==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-JUN-99 1QTH . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR R.LIU,W.A.BAASE,B.W.MATTHEWS . 324 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17636.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 241 74.4 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 6.8 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 1.2 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 . 18 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 165 50.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.9 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 3 0 2 4 2 0 0 2 2 1 0 0 0 0 0 2 1 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 1 A M 0 0 83 0, 0.0 2,-0.1 0, 0.0 160,-0.0 0.000 360.0 360.0 360.0 152.7 1.3 41.4 -9.5 2 2 A N > - 0 0 108 1,-0.1 4,-2.1 95,-0.0 5,-0.1 -0.384 360.0-121.3 -78.8 155.5 -0.0 37.9 -10.1 3 3 A I H > S+ 0 0 40 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.868 115.0 61.7 -68.5 -37.5 -2.1 35.9 -7.8 4 4 A F H > S+ 0 0 45 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.947 107.3 44.5 -53.7 -46.7 0.5 33.3 -7.9 5 5 A E H > S+ 0 0 104 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.886 110.3 52.1 -70.8 -38.5 2.9 35.9 -6.4 6 6 A M H X S+ 0 0 0 -4,-2.1 4,-3.0 1,-0.2 5,-0.3 0.965 110.7 49.3 -62.1 -41.1 0.6 37.2 -3.8 7 7 A L H X>S+ 0 0 0 -4,-2.8 4,-3.1 2,-0.2 5,-1.6 0.825 106.2 55.4 -69.4 -23.4 -0.1 33.5 -2.6 8 8 A R H <5S+ 0 0 96 -4,-1.4 4,-0.2 -5,-0.3 -1,-0.2 0.948 111.3 46.6 -70.9 -40.0 3.6 32.8 -2.4 9 9 A I H <5S+ 0 0 70 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.970 125.1 29.0 -58.8 -56.9 3.9 35.8 -0.1 10 10 A D H <5S+ 0 0 19 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.741 138.2 23.3 -78.4 -31.4 0.9 34.9 2.0 11 11 A E T <5S- 0 0 50 -4,-3.1 19,-0.3 -5,-0.3 -3,-0.2 0.720 96.9-145.7-104.0 -38.9 1.0 31.1 1.7 12 12 A G < - 0 0 13 -5,-1.6 18,-0.5 -4,-0.2 2,-0.3 -0.141 15.0 -97.3 89.6 164.0 4.6 30.5 0.9 13 13 A L + 0 0 53 16,-0.2 2,-0.2 -5,-0.1 16,-0.2 -0.908 38.5 173.1-120.8 146.2 6.0 27.7 -1.4 14 14 A R - 0 0 80 -2,-0.3 14,-1.7 46,-0.1 4,-0.1 -0.762 23.4-162.8-165.9 111.2 7.4 24.4 -0.2 15 15 A L S S+ 0 0 70 -2,-0.2 43,-3.7 12,-0.2 2,-0.3 0.413 80.5 53.5 -70.5 -11.2 8.5 21.3 -2.2 16 16 A K B S-A 57 0A 62 41,-0.2 41,-0.2 12,-0.1 10,-0.1 -0.996 100.5 -86.1-134.7 133.4 8.4 19.0 0.8 17 17 A I + 0 0 15 39,-1.0 2,-0.3 -2,-0.3 10,-0.2 0.039 52.2 169.4 -35.2 132.5 5.5 18.3 3.3 18 18 A Y E -B 26 0B 42 8,-2.5 8,-2.8 -4,-0.1 2,-0.1 -0.997 37.0-104.8-153.1 149.8 5.2 20.6 6.3 19 19 A K E -B 25 0B 129 -2,-0.3 6,-0.2 6,-0.2 5,-0.2 -0.456 40.4-145.5 -73.2 140.1 2.8 21.4 9.1 20 20 A D > - 0 0 43 4,-2.1 3,-3.1 -2,-0.1 -1,-0.1 -0.302 42.1 -61.9 -92.2-169.5 0.9 24.6 8.7 21 21 A T T 3 S+ 0 0 122 1,-0.3 -2,-0.1 2,-0.2 -1,-0.0 0.659 141.8 34.6 -32.7 -48.3 -0.4 27.3 11.0 22 22 A E T 3 S- 0 0 114 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.284 127.0 -99.1 -94.7 -5.2 -2.6 24.7 12.8 23 23 A G S < S+ 0 0 24 -3,-3.1 -2,-0.2 1,-0.3 2,-0.1 0.456 72.2 150.1 98.7 -0.1 -0.1 22.0 12.3 24 24 A Y - 0 0 65 -5,-0.2 -4,-2.1 1,-0.1 2,-0.4 -0.402 55.3-102.8 -72.4 141.9 -1.6 20.3 9.2 25 25 A Y E +BC 19 34B 36 9,-1.1 8,-3.5 11,-0.3 9,-1.0 -0.523 55.6 165.4 -69.2 121.8 0.5 18.6 6.6 26 26 A T E -BC 18 32B 6 -8,-2.8 -8,-2.5 -2,-0.4 2,-0.2 -0.743 17.3-179.8-130.0 172.1 0.8 20.9 3.7 27 27 A I E > + C 0 31B 0 4,-1.3 4,-2.1 -2,-0.3 -12,-0.2 -0.883 50.6 13.0-159.7-177.3 2.9 21.3 0.6 28 28 A G T 4 S- 0 0 0 -14,-1.7 2,-1.1 -2,-0.2 -12,-0.1 0.121 120.8 -11.3 38.3-141.4 3.3 23.6 -2.5 29 29 A I T 4 S- 0 0 4 34,-0.2 -16,-0.2 1,-0.2 -1,-0.2 -0.718 131.0 -40.1 -89.0 94.3 1.4 27.0 -2.2 30 30 A G T 4 S+ 0 0 24 -2,-1.1 2,-0.7 -18,-0.5 -1,-0.2 0.767 88.6 167.5 59.4 33.2 -0.9 26.6 0.8 31 31 A H E < -C 27 0B 27 -4,-2.1 -4,-1.3 -20,-0.0 2,-0.5 -0.704 26.3-150.1 -87.5 111.4 -1.9 23.0 0.0 32 32 A L E +C 26 0B 83 -2,-0.7 -6,-0.2 -6,-0.2 3,-0.1 -0.606 20.1 171.9 -80.1 122.5 -3.7 21.0 2.7 33 33 A L E - 0 0 18 -8,-3.5 