.8 54.9 -59.2 -34.1 25.0 35.0 -0.7 276 90 B S H 3< S+ 0 0 42 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.686 93.3 93.8 -73.0 -21.2 27.9 35.6 1.7 277 91 B L S << S- 0 0 8 -3,-1.2 2,-0.1 -4,-0.9 31,-0.0 -0.388 77.6-116.7 -73.8 152.5 30.5 34.1 -0.7 278 92 B D > - 0 0 56 -2,-0.1 4,-2.2 1,-0.1 5,-0.2 -0.308 43.7 -91.1 -73.2 170.3 32.6 36.0 -3.3 279 93 B A H > S+ 0 0 75 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.846 124.3 47.5 -57.8 -40.8 32.1 35.2 -7.0 280 94 B V H > S+ 0 0 24 62,-0.2 4,-1.8 2,-0.2 3,-0.4 0.948 112.2 47.1 -71.4 -45.5 34.8 32.5 -7.1 281 95 B R H > S+ 0 0 20 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.826 106.3 60.5 -65.9 -26.7 33.7 30.6 -4.0 282 96 B R H X S+ 0 0 84 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.881 103.2 51.5 -64.2 -37.4 30.1 30.8 -5.3 283 97 B C H X S+ 0 0 19 -4,-1.3 4,-2.7 -3,-0.4 -2,-0.2 0.930 107.8 51.2 -62.7 -40.6 31.3 28.9 -8.3 284 98 B A H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.893 109.7 51.2 -62.3 -37.9 32.8 26.3 -5.9 285 99 B A H X S+ 0 0 13 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.926 110.6 46.8 -64.7 -45.9 29.5 26.1 -4.2 286 100 B I H X S+ 0 0 10 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.919 112.7 51.3 -63.1 -40.1 27.6 25.5 -7.4 287 101 B N H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.955 108.8 50.6 -60.1 -51.0 30.2 22.9 -8.4 288 102 B H H X S+ 0 0 7 -4,-2.7 4,-2.8 1,-0.2 5,-0.3 0.904 113.8 44.4 -52.7 -48.1 29.8 21.1 -5.0 289 103 B V H X S+ 0 0 8 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.872 109.7 55.8 -69.3 -38.3 26.0 21.0 -5.4 290 104 B F H < S+ 0 0 32 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.933 116.9 37.8 -54.7 -45.2 26.3 19.9 -9.1 291 105 B Q H < S+ 0 0 34 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.908 133.4 19.8 -71.5 -44.0 28.4 17.0 -7.9 292 106 B M H < S- 0 0 63 -4,-2.8 4,-0.4 -5,-0.2 -3,-0.2 0.620 99.2-122.3-108.1 -24.4 26.7 16.0 -4.6 293 107 B G X - 0 0 28 -4,-2.3 4,-1.9 -5,-0.3 5,-0.2 -0.002 34.9 -74.5 88.5 162.5 23.2 17.4 -4.7 294 108 B V H > S+ 0 0 19 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.909 125.5 47.3 -64.5 -47.9 21.4 19.8 -2.3 295 109 B T H > S+ 0 0 52 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.886 110.7 53.2 -66.7 -36.1 20.8 17.5 0.7 296 110 B G H 4 S+ 0 0 25 -4,-0.4 3,-0.5 1,-0.2 -1,-0.2 0.945 116.1 39.2 -61.2 -45.3 24.3 16.2 0.7 297 111 B V H >< S+ 0 0 9 -4,-1.9 3,-2.5 1,-0.2 -2,-0.2 0.919 110.4 57.4 -70.4 -43.9 25.8 19.6 0.8 298 112 B A H 3< S+ 0 0 5 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.630 98.0 66.0 -67.8 -10.7 23.2 21.1 3.2 299 113 B G T 3< S+ 0 0 44 -4,-0.8 2,-1.8 -3,-0.5 -1,-0.3 0.492 73.4 91.5 -84.5 -6.5 24.2 18.4 5.6 300 114 B F <> + 0 0 33 -3,-2.5 4,-2.6 1,-0.2 5,-0.2 -0.452 54.2 166.4 -84.0 65.9 