==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-JUN-11 3SB7 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR A.B.SORIAGA,A.LAGANOWSKY,M.ZHAO,M.R.SAWAYA,D.CASCIO,T.O.YEAT . 325 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15186.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 225 69.2 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 . 26 8.0 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 . 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 . 12 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 163 50.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.2 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 1 3 2 0 3 3 0 0 3 1 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 . 3 0 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 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 0 A P 0 0 170 0, 0.0 5,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 115.6 -25.0 -6.2 40.5 2 1 A M + 0 0 46 4,-0.1 2,-0.3 3,-0.1 157,-0.0 -0.354 360.0 146.9 -71.5 143.5 -25.8 -9.2 38.3 3 2 A N > - 0 0 69 -2,-0.1 4,-2.6 156,-0.0 5,-0.1 -0.898 62.2 -79.8-157.1-175.9 -28.1 -8.9 35.3 4 3 A I H > S+ 0 0 21 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.807 124.3 56.1 -67.2 -29.6 -28.7 -10.4 31.9 5 4 A F H > S+ 0 0 50 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.918 112.8 39.7 -68.8 -44.1 -26.0 -8.1 30.3 6 5 A E H > S+ 0 0 21 2,-0.2 4,-1.2 1,-0.2 -2,-0.2 0.914 113.9 55.8 -69.0 -43.9 -23.3 -9.3 32.7 7 6 A M H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 3,-0.5 0.913 110.6 43.3 -53.8 -49.6 -24.5 -12.9 32.5 8 7 A L H X>S+ 0 0 0 -4,-2.1 4,-3.5 1,-0.2 5,-0.6 0.824 107.1 59.4 -70.5 -33.4 -24.2 -13.1 28.7 9 8 A R H <5S+ 0 0 70 -4,-1.4 4,-0.4 1,-0.2 -1,-0.2 0.758 110.9 43.8 -66.4 -24.1 -20.8 -11.3 28.7 10 9 A I H <5S+ 0 0 17 -4,-1.2 -2,-0.2 -3,-0.5 -1,-0.2 0.843 118.3 43.2 -85.5 -39.9 -19.6 -14.2 30.8 11 10 A D H <5S+ 0 0 13 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.921 128.9 26.2 -70.4 -46.8 -21.3 -16.9 28.8 12 11 A E T <5S- 0 0 36 -4,-3.5 -3,-0.2 -5,-0.1 19,-0.2 0.912 94.4-153.3 -85.3 -48.3 -20.5 -15.5 25.3 13 12 A G < - 0 0 0 -5,-0.6 2,-0.4 -4,-0.4 18,-0.3 -0.036 21.9 -81.5 86.3 164.1 -17.3 -13.6 25.9 14 13 A L B +A 177 0A 12 163,-1.7 163,-1.7 16,-0.2 2,-0.3 -0.884 40.2 171.5-111.8 134.2 -16.0 -10.6 23.9 15 14 A R E -B 29 0B 29 14,-0.7 14,-2.4 -2,-0.4 4,-0.1 -0.995 14.7-166.8-138.0 134.2 -14.1 -10.6 20.6 16 15 A L E + 0 0 33 -2,-0.3 43,-2.1 12,-0.2 2,-0.3 0.450 69.5 62.9-104.8 -3.0 -13.4 -7.4 18.6 17 16 A K E S-D 58 0C 86 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.915 96.3 -89.7-119.9 151.4 -12.2 -9.0 15.3 18 17 A I E + 0 0 6 39,-1.8 2,-0.3 -2,-0.3 10,-0.2 -0.289 55.7 166.0 -57.9 137.7 -14.3 -11.1 12.9 19 18 A Y E -B 27 0B 11 8,-2.2 8,-4.5 -4,-0.1 2,-0.4 -0.986 37.3-108.1-151.3 156.8 -14.0 -14.8 13.7 20 19 A K E -B 26 0B 38 305,-0.9 6,-0.3 -2,-0.3 