2,-0.3 -2,-0.5 -1,-0.2 0.923 62.3 -26.6 -90.8 -51.6 -3.0 17.3 2.6 34 34 A T E -C 25 0B 22 -9,-1.0 -9,-1.1 2,-0.1 -1,-0.3 -0.988 31.0-141.4-162.8 155.1 -4.7 16.2 5.8 35 35 A K S S+ 0 0 141 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.818 77.8 104.2 -84.7 -35.7 -5.8 17.2 9.2 36 36 A S S S- 0 0 63 1,-0.1 2,-1.3 -3,-0.1 -11,-0.3 -0.186 79.0-122.7 -52.9 139.9 -4.8 13.8 10.5 37 37 A P S S+ 0 0 129 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.467 75.9 105.1 -84.1 58.0 -1.5 13.4 12.5 38 38 A S > - 0 0 30 -2,-1.3 4,-2.2 1,-0.1 3,-0.4 -0.905 50.9-164.5-139.9 108.3 0.2 10.8 10.2 39 39 A L H > S+ 0 0 66 -2,-0.4 4,-2.4 1,-0.3 5,-0.2 0.879 99.7 57.8 -56.1 -32.8 3.0 12.0 8.1 40 40 A N H > S+ 0 0 109 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.873 102.8 50.9 -65.1 -36.9 2.4 8.7 6.4 41 41 A A H > S+ 0 0 27 -3,-0.4 4,-1.4 2,-0.2 -1,-0.2 0.872 109.1 53.9 -68.2 -34.5 -1.2 9.7 5.7 42 42 A A H >X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 3,-0.9 0.983 106.3 49.5 -61.9 -58.2 0.1 13.0 4.2 43 43 A K H 3X S+ 0 0 44 -4,-2.4 4,-3.2 1,-0.3 11,-0.3 0.782 107.3 55.3 -51.5 -36.2 2.5 11.3 1.7 44 44 A S H 3X S+ 0 0 54 -4,-1.4 4,-2.8 2,-0.2 -1,-0.3 0.891 111.0 43.6 -69.8 -33.6 -0.3 9.0 0.5 45 45 A E H X>S+ 0 0 32 -4,-3.2 4,-4.0 1,-0.2 5,-1.2 0.916 115.2 46.6 -52.1 -50.1 1.0 10.8 -4.1 48 48 A K H 3<5S+ 0 0 132 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.982 112.5 50.2 -60.9 -42.8 -2.6 10.4 -5.0 49 49 A A H 3<5S+ 0 0 44 -4,-4.7 -1,-0.3 1,-0.2 -2,-0.2 0.711 121.7 35.4 -60.2 -20.0 -2.8 14.1 -5.6 50 50 A I H <<5S- 0 0 37 -4,-1.5 -1,-0.2 -3,-0.9 -2,-0.2 0.739 101.5-128.6 -98.5 -38.9 0.3 13.8 -7.9 51 51 A G T <5S+ 0 0 64 -4,-4.0 2,-0.3 1,-0.3 -3,-0.2 0.802 78.6 76.1 81.7 38.2 -0.3 10.4 -9.3 52 52 A R S - 0 0 9 -2,-0.9 3,-2.5 -11,-0.3 -1,-0.2 0.544 42.4-141.5-101.4 -23.2 6.9 11.5 -4.2 55 55 A N T 3 S- 0 0 106 1,-0.3 -2,-0.1 -12,-0.2 -11,-0.1 0.957 78.8 -49.9 47.1 51.3 7.7 10.5 -0.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.0 1,-0.1 2,-0.7 0.211 117.8 117.2 76.5 -8.7 6.6 14.0 0.2 57 57 A V B < +A 16 0A 72 -3,-2.5 -41,-0.2 -41,-0.2 2,-0.2 -0.783 39.1 180.0 -99.6 116.5 8.7 15.6 -2.4 58 58 A I - 0 0 5 -43,-3.7 2,-0.6 -2,-0.7 3,-0.1 -0.572 22.9-124.1-110.7 170.0 7.3 17.6 -5.3 59 59 A T > - 0 0 64 -2,-0.2 3,-6.7 1,-0.1 5,-0.1 -0.890 29.9-112.8-117.3 112.8 8.6 19.5 -8.2 60 60 A K T 3> S+ 0 0 76 -2,-0.6 4,-2.9 1,-0.3 5,-0.3 0.428 121.4 54.6 7.3 -77.9 7.8 23.1 -9.0 61 61 A D H 3> S+ 0 0 115 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.760 112.7 45.8 -39.8 -32.3 5.9 22.0 -12.1 62 62 A E H <> S+ 0 0 31 -3,-6.7 4,-3.0 2,-0.2 -1,-0.2 0.957 113.8 45.9 -72.7 -64.2 4.1 19.9 -9.7 63 63 A A H > S+ 0 0 3 1,-0.2 4,-1.9 2,-0.2 5,-0.3 0.917 113.8 50.6 -38.5 -66.3 3.6 22.6 -7.2 64 64 A E H X S+ 0 0 73 -4,-2.9 4,-2.1 1,-0.3 5,-0.3 0.875 110.6 47.3 -39.5 -61.2 2.6 25.0 -9.9 65 65 A K H X S+ 0 0 82 -4,-1.8 4,-2.3 -5,-0.3 -1,-0.3 0.905 109.5 55.7 -55.3 -42.7 0.0 22.8 -11.4 66 66 A L H >X S+ 0 0 2 -4,-3.0 4,-1.7 1,-0.2 3,-0.9 0.981 109.1 44.9 -48.1 -71.2 -1.4 22.0 -7.9 67 67 A F H 3X S+ 0 0 4 -4,-1.9 4,-4.9 1,-0.3 5,-0.4 0.815 108.0 55.9 -39.7 -50.3 -2.0 25.6 -7.0 68 68 A N H 3X S+ 0 0 107 -4,-2.1 4,-2.6 -5,-0.3 -1,-0.3 0.947 108.8 48.7 -57.1 -41.3 -3.6 26.5 -10.3 69 69 A Q H X S+ 0 0 109 -4,-2.2 4,-1.5 -5,-0.3 3,-0.6 0.980 109.1 58.5 -73.1 -45.4 -15.5 28.9 -9.2 77 77 A G H 3X S+ 0 0 11 -4,-3.5 4,-0.8 1,-0.3 -1,-0.2 0.828 109.0 48.1 -46.7 -33.9 -16.7 28.8 -5.7 78 78 A I H 3< S+ 0 0 0 -4,-1.1 3,-0.5 -5,-0.2 7,-0.3 0.890 109.2 53.5 -73.1 -40.8 -16.9 32.5 -6.0 79 79 A L H << S+ 0 0 77 -4,-1.9 -2,-0.2 -3,-0.6 -1,-0.2 0.470 110.6 45.6 -71.7 -13.4 -18.7 32.1 -9.3 80 80 A R H < S+ 0 0 154 -4,-1.5 2,-0.4 -5,-0.1 -1,-0.2 0.640 93.5 96.8-103.7 -18.6 -21.3 29.9 -7.9 81 81 A N X - 0 0 14 -4,-0.8 4,-2.7 -3,-0.5 -3,-0.0 -0.601 57.2-157.6 -81.4 127.9 -21.9 32.0 -4.8 82 82 A A T 4 S+ 0 0 79 -2,-0.4 5,-0.2 2,-0.2 -1,-0.1 0.884 97.0 49.2 -66.4 -38.9 -24.8 34.5 -4.7 83 83 A K T > S+ 0 0 126 1,-0.1 