27.8 19.8 6.0 301 115 B T H > + 0 0 55 -2,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.859 69.8 41.5 -56.3 -47.2 26.6 21.9 9.0 302 116 B N H > S+ 0 0 79 -3,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.906 113.1 53.7 -69.5 -40.6 30.1 22.9 10.3 303 117 B V H > S+ 0 0 9 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.924 108.1 51.3 -58.7 -44.5 31.5 23.6 6.8 304 118 B L H X S+ 0 0 10 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.915 111.1 47.1 -60.1 -44.6 28.6 25.9 6.1 305 119 B R H X S+ 0 0 102 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.2 0.918 111.8 51.0 -59.6 -45.5 29.1 27.8 9.4 306 120 B M H <>S+ 0 0 13 -4,-2.7 5,-3.0 2,-0.2 4,-0.3 0.912 109.6 49.8 -62.4 -41.1 32.9 28.1 8.7 307 121 B L H ><5S+ 0 0 6 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.924 109.7 50.1 -66.6 -41.7 32.3 29.4 5.2 308 122 B Q H 3<5S+ 0 0 83 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.847 112.7 48.7 -61.7 -31.7 29.9 32.1 6.4 309 123 B Q T 3<5S- 0 0 102 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.430 114.4-119.4 -88.4 3.8 32.5 33.0 9.0 310 124 B K T < 5 + 0 0 126 -3,-1.4 2,-1.4 -4,-0.3 -3,-0.2 0.799 63.5 148.1 62.1 32.1 35.2 33.2 6.4 311 125 B R >< + 0 0 77 -5,-3.0 4,-2.5 1,-0.2 -1,-0.2 -0.638 15.7 165.6 -93.2 74.2 37.2 30.4 8.2 312 126 B W H > + 0 0 61 -2,-1.4 4,-2.5 1,-0.2 -1,-0.2 0.883 66.1 50.2 -68.6 -43.2 38.5 29.1 4.9 313 127 B D H > S+ 0 0 108 -3,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.943 114.4 46.0 -59.7 -46.9 41.3 26.9 6.1 314 128 B E H > S+ 0 0 87 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.902 111.1 51.8 -66.4 -39.3 38.9 25.2 8.6 315 129 B A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.934 110.9 48.7 -61.3 -43.8 36.2 24.8 6.0 316 130 B A H X S+ 0 0 8 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.904 109.5 50.9 -65.5 -38.6 38.7 23.2 3.6 317 131 B V H < S+ 0 0 90 -4,-2.3 4,-0.2 1,-0.2 -1,-0.2 0.913 112.4 48.2 -64.6 -39.7 40.0 20.8 6.2 318 132 B N H >< S+ 0 0 34 -4,-2.2 3,-1.5 1,-0.2 4,-0.4 0.887 107.3 53.4 -70.8 -37.0 36.5 19.7 7.0 319 133 B L H >< S+ 0 0 0 -4,-2.4 3,-1.5 1,-0.3 6,-0.5 0.869 102.3 61.4 -61.9 -34.8 35.5 19.2 3.4 320 134 B A T 3< S+ 0 0 37 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.549 96.2 60.3 -71.5 -5.5 38.6 16.9 3.1 321 135 B K T < S+ 0 0 138 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.2 0.583 87.1 106.0 -89.4 -15.0 37.0 14.6 5.8 322 136 B S S <> S- 0 0 13 -3,-1.5 4,-2.5 -4,-0.4 5,-0.2 -0.227 76.3-129.7 -71.4 154.2 34.0 14.0 3.6 323 137 B R H > S+ 0 0 117 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.867 108.2 64.9 -65.0 -33.7 33.1 10.8 1.7 324 138 B W H > S+ 0 0 20 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.947 112.0 32.6 -54.8 -50.7 32.5 13.1 -1.4 325 139 B Y H >4 S+ 0 0 61 -6,-0.5 3,-0.7 1,-0.2 7,-0.2 0.946 120.4 49.9 -68.4 -50.3 36.2 14.1 -1.5 326 140 B N H 3< S+ 0 0 87 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.790 109.1 49.2 -68.8 -29.1 37.7 10.8 -0.2 327 141 B Q H 3< S+ 0 0 97 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.704 132.6 15.1 -84.0 -16.6 36.0 8.4 -2.5 328 142 B b S XX S+ 0 0 9 -3,-0.7 3,-1.0 -4,-0.6 4,-0.9 -0.429 72.9 166.9-151.4 68.0 36.8 10.5 -5.6 329 143 B P H 3> S+ 0 0 47 0, 0.0 4,-2.5 0, 0.0 3,-0.3 0.793 70.4 59.9 -65.2 -29.2 39.6 13.0 -4.7 330 144 B D H 34 S+ 0 0 105 1,-0.2 4,-0.3 2,-0.2 -5,-0.1 0.801 107.2 46.9 -71.4 -24.0 40.6 14.0 -8.2 331 145 B R H <4 S+ 0 0 28 -3,-1.0 -1,-0.2 -6,-0.2 4,-0.2 0.716 123.0 34.0 -82.5 -22.3 37.1 15.4 -9.0 332 146 B A H >X S+ 0 0 0 -4,-0.9 4,-2.1 -3,-0.3 3,-0.6 0.682 93.9 84.0-105.6 -25.6 36.8 17.2 -5.7 333 147 B K H 3X S+ 0 0 85 -4,-2.5 4,-2.2 1,-0.3 5,-0.2 0.830 92.1 47.1 -59.0 -38.6 40.3 18.4 -4.8 334 148 B R H 3> S+ 0 0 40 -4,-0.3 4,-2.2 1,-0.2 -1,-0.3 0.817 109.0 55.4 -75.5 -27.1 40.2 21.6 -6.9 335 149 B V H <> S+ 0 0 0 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.917 108.9 48.4 -68.1 -41.5 36.8 22.6 -5.6 336 150 B I H X S+ 0 0 17 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.940 111.0 49.3 -65.1 -43.1 38.2 22.3 -2.0 337 151 B T H X S+ 0 0 45 -4,-2.2 4,-2.2 1,-0.2 5,-0.3 0.900 108.9 54.2 -61.9 -38.8 41.3 24.4 -2.9 338 152 B T H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.893 106.5 50.4 -63.9 -39.8 39.0 27.0 -4.4 339 153 B F H < S+ 0 0 5 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.885 111.9 50.3 -62.6 -34.0 37.0 27.2 -1.2 340 154 B R H < S+ 0 0 115 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.910 127.3 18.9 -68.4 -39.5 40.3 27.7 0.6 341 155 B T H < S- 0 0 41 -4,-2.2 -3,-0.2 2,-0.2 -2,-0.2 0.723 80.0-138.4-110.1 -27.0 41.6 30.5 -1.6 342 156 B G S < S+ 0 0 15 -4,-2.6 -62,-0.2 1,-0.3 2,-0.2 0.705 72.5 104.9 67.0 17.7 38.7 32.1 -3.5 343 157 B T S S- 0 0 43 -6,-0.3 3,-0.3 -5,-0.1 -1,-0.3 -0.736 79.8-121.6-118.5 175.0 41.1 32.2 -6.6 344 158 B W S > S+ 0 0 11 -2,-0.2 3,-2.3 1,-0.2 4,-0.3 0.211 73.4 118.3 -97.4 13.6 41.2 30.1 -9.7 345 159 B D G > + 0 0 75 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.801 67.1 61.4 -52.1 -36.0 44.8 28.9 -9.1 346 160 B A G 3 S+ 0 0 26 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.695 104.0 50.4 -67.9 -15.1 43.8 25.2 -8.9 347 161 B Y G X S+ 0 0 0 -3,-2.3 3,-1.6 -13,-0.1 -1,-0.3 0.366 79.0 130.1-104.2 2.1 42.6 25.4 -12.5 348 162 B K T < S+ 0 0 86 -3,-1.5 -168,-0.0 -4,-0.3 -3,-0.0 -0.301 79.6 5.2 -59.5 137.7 45.7 26.9 -14.0 349 163 B N T 3 0 0 163 1,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.632 360.0 360.0 64.7 16.9 47.0 25.1 -17.1 350 164 B L < 0 0 124 -3,-1.6 -2,-0.1 0, 0.0 -1,-0.1 0.450 360.0 360.0-111.5 360.0 44.0 22.7 -17.1