5,-0.1 -0.723 31.9-132.8 -86.1 135.1 -15.7 -18.1 12.8 21 20 A D > - 0 0 36 4,-2.9 3,-1.8 -2,-0.4 -1,-0.1 -0.197 45.3 -81.4 -71.7 178.0 -17.8 -19.8 15.5 22 21 A T T 3 S+ 0 0 70 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.694 136.3 51.8 -59.2 -17.5 -17.3 -23.5 16.2 23 22 A E T 3 S- 0 0 133 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.653 123.8-104.5 -89.6 -19.8 -19.6 -24.2 13.2 24 23 A G S < S+ 0 0 30 -3,-1.8 2,-0.4 1,-0.3 -2,-0.1 0.449 72.9 141.1 108.8 4.8 -17.5 -21.9 10.9 25 24 A Y - 0 0 62 1,-0.1 -4,-2.9 -5,-0.1 -1,-0.3 -0.649 58.1-111.6 -83.0 132.6 -19.9 -18.9 10.9 26 25 A Y E +BC 20 35B 11 9,-0.9 8,-2.7 11,-0.4 9,-1.1 -0.450 48.9 168.1 -67.2 127.6 -18.3 -15.5 11.0 27 26 A T E -BC 19 33B 6 -8,-4.5 -8,-2.2 6,-0.2 2,-0.3 -0.821 15.1-176.4-136.6 169.2 -19.1 -13.7 14.2 28 27 A I E > + C 0 32B 0 4,-1.4 4,-2.5 -2,-0.3 -12,-0.2 -0.984 47.9 9.3-163.8 164.0 -18.1 -10.7 16.3 29 28 A G E 4 S-B 15 0B 0 -14,-2.4 2,-1.6 -2,-0.3 -14,-0.7 -0.321 122.9 -7.6 64.1-142.8 -18.6 -8.8 19.6 30 29 A I T 4 S- 0 0 3 34,-0.5 -1,-0.2 -16,-0.2 -16,-0.2 -0.604 129.8 -53.0 -86.5 76.1 -20.6 -10.7 22.3 31 30 A G T 4 S+ 0 0 20 -2,-1.6 2,-0.8 -18,-0.3 -2,-0.2 0.867 84.4 162.4 61.1 43.6 -21.7 -13.6 20.0 32 31 A H E < -C 28 0B 35 -4,-2.5 -4,-1.4 32,-0.0 2,-0.2 -0.837 30.8-142.8 -98.8 107.2 -23.1 -11.5 17.2 33 32 A L E -C 27 0B 76 -2,-0.8 -6,-0.2 -6,-0.2 3,-0.1 -0.473 18.3-177.2 -70.0 130.8 -23.5 -13.7 14.0 34 33 A L E - 0 0 15 -8,-2.7 2,-0.3 1,-0.3 -7,-0.2 0.879 59.9 -26.8 -93.8 -49.8 -22.7 -11.8 10.8 35 34 A T E -C 26 0B 23 -9,-1.1 -9,-0.9 2,-0.1 -1,-0.3 -0.981 33.8-135.7-165.4 153.9 -23.4 -14.4 8.1 36 35 A K S S+ 0 0 144 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.519 75.8 112.2 -86.5 -8.8 -23.5 -18.1 7.3 37 36 A S S S- 0 0 52 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.387 74.5-131.5 -67.5 141.3 -21.7 -17.4 4.1 38 37 A P S S+ 0 0 123 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.163 78.1 106.3 -78.7 19.9 -18.1 -18.7 3.8 39 38 A S > - 0 0 45 1,-0.2 4,-1.7 -13,-0.0 3,-0.3 -0.902 55.4-164.2-107.3 116.5 -17.1 -15.2 2.6 40 39 A L H > S+ 0 0 47 -2,-0.6 4,-2.5 1,-0.2 5,-0.2 0.826 97.1 58.3 -60.0 -31.7 -15.1 -13.0 4.9 41 40 A N H > S+ 0 0 121 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.843 103.2 50.4 -67.6 -35.6 -16.1 -10.2 2.5 42 41 A A H > S+ 0 0 28 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.852 112.0 48.6 -68.6 -35.4 -19.8 -10.9 3.1 43 42 A A H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.888 112.5 47.4 -69.9 -40.9 -19.1 -10.8 6.8 44 43 A K H X S+ 0 0 55 -4,-2.5 4,-2.4 2,-0.2 11,-0.3 0.864 111.9 50.9 -67.9 -37.1 -17.2 -7.5 6.5 45 44 A S H X S+ 0 0 67 -4,-2.3 4,-1.2 2,-0.2 -2,-0.2 0.917 112.5 46.1 -64.5 -45.1 -20.0 -6.1 4.3 46 45 A E H X S+ 0 0 98 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.885 112.6 50.8 -64.4 -40.9 -22.6 -7.1 6.9 47 46 A L H >X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 