4,-0.6 2,-0.1 -1,-0.2 0.940 120.5 34.0 -69.3 -42.0 -23.1 36.5 -2.0 84 84 A L H > S+ 0 0 2 -7,-0.2 4,-3.2 2,-0.1 5,-0.3 0.821 101.7 68.9 -82.3 -42.5 -19.7 36.7 -3.7 85 85 A K H X S+ 0 0 95 -4,-2.7 4,-3.5 -7,-0.3 5,-0.2 0.932 104.6 42.1 -44.8 -56.4 -20.3 36.8 -7.5 86 86 A P H > S+ 0 0 48 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.897 116.4 50.0 -60.5 -44.0 -21.8 40.3 -7.5 87 87 A V H X S+ 0 0 5 -4,-0.6 4,-1.6 -5,-0.2 3,-0.3 0.933 116.3 42.5 -61.8 -37.7 -19.3 41.5 -5.1 88 88 A Y H < S+ 0 0 43 -4,-3.2 -1,-0.2 1,-0.3 -3,-0.2 0.880 110.8 54.2 -72.3 -38.0 -16.6 39.9 -7.3 89 89 A D H < S+ 0 0 78 -4,-3.5 -1,-0.3 -5,-0.3 -2,-0.2 0.626 107.5 54.4 -68.0 -22.6 -18.0 41.1 -10.4 90 90 A S H < S+ 0 0 45 -4,-1.0 -1,-0.2 -3,-0.3 -2,-0.2 0.793 90.6 94.1 -84.1 -35.6 -18.0 44.5 -9.0 91 91 A L S < S- 0 0 11 -4,-1.6 2,-0.1 -5,-0.1 31,-0.0 -0.101 72.9-113.5 -67.0 161.7 -14.4 44.8 -8.0 92 92 A D > - 0 0 56 1,-0.1 4,-1.8 4,-0.0 3,-0.4 -0.403 48.9 -88.5 -78.1 159.9 -11.3 46.2 -9.8 93 93 A A H > S+ 0 0 90 1,-0.2 4,-0.8 2,-0.2 -1,-0.1 0.790 125.5 43.8 -38.1 -44.3 -8.5 43.8 -10.9 94 94 A V H > S+ 0 0 21 62,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.883 109.5 49.1 -73.6 -47.2 -6.8 44.1 -7.5 95 95 A R H > S+ 0 0 21 -3,-0.4 4,-2.0 1,-0.2 -2,-0.2 0.818 106.7 59.8 -66.5 -34.2 -9.6 43.9 -4.9 96 96 A R H X S+ 0 0 72 -4,-1.8 4,-2.9 2,-0.2 -1,-0.2 0.851 102.4 55.2 -60.1 -35.2 -10.8 40.7 -6.8 97 97 A A H X S+ 0 0 10 -4,-0.8 4,-2.6 -5,-0.3 -2,-0.2 0.934 105.6 49.0 -61.7 -50.9 -7.4 39.3 -6.0 98 98 A M H X S+ 0 0 0 -4,-1.5 4,-3.0 2,-0.2 -2,-0.2 0.963 110.4 54.9 -54.3 -48.1 -7.8 39.9 -2.3 99 99 A L H X S+ 0 0 8 -4,-2.0 4,-2.6 1,-0.3 5,-0.3 0.943 109.7 42.1 -53.6 -56.1 -11.2 38.3 -2.6 100 100 A I H X S+ 0 0 13 -4,-2.9 4,-2.7 1,-0.2 -1,-0.3 0.930 111.2 58.5 -64.2 -29.0 -10.0 35.2 -4.0 101 101 A N H X S+ 0 0 0 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.947 107.5 48.0 -55.1 -51.2 -7.1 35.3 -1.6 102 102 A M H >X S+ 0 0 4 -4,-3.0 4,-2.1 1,-0.2 3,-0.5 0.904 114.0 44.1 -54.7 -50.3 -9.7 35.3 1.2 103 103 A V H 3X S+ 0 0 8 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.850 106.6 61.4 -70.3 -26.2 -11.6 32.5 -0.2 104 104 A F H 3< S+ 0 0 34 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.822 115.0 35.7 -62.6 -31.4 -8.4 30.6 -0.9 105 105 A Q H << S+ 0 0 54 -4,-1.2 -2,-0.2 -3,-0.5 -1,-0.2 0.634 133.0 19.3 -94.9 -28.5 -7.7 30.7 2.8 106 106 A M H X S- 0 0 47 -4,-2.1 4,-0.5 -5,-0.2 -3,-0.2 0.543 100.5-112.3-127.0 -6.5 -11.2 30.3 4.4 107 107 A G H X - 0 0 30 -4,-1.8 4,-1.7 -5,-0.3 5,-0.2 -0.011 32.0 -79.4 90.9 158.1 -13.6 28.9 2.0 108 108 A E H > S+ 0 0 87 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.968 127.8 41.8 -56.9 -57.0 -16.6 30.2 0.2 109 109 A T H > S+ 0 0 104 1,-0.3 4,-0.8 2,-0.2 -1,-0.2 0.932 110.7 54.8 -62.0 -51.0 -18.9 29.8 3.1 110 110 A G H < S+ 0 0 44 -4,-0.5 3,-0.4 1,-0.2 -1,-0.3 0.854 115.1 42.6 -51.4 -36.2 -16.5 31.1 5.7 111 111 A V H >< S+ 0 0 0 -4,-1.7 3,-1.7 1,-0.2 -2,-0.2 0.879 104.5 59.5 -81.3 -41.1 -16.2 34.3 3.6 112 112 A A H 3< S+ 0 0 8 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.630 86.2 81.1 -64.3 -8.9 -19.7 34.9 2.6 113 113 A G T 3< S+ 0 0 59 -4,-0.8 2,-0.9 -3,-0.4 -1,-0.3 0.506 70.2 86.9 -71.8 -9.7 -20.6 35.2 6.3 114 114 A F <> + 0 0 49 -3,-1.7 4,-2.2 1,-0.2 5,-0.3 -0.443 53.2 161.7 -88.8 52.4 -19.3 38.7 6.1 115 115 A T H > S+ 0 0 99 -2,-0.9 4,-2.2 1,-0.2 -1,-0.2 0.836 72.7 43.3 -33.9 -63.9 -22.7 40.2 5.0 116 116 A N H > S+ 0 0 85 2,-0.2 4,-2.5 -3,-0.2 -1,-0.2 0.886 113.7 48.2 -56.2 -52.9 -21.8 43.8 5.9 117 117 A S H > S+ 0 0 4 -3,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.955 113.0 49.1 -56.8 -49.8 -18.2 43.8 4.7 118 118 A L H X S+ 0 0 13 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.870 108.0 53.8 -57.5 -44.0 -19.2 42.4 1.4 119 119 A R H X S+ 0 0 121 -4,-2.2 4,-1.8 -5,-0.3 5,-0.2 0.981 110.9 45.6 -60.7 -51.5 -22.0 44.8 1.0 120 120 A M H X>S+ 0 0 11 -4,-2.5 5,-3.2 1,-0.3 4,-1.0 0.918 105.4 59.9 -58.7 -40.5 -19.7 47.8 1.5 121 121 A L H ><5S+ 0 0 7 -4,-2.9 3,-1.3 1,-0.2 -1,-0.3 0.947 105.9 50.5 -50.2 -44.8 -17.2 46.4 -0.8 122 122 A Q H 3<5S+ 0 0 74 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.823 111.2 46.1 -57.2 -40.2 -19.9 46.6 -3.4 123 123 A Q H 3<5S- 0 0 90 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 0.514 117.2-114.8 -83.5 -2.7 -20.7 50.2 -2.6 124 124 A K T <<5 + 0 0 120 -3,-1.3 2,-1.3 -4,-1.0 -3,-0.2 0.847 60.9 157.1 70.0 35.8 -17.1 50.9 -2.7 125 125 A R >>< + 0 0 115 -5,-3.2 4,-2.5 1,-0.2 3,-1.0 -0.415 13.2 171.5 -93.1 63.1 -17.1 51.7 0.9 126 126 A W H 3> + 0 0 53 -2,-1.3 4,-1.8 1,-0.2 5,-0.2 0.745 67.3 38.2 -37.0 -61.2 -13.4 51.1 1.5 127 127 A D H 3> S+ 0 0 95 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.749 117.3 54.7 -75.9 -11.5 -12.5 52.2 5.0 128 128 A E H <> S+ 0 0 92 -3,-1.0 4,-2.0 2,-0.2 -2,-0.2 0.925 106.0 47.5 -82.5 -49.2 -15.8 51.0 6.3 129 129 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.965 114.5 50.1 -53.7 -49.4 -15.5 47.4 5.0 130 130 A A H X S+ 0 0 6 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.859 105.4 55.1 -56.4 -42.6 -12.0 47.4 6.5 131 131 A V H < S+ 0 0 96 -4,-1.2 -1,-0.2 -5,-0.2 3,-0.2 0.961 114.1 42.1 -54.5 -48.8 -13.2 48.7 9.8 132 132 A N H >< S+ 0 0 41 -4,-2.0 3,-1.9 -3,-0.3 4,-0.3 0.861 108.9 55.3 -62.4 -51.3 -15.6 45.7 9.9 133 133 A L H >< S+ 0 0 1 -4,-2.6 3,-0.6 1,-0.3 6,-0.3 0.711 98.6 66.0 -57.3 -27.4 -13.2 43.0 8.6 134 134 A A T 3< S+ 0 0 43 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.385 92.7 61.5 -79.1 4.1 -10.9 44.0 11.5 135 135 A K T < S+ 0 0 174 -3,-1.9 -1,-0.2 4,-0.0 -2,-0.2 0.450 85.9 106.6-102.0 -11.8 -13.5 42.7 14.0 136 136 A S S <> S- 0 0 14 -3,-0.6 4,-0.8 -4,-0.3 5,-0.0 -0.200 77.9-128.6 -69.3 159.6 -13.3 39.2 12.7 137 137 A R H >> S+ 0 0 153 1,-0.2 4,-3.1 2,-0.2 3,-1.0 0.894 111.0 64.8 -71.5 -41.6 -11.7 36.2 14.3 138 138 A W H 3> S+ 0 0 25 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.862 98.7 51.6 -53.0 -33.5 -10.0 35.8 11.0 139 139 A Y H 34 S+ 0 0 50 -6,-0.3 -1,-0.3 1,-0.2 7,-0.2 0.863 112.4 46.2 -71.7 -29.1 -8.2 39.1 11.6 140 140 A N H << S+ 0 0 107 -3,-1.0 -2,-0.2 -4,-0.8 -1,-0.2 0.869 109.9 57.7 -72.7 -37.4 -7.1 37.8 15.0 141 141 A Q H < S+ 0 0 120 -4,-3.1 -2,-0.2 1,-0.3 -3,-0.2 0.971 127.8 6.7 -49.2 -74.7 -6.1 34.6 13.4 142 142 A T X + 0 0 36 -4,-1.9 4,-0.5 1,-0.1 -1,-0.3 -0.966 69.5 167.7-119.1 99.8 -3.7 35.9 10.9 143 143 A P H > S+ 0 0 53 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.674 79.6 51.3 -87.9 -24.1 -3.2 39.5 11.6 144 144 A N H > S+ 0 0 120 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.904 117.1 40.3 -77.6 -39.6 -0.2 39.8 9.4 145 145 A R H > S+ 0 0 18 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.699 117.9 47.4 -76.5 -26.3 -2.0 38.2 6.6 146 146 A A H X S+ 0 0 0 -4,-0.5 4,-2.0 -7,-0.2 5,-0.2 0.840 104.1 62.1 -89.6 -23.0 -5.2 40.0 7.3 147 147 A K H X S+ 0 0 113 -4,-1.4 4,-2.6 2,-0.2 5,-0.2 0.921 104.1 46.2 -61.1 -53.0 -3.5 43.3 7.6 148 148 A R H X S+ 0 0 56 -4,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.883 112.3 52.4 -59.9 -42.2 -2.2 43.2 3.9 149 149 A V H X S+ 0 0 0 -4,-1.0 4,-1.2 2,-0.2 -1,-0.2 0.957 112.9 41.5 -53.2 -60.9 -5.6 42.2 2.6 150 150 A I H >X S+ 0 0 16 -4,-2.0 4,-3.1 1,-0.2 3,-0.7 0.918 112.0 56.1 -57.8 -52.0 -7.5 45.0 4.3 151 151 A T H 3X S+ 0 0 55 -4,-2.6 4,-2.4 1,-0.3 -1,-0.2 0.904 109.9 46.0 -47.1 -48.4 -4.9 47.5 3.5 152 152 A T H 3X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.3 -1,-0.3 0.689 108.7 51.8 -71.4 -26.1 -5.2 46.6 -0.1 153 153 A F H << S+ 0 0 2 -4,-1.2 -1,-0.2 -3,-0.7 -2,-0.2 0.829 113.0 51.9 -73.3 -28.4 -9.0 46.7 -0.1 154 154 A R H < S+ 0 0 119 -4,-3.1 -2,-0.3 -5,-0.2 -3,-0.2 0.924 122.8 25.7 -64.5 -47.7 -8.2 50.0 1.4 155 155 A T H < S- 0 0 67 -4,-2.4 -3,-0.2 2,-0.2 -2,-0.2 0.835 83.2-138.7 -88.8 -48.2 -5.8 51.1 -1.3 156 156 A G S < S+ 0 0 16 -4,-2.7 2,-0.2 1,-0.4 -62,-0.2 0.689 75.7 87.4 87.2 10.1 -6.7 49.3 -4.6 157 157 A T S S- 0 0 58 -5,-0.2 -1,-0.4 -63,-0.1 3,-0.3 -0.847 85.8-114.0-136.5 170.4 -2.9 48.8 -5.3 158 158 A W S > S+ 0 0 41 -2,-0.2 3,-4.5 1,-0.2 4,-0.1 0.419 74.6 119.0 -90.2 2.7 -0.2 46.3 -4.5 159 159 A D G > S+ 0 0 132 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.777 73.8 50.8 -35.7 -50.0 1.8 48.7 -2.3 160 160 A A G 3 S+ 0 0 29 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.549 88.7 80.9 -71.3 -11.5 1.5 46.6 0.8 161 161 A Y G < 0 0 6 -3,-4.5 -1,-0.3 -13,-0.1 -2,-0.2 0.238 360.0 360.0 -84.1 18.0 2.7 43.6 -1.1 162 162 A K < 0 0 181 -3,-1.1 0, 0.0 -4,-0.1 0, 0.0 -0.848 360.0 360.0-153.6 360.0 6.1 45.0 -0.5 163 !* 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 0.0 164 1 B M 0 0 90 0, 0.0 2,-0.2 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 118.4 18.7 10.3 17.8 165 2 B N > - 0 0 91 1,-0.0 4,-3.9 95,-0.0 5,-0.3 -0.610 360.0 -66.3-133.3-164.1 20.3 11.7 14.8 166 3 B I H > S+ 0 0 34 1,-0.3 4,-3.1 2,-0.2 5,-0.2 0.806 130.4 59.2 -50.4 -28.9 22.6 14.2 13.3 167 4 B F H > S+ 0 0 87 2,-0.2 4,-3.7 3,-0.2 -1,-0.3 0.948 110.9 34.7 -67.2 -54.6 19.9 16.6 14.6 168 5 B E H > S+ 0 0 77 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.863 119.8 52.5 -67.6 -32.3 20.1 15.7 18.2 169 6 B M H X S+ 0 0 0 -4,-3.9 4,-2.6 2,-0.2 -2,-0.2 0.977 114.8 41.3 -68.7 -45.5 23.7 15.2 17.8 170 7 B L H X>S+ 0 0 0 -4,-3.1 4,-2.7 -5,-0.3 5,-1.4 0.925 110.6 55.0 -68.3 -40.0 24.0 18.6 16.3 171 8 B R H X5S+ 0 0 111 -4,-3.7 4,-1.2 1,-0.2 -1,-0.2 0.952 113.6 45.0 -54.5 -50.1 21.7 20.3 18.6 172 9 B I H <5S+ 0 0 52 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.932 124.7 31.1 -60.7 -45.6 23.9 18.9 21.3 173 10 B D H <5S+ 0 0 22 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.934 134.9 26.8 -76.8 -53.4 27.2 19.8 19.7 174 11 B E H <5S- 0 0 43 -4,-2.7 19,-0.5 -5,-0.2 -3,-0.2 0.762 100.8-147.8 -82.3 -29.3 26.2 23.0 17.8 175 12 B G << - 0 0 18 -5,-1.4 2,-0.4 -4,-1.2 -1,-0.1 -0.108 11.2-101.9 81.0-177.7 23.3 24.0 20.1 176 13 B L + 0 0 66 16,-0.2 2,-0.4 -4,-0.1 16,-0.2 -0.971 37.8 164.9-145.7 132.9 20.2 25.8 19.1 177 14 B R E -D 191 0C 159 14,-1.2 14,-2.1 -2,-0.4 4,-0.1 -0.987 26.2-154.5-150.5 134.4 19.2 29.3 19.4 178 15 B L E S+ 0 0 57 -2,-0.4 43,-1.9 12,-0.2 2,-0.3 0.521 78.5 60.5 -85.0 -10.8 16.4 31.4 17.8 179 16 B K E S-F 220 0D 135 41,-0.2 41,-0.3 12,-0.1 12,-0.2 -0.797 101.7 -82.4-114.9 158.2 18.0 34.8 18.1 180 17 B I E + 0 0 21 39,-3.4 2,-0.3 -2,-0.3 10,-0.2 -0.314 60.9 177.3 -55.5 138.2 21.3 36.1 16.7 181 18 B Y E -D 189 0C 47 8,-3.0 8,-4.5 -4,-0.1 2,-0.5 -0.959 31.2-115.9-145.4 164.1 24.1 35.0 19.0 182 19 B K E -D 188 0C 124 -2,-0.3 6,-0.2 6,-0.2 5,-0.2 -0.869 28.6-144.8-105.2 126.8 27.8 35.1 19.5 183 20 B D - 0 0 44 4,-2.6 -1,-0.1 -2,-0.5 6,-0.0 0.044 36.9 -88.8 -75.0-170.0 29.7 31.9 19.5 184 21 B T S S+ 0 0 141 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.630 130.2 54.0 -76.3 -17.2 32.8 31.1 21.6 185 22 B E S S- 0 0 122 2,-0.1 -1,-0.2 0, 0.0 -3,-0.0 0.791 122.7-109.7 -80.8 -32.3 35.0 32.5 18.9 186 23 B G S S+ 0 0 18 1,-0.3 -2,-0.1 -5,-0.0 3,-0.1 0.031 72.7 134.9 120.2 -13.1 33.0 35.6 19.1 187 24 B Y - 0 0 80 -5,-0.2 -4,-2.6 1,-0.1 2,-0.5 -0.118 62.5 -97.9 -66.2 155.6 31.1 35.3 15.7 188 25 B Y E +DE 182 197C 44 9,-1.3 8,-3.6 11,-0.3 9,-0.9 -0.575 53.4 168.6 -81.5 126.0 27.5 35.9 15.0 189 26 B T E +DE 181 195C 4 -8,-4.5 -8,-3.0 -2,-0.5 2,-0.3 -0.942 15.1 178.0-137.9 156.2 25.6 32.7 14.9 190 27 B I E > + E 0 194C 2 4,-2.1 4,-3.2 -2,-0.3 2,-0.2 -0.961 49.9 11.6-156.0 165.5 22.2 31.4 14.9 191 28 B G E 4 S-D 177 0C 1 -14,-2.1 -14,-1.2 -2,-0.3 2,-1.1 -0.391 123.9 -14.7 67.7-135.0 20.1 28.2 14.7 192 29 B I T 4 S- 0 0 6 34,-0.3 -17,-0.2 -16,-0.2 -16,-0.2 -0.782 129.5 -47.8-106.6 85.9 22.2 25.1 15.2 193 30 B G T 4 S+ 0 0 16 -2,-1.1 2,-0.9 -19,-0.5 -2,-0.2 0.817 83.8 165.5 55.6 40.6 25.5 26.6 14.7 194 31 B H E < -E 190 0C 33 -4,-3.2 -4,-2.1 -20,-0.1 2,-0.3 -0.742 31.9-138.7 -88.8 110.6 24.7 28.4 11.6 195 32 B L E -E 189 0C 76 -2,-0.9 -6,-0.2 -6,-0.2 3,-0.1 -0.527 22.7-179.3 -67.5 128.2 27.5 30.9 11.1 196 33 B L E - 0 0 11 -8,-3.6 2,-0.3 1,-0.4 -7,-0.2 0.908 61.4 -40.9 -89.5 -46.3 26.2 34.4 10.0 197 34 B T E -E 188 0C 27 -9,-0.9 -9,-1.3 2,-0.1 -1,-0.4 -0.934 33.5-129.2-172.0 162.2 29.6 36.2 9.6 198 35 B K S S+ 0 0 140 -2,-0.3 -1,-0.0 -11,-0.2 -2,-0.0 0.625 75.4 115.1 -92.7 -17.9 33.1 36.7 11.3 199 36 B S S S- 0 0 60 1,-0.1 2,-1.6 -11,-0.1 -11,-0.3 -0.122 74.7-121.4 -57.7 139.2 32.6 40.5 11.2 200 37 B P S S+ 0 0 128 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.488 80.9 91.1 -82.7 65.0 32.2 42.7 14.4 201 38 B S > - 0 0 47 -2,-1.6 4,-0.9 -4,-0.1 -13,-0.1 -0.862 60.2-153.9-161.7 119.4 28.8 44.2 13.6 202 39 B L H > S+ 0 0 77 -2,-0.3 4,-3.2 1,-0.2 5,-0.1 0.666 98.4 56.0 -74.9 -12.5 25.3 42.9 14.5 203 40 B N H > S+ 0 0 119 2,-0.3 4,-3.6 1,-0.2 5,-0.2 0.824 102.4 53.9 -81.6 -40.5 23.7 44.7 11.5 204 41 B A H > S+ 0 0 34 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.892 115.0 44.1 -57.6 -33.6 26.0 42.9 9.2 205 42 B A H X S+ 0 0 0 -4,-0.9 4,-2.9 2,-0.2 -2,-0.3 0.914 111.7 48.9 -74.7 -53.6 24.5 39.9 11.1 206 43 B K H X S+ 0 0 37 -4,-3.2 4,-3.1 1,-0.2 13,-0.3 0.945 114.9 50.5 -49.5 -46.5 21.0 41.1 11.0 207 44 B S H X S+ 0 0 79 -4,-3.6 4,-1.2 2,-0.2 -2,-0.2 0.844 107.9 47.6 -60.9 -47.7 21.7 41.6 7.3 208 45 B E H X S+ 0 0 99 -4,-1.8 4,-2.0 -5,-0.2 3,-0.3 0.963 114.6 50.9 -59.4 -48.3 23.1 38.3 6.6 209 46 B L H >X S+ 0 0 3 -4,-2.9 4,-0.8 1,-0.2 3,-0.6 0.976 102.2 54.4 -53.1 -69.7 20.2 36.8 8.4 210 47 B D H 3X>S+ 0 0 35 -4,-3.1 4,-1.1 1,-0.2 5,-1.0 0.783 113.1 48.5 -38.0 -38.5 17.3 38.5 6.7 211 48 B K H 3<5S+ 0 0 177 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.867 105.5 49.5 -76.6 -43.5 18.7 37.3 3.4 212 49 B A H <<5S+ 0 0 51 -4,-2.0 -1,-0.2 -3,-0.6 -2,-0.2 0.408 122.0 42.6 -73.2 1.7 19.4 33.6 3.9 213 50 B I H <5S- 0 0 31 -4,-0.8 -2,-0.2 -3,-0.3 -1,-0.2 0.590 101.3-133.4-117.2 -26.9 15.9 33.7 5.2 214 51 B G T <5S+ 0 0 72 -4,-1.1 2,-0.3 -5,-0.3 -3,-0.2 0.511 75.8 74.2 82.7 4.9 14.1 35.8 2.7 215 52 B R S > - 0 0 73 -2,-0.3 3,-2.6 1,-0.1 4,-1.2 -0.620 43.7-108.1 -93.4 143.2 10.8 30.5 13.7 223 60 B K H 3> S+ 0 0 156 1,-0.3 4,-1.9 -2,-0.2 3,-0.2 0.865 120.6 43.0 -50.3 -36.3 11.7 26.9 14.6 224 61 B D H 3> S+ 0 0 94 2,-0.3 4,-1.8 1,-0.2 -1,-0.3 0.549 104.9 63.3 -90.5 3.2 11.4 25.6 11.2 225 62 B E H <4 S+ 0 0 30 -3,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.599 108.9 44.3 -88.2 -20.5 13.2 28.6 9.8 226 63 B A H X S+ 0 0 5 -4,-1.2 4,-1.9 -3,-0.2 -34,-0.3 0.815 109.4 57.2 -87.6 -36.0 15.8 27.2 11.8 227 64 B E H >X S+ 0 0 48 -4,-1.9 4,-3.7 -5,-0.2 3,-0.6 0.994 105.4 49.0 -56.2 -73.1 15.1 23.6 10.5 228 65 B K H 3< S+ 0 0 52 -4,-1.8 2,-0.3 1,-0.2 0, 0.0 -0.694 109.5 50.0 -69.2 137.2 15.5 24.4 7.0 229 66 B L H 3> S+ 0 0 9 -2,-0.2 4,-2.4 -38,-0.0 -1,-0.2 -0.812 112.8 46.8 127.4 -66.1 18.8 26.1 7.3 230 67 B F H S+ 0 0 54 -4,-0.4 4,-2.2 -3,-0.4 -1,-0.2 0.916 108.7 50.7 -72.7 -48.2 26.4 21.1 2.5 237 74 B A H X S+ 0 0 8 -4,-2.8 4,-1.6 2,-0.2 -2,-0.2 0.964 114.3 42.0 -55.3 -55.8 28.3 19.0 4.9 238 75 B V H X S+ 0 0 20 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.981 113.0 51.2 -61.7 -50.8 27.3 15.7 3.2 239 76 B R H X S+ 0 0 170 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.920 105.1 61.6 -54.3 -31.2 27.7 16.9 -0.3 240 77 B G H >X S+ 0 0 2 -4,-2.2 4,-0.8 1,-0.2 3,-0.5 0.960 105.5 43.0 -54.2 -60.7 31.1 18.0 0.9 241 78 B I H >< S+ 0 0 0 -4,-1.6 3,-1.0 1,-0.2 7,-0.4 0.905 111.8 53.8 -55.9 -45.6 32.3 14.5 1.7 242 79 B L H 3< S+ 0 0 67 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.867 106.1 53.1 -64.0 -24.9 30.8 13.0 -1.4 243 80 B R H << S+ 0 0 173 -4,-1.9 2,-0.8 -3,-0.5 -1,-0.3 0.637 95.4 91.1 -76.2 -21.9 32.7 15.6 -3.5 244 81 B N S+ 0 0 105 2,-0.1 4,-0.5 3,-0.1 -1,-0.2 0.764 120.7 36.4 -87.0 -34.3 39.6 11.2 0.3 247 84 B L H > S+ 0 0 0 -3,-0.3 4,-2.7 -6,-0.2 5,-0.2 0.852 103.1 70.6 -90.5 -32.4 36.5 11.4 2.3 248 85 B K H X S+ 0 0 77 -4,-3.4 4,-2.4 -7,-0.4 5,-0.3 0.914 99.7 45.1 -45.1 -65.2 34.1 9.7 -0.0 249 86 B P H > S+ 0 0 53 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.831 113.9 51.6 -46.0 -44.4 35.5 6.1 0.3 250 87 B V H X S+ 0 0 3 -4,-0.5 4,-1.0 2,-0.2 -2,-0.2 0.956 110.4 47.8 -62.3 -50.3 35.8 6.4 4.1 251 88 B Y H >< S+ 0 0 39 -4,-2.7 3,-1.8 1,-0.2 -1,-0.2 0.955 110.2 49.7 -53.1 -59.1 32.2 7.6 4.4 252 89 B D H 3< S+ 0 0 76 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.886 108.9 56.7 -46.7 -43.9 30.7 4.8 2.3 253 90 B S H 3< S+ 0 0 36 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.776 97.0 85.6 -66.1 -24.1 32.7 2.4 4.3 254 91 B L S << S- 0 0 13 -3,-1.8 2,-0.2 -4,-1.0 31,-0.0 -0.203 74.0-117.0 -83.2 172.3 31.2 3.5 7.6 255 92 B D > - 0 0 57 1,-0.0 4,-3.1 -2,-0.0 5,-0.3 -0.549 41.2 -95.3 -93.3 164.5 28.1 2.7 9.6 256 93 B A H > S+ 0 0 78 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.841 125.7 49.6 -45.6 -52.7 25.2 5.1 10.4 257 94 B V H > S+ 0 0 23 2,-0.2 4,-1.1 62,-0.2 -1,-0.2 0.930 115.2 41.7 -55.4 -52.7 26.8 5.9 13.8 258 95 B R H > S+ 0 0 28 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.850 112.1 54.6 -70.8 -35.4 30.3 6.6 12.4 259 96 B R H X S+ 0 0 65 -4,-3.1 4,-2.1 1,-0.2 3,-0.3 0.948 101.3 58.4 -62.1 -44.0 29.1 8.5 9.4 260 97 B A H X S+ 0 0 9 -4,-2.3 4,-1.3 -5,-0.3 -1,-0.2 0.904 107.0 51.9 -51.0 -36.7 27.1 10.8 11.8 261 98 B M H X S+ 0 0 0 -4,-1.1 4,-1.9 1,-0.2 -1,-0.2 0.839 107.4 47.1 -64.2 -45.8 30.6 11.5 13.3 262 99 B L H X S+ 0 0 3 -4,-1.8 4,-2.4 -3,-0.3 -1,-0.2 0.811 110.1 54.3 -70.3 -31.0 32.4 12.5 10.1 263 100 B I H X S+ 0 0 16 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.863 106.3 52.8 -68.6 -35.0 29.6 14.6 9.1 264 101 B N H X S+ 0 0 0 -4,-1.3 4,-2.3 -5,-0.3 -2,-0.2 0.920 109.9 47.6 -66.1 -42.7 29.9 16.4 12.4 265 102 B M H X S+ 0 0 4 -4,-1.9 4,-3.4 2,-0.2 5,-0.2 0.921 114.5 45.8 -61.6 -51.5 33.7 17.0 11.8 266 103 B V H X S+ 0 0 8 -4,-2.4 4,-3.1 2,-0.2 -1,-0.2 0.882 112.0 53.2 -57.4 -43.0 33.1 18.3 8.3 267 104 B F H < S+ 0 0 35 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.919 116.5 39.3 -57.2 -46.4 30.2 20.4 9.7 268 105 B Q H < S+ 0 0 55 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.884 134.2 16.6 -73.2 -42.6 32.5 21.9 12.2 269 106 B M H < S- 0 0 52 -4,-3.4 4,-0.5 1,-0.2 -3,-0.2 0.609 99.8-107.1-114.4 -12.3 35.6 22.2 10.1 270 107 B G X - 0 0 30 -4,-3.1 4,-2.1 -5,-0.2 5,-0.2 -0.061 37.9 -82.8 101.9 154.0 34.9 22.0 6.4 271 108 B E H > S+ 0 0 53 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.963 129.7 49.1 -58.8 -50.0 35.7 19.3 3.9 272 109 B T H > S+ 0 0 123 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.953 107.8 53.9 -58.8 -47.9 39.2 20.5 3.5 273 110 B G H 4 S+ 0 0 32 -4,-0.5 3,-0.5 2,-0.2 -1,-0.2 0.928 114.2 41.9 -52.7 -45.9 39.8 20.7 7.2 274 111 B V H >< S+ 0 0 1 -4,-2.1 3,-2.9 1,-0.2 -2,-0.2 0.998 105.5 59.7 -65.5 -64.2 38.7 17.1 7.7 275 112 B A H 3< S+ 0 0 13 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.684 91.8 77.9 -38.4 -21.1 40.5 15.5 4.6 276 113 B G T 3< S+ 0 0 55 -4,-1.2 2,-2.0 -3,-0.5 -1,-0.3 0.672 70.4 80.9 -66.1 -19.0 43.7 16.8 6.3 277 114 B F <> + 0 0 50 -3,-2.9 4,-1.4 -4,-0.2 -1,-0.2 -0.507 60.6 167.6 -91.2 71.8 43.8 13.9 8.8 278 115 B T H > + 0 0 81 -2,-2.0 4,-0.6 1,-0.2 3,-0.3 0.927 68.2 42.7 -47.9 -60.4 45.4 11.5 6.3 279 116 B N H >> S+ 0 0 95 -3,-0.2 4,-1.5 1,-0.2 3,-0.9 0.883 111.7 50.5 -60.6 -49.0 46.3 8.8 8.7 280 117 B S H 3> S+ 0 0 10 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.757 104.8 58.7 -66.0 -24.2 43.2 8.6 10.9 281 118 B L H 3X S+ 0 0 14 -4,-1.4 4,-0.9 -3,-0.3 -1,-0.2 0.623 104.4 53.6 -70.0 -27.5 40.9 8.4 7.8 282 119 B R H S+ 0 0 6 -4,-1.5 5,-2.8 2,-0.2 4,-0.4 0.901 108.7 56.8 -66.0 -40.9 42.3 3.5 10.1 284 121 B L H ><5S+ 0 0 6 -4,-1.9 3,-1.1 1,-0.3 -1,-0.2 0.928 110.6 45.7 -50.2 -45.3 38.7 4.5 10.1 285 122 B Q H 3<5S+ 0 0 83 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.731 112.3 50.7 -69.1 -26.9 38.6 2.7 6.8 286 123 B Q T 3<5S- 0 0 72 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.296 114.9-111.6 -97.2 6.7 40.5 -0.2 8.2 287 124 B K T < 5S+ 0 0 121 -3,-1.1 2,-0.6 -4,-0.4 3,-0.2 0.684 73.9 141.6 68.8 18.0 38.3 -0.6 11.1 288 125 B R >>< + 0 0 113 -5,-2.8 4,-1.6 1,-0.2 3,-0.9 -0.113 16.3 161.7 -83.6 32.4 41.2 0.5 13.3 289 126 B W H 3> + 0 0 44 -2,-0.6 4,-2.5 -6,-0.2 -1,-0.2 0.734 66.5 50.2 -24.5 -54.3 39.0 2.5 15.6 290 127 B D H 3> S+ 0 0 98 -3,-0.2 4,-3.3 1,-0.2 5,-0.3 0.954 110.6 47.4 -57.4 -51.4 41.5 2.8 18.6 291 128 B E H <> S+ 0 0 110 -3,-0.9 4,-2.4 1,-0.2 -1,-0.2 0.918 112.3 49.6 -55.5 -48.1 44.3 4.0 16.6 292 129 B A H X S+ 0 0 0 -4,-1.6 4,-3.2 2,-0.2 -1,-0.2 0.898 111.5 50.2 -59.0 -43.8 42.3 6.6 14.8 293 130 B A H X S+ 0 0 9 -4,-2.5 4,-2.9 -5,-0.3 3,-0.3 0.998 110.9 48.5 -56.4 -66.5 41.0 7.8 18.1 294 131 B V H < S+ 0 0 73 -4,-3.3 4,-0.5 1,-0.3 -2,-0.2 0.819 114.2 46.8 -36.2 -51.3 44.5 8.0 19.6 295 132 B N H >< S+ 0 0 59 -4,-2.4 3,-1.0 -5,-0.3 4,-0.4 0.916 112.2 49.3 -65.3 -44.4 45.7 9.9 16.5 296 133 B L H >< S+ 0 0 8 -4,-3.2 3,-1.9 -3,-0.3 6,-0.4 0.902 101.2 63.8 -64.5 -37.7 42.7 12.2 16.6 297 134 B A T 3< S+ 0 0 44 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.657 100.3 53.8 -59.9 -17.1 43.1 13.0 20.3 298 135 B K T < S+ 0 0 150 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.510 88.9 107.6 -92.3 -10.2 46.5 14.6 19.5 299 136 B S S X> S- 0 0 22 -3,-1.9 4,-1.7 -4,-0.4 3,-0.7 -0.289 79.4-119.8 -71.3 160.2 45.1 17.0 16.8 300 137 B R H 3> S+ 0 0 143 1,-0.3 4,-3.1 2,-0.2 5,-0.1 0.774 115.8 64.9 -64.4 -30.3 44.7 20.8 17.2 301 138 B W H 3> S+ 0 0 11 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.915 103.8 46.0 -58.2 -42.0 41.0 20.2 16.6 302 139 B Y H <4 S+ 0 0 64 -3,-0.7 -2,-0.2 -6,-0.4 -1,-0.2 0.893 111.3 49.0 -72.5 -45.3 41.1 18.3 19.9 303 140 B N H < S+ 0 0 132 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.950 114.9 50.3 -59.5 -40.3 43.1 21.0 21.9 304 141 B Q H < S+ 0 0 128 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.911 130.3 10.2 -61.4 -49.1 40.5 23.5 20.4 305 142 B T X + 0 0 46 -4,-2.4 4,-4.3 -5,-0.1 -1,-0.2 -0.549 69.4 161.2-133.2 68.2 37.2 21.7 21.4 306 143 B P H > S+ 0 0 45 0, 0.0 4,-3.1 0, 0.0 5,-0.3 0.810 74.4 56.8 -58.3 -31.7 38.0 18.8 23.7 307 144 B N H > S+ 0 0 117 2,-0.2 4,-1.3 1,-0.2 -2,-0.1 0.975 117.7 32.8 -67.6 -47.5 34.5 18.6 25.0 308 145 B R H > S+ 0 0 22 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.973 117.5 53.7 -72.7 -50.6 33.2 18.1 21.7 309 146 B A H X S+ 0 0 0 -4,-4.3 4,-2.6 1,-0.2 5,-0.3 0.934 105.0 56.7 -51.2 -47.3 36.2 16.2 20.3 310 147 B K H X S+ 0 0 100 -4,-3.1 4,-2.9 -5,-0.2 5,-0.3 0.951 106.7 49.8 -50.0 -47.4 36.1 13.7 23.2 311 148 B R H X S+ 0 0 60 -4,-1.3 4,-1.6 -5,-0.3 -1,-0.2 0.937 113.2 44.7 -54.7 -48.8 32.5 12.8 22.3 312 149 B V H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.906 113.5 50.2 -60.9 -49.2 33.1 12.2 18.7 313 150 B I H X S+ 0 0 16 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.910 109.5 49.4 -59.7 -47.4 36.2 10.3 19.3 314 151 B T H X S+ 0 0 59 -4,-2.9 4,-2.7 -5,-0.3 5,-0.3 0.843 110.6 52.7 -60.7 -35.2 34.6 8.0 21.7 315 152 B T H X S+ 0 0 0 -4,-1.6 4,-2.5 -5,-0.3 -1,-0.2 0.817 103.2 55.5 -68.8 -36.9 31.8 7.4 19.3 316 153 B F H < S+ 0 0 2 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.823 114.4 43.3 -64.9 -33.3 34.1 6.5 16.6 317 154 B R H < S+ 0 0 108 -4,-1.8 -2,-0.2 -5,-0.2 -3,-0.1 0.995 124.4 29.4 -72.7 -67.0 35.4 4.0 18.9 318 155 B T H < S- 0 0 56 -4,-2.7 -3,-0.2 2,-0.1 -2,-0.2 0.766 84.8-149.9 -65.5 -37.9 32.2 2.6 20.5 319 156 B G < + 0 0 17 -4,-2.5 2,-0.3 1,-0.3 -62,-0.2 0.835 62.9 104.6 65.9 29.7 30.0 3.2 17.5 320 157 B T S S- 0 0 46 -5,-0.2 3,-0.3 -6,-0.1 -1,-0.3 -0.924 81.0-119.4-132.6 156.4 27.1 3.6 19.8 321 158 B W S > S+ 0 0 45 -2,-0.3 3,-2.8 1,-0.2 2,-1.0 0.604 71.3 123.1 -76.3 -9.5 25.4 6.8 20.8 322 159 B D T 3 + 0 0 125 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 0.485 68.2 60.3 -26.6 -14.4 26.1 6.4 24.5 323 160 B A T 3 S+ 0 0 38 -2,-1.0 2,-0.6 -3,-0.3 -1,-0.3 0.817 88.9 66.8 -93.7 -27.4 27.9 9.7 24.7 324 161 B Y < 0 0 10 -3,-2.8 -1,-0.2 1,-0.2 -2,-0.1 -0.301 360.0 360.0 -87.5 45.2 25.1 12.0 23.5 325 162 B K 0 0 184 -2,-0.6 -1,-0.2 -3,-0.3 -3,-0.1 0.276 360.0 360.0-101.6 360.0 22.9 11.4 26.7