3,-0.7 0.937 108.3 50.8 -63.1 -48.6 -20.5 -5.7 9.7 48 47 A D H 3X>S+ 0 0 39 -4,-2.4 4,-1.9 1,-0.3 5,-0.6 0.783 109.3 53.1 -60.0 -28.5 -20.1 -2.3 8.0 49 48 A K H 3<5S+ 0 0 104 -4,-1.2 -1,-0.3 2,-0.2 -2,-0.2 0.754 111.3 45.3 -79.2 -25.7 -23.8 -2.2 7.5 50 49 A A H <<5S+ 0 0 44 -4,-1.2 -2,-0.2 -3,-0.7 -1,-0.2 0.819 122.4 34.7 -84.9 -34.4 -24.5 -2.8 11.2 51 50 A I H <5S- 0 0 41 -4,-2.3 -2,-0.2 2,-0.2 -3,-0.2 0.872 100.2-127.5 -89.2 -42.7 -21.9 -0.3 12.5 52 51 A G T <5S+ 0 0 64 -4,-1.9 2,-0.3 1,-0.4 -3,-0.2 0.714 74.3 68.9 99.7 26.6 -22.1 2.4 9.8 53 52 A R S - 0 0 7 -2,-1.4 3,-1.3 -11,-0.3 -1,-0.2 0.775 28.9-151.2 -82.4 -29.1 -14.6 -1.4 10.0 56 55 A N T 3 S- 0 0 103 1,-0.3 3,-0.1 -12,-0.2 -2,-0.1 0.900 74.0 -52.5 53.2 44.0 -12.4 -3.8 8.0 57 56 A G T 3 S+ 0 0 7 -13,-0.2 -39,-1.8 1,-0.1 2,-0.4 0.539 122.0 100.1 75.1 8.2 -13.3 -6.6 10.4 58 57 A V B < +D 17 0C 63 -3,-1.3 2,-0.2 -41,-0.2 -41,-0.2 -0.990 42.7 169.2-132.0 130.8 -12.4 -4.6 13.5 59 58 A I - 0 0 6 -43,-2.1 2,-0.2 -2,-0.4 -30,-0.1 -0.794 30.0-105.8-129.7 174.4 -14.7 -2.7 15.9 60 59 A T > - 0 0 53 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.500 32.2-107.3 -97.8 168.9 -14.4 -1.1 19.3 61 60 A K H > S+ 0 0 94 1,-0.2 4,-1.0 2,-0.2 5,-0.1 0.860 120.6 49.8 -62.0 -36.6 -15.7 -2.2 22.7 62 61 A H H > S+ 0 0 135 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.773 109.2 50.9 -77.9 -26.4 -18.5 0.4 22.7 63 62 A E H > S+ 0 0 29 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.866 108.5 52.9 -72.0 -38.1 -19.6 -0.6 19.2 64 63 A A H X S+ 0 0 1 -4,-2.1 4,-1.6 1,-0.2 -34,-0.5 0.777 106.2 54.6 -66.3 -27.3 -19.7 -4.2 20.4 65 64 A E H X S+ 0 0 39 -4,-1.0 4,-2.4 2,-0.2 -1,-0.2 0.833 103.6 54.5 -74.7 -33.9 -21.9 -3.0 23.3 66 65 A H H X S+ 0 0 125 -4,-1.1 4,-2.1 2,-0.2 -2,-0.2 0.924 111.7 42.9 -67.3 -45.7 -24.4 -1.4 20.9 67 66 A L H X S+ 0 0 6 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.908 112.9 55.3 -62.4 -42.2 -24.9 -4.7 18.9 68 67 A F H X S+ 0 0 2 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.898 108.4 47.2 -57.2 -44.8 -25.0 -6.5 22.2 69 68 A N H X S+ 0 0 65 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.907 111.4 50.1 -65.4 -43.6 -27.8 -4.3 23.5 70 69 A Q H X S+ 0 0 93 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.885 112.1 49.4 -60.4 -39.8 -29.8 -4.7 20.3 71 70 A D H X S+ 0 0 37 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.910 110.7 47.6 -68.8 -45.1 -29.3 -8.5 20.5 72 71 A V H X S+ 0 0 3 -4,-2.4 4,-2.2 1,-0.2 5,-0.2 0.946 113.0 49.8 -59.0 -48.9 -30.5 -8.7 24.1 73 72 A D H X S+ 0 0 91 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.885 109.1 53.3 -55.2 -41.6 -33.5 -6.5 23.3 74 73 A A H X S+ 0 0 58 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.863 108.3 48.8 -63.4 -39.1 -34.2 -8.8 20.3 75 74 A A H X S+ 0 0 9 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.892 113.0 46.5 -70.0 -41.6 -34.2 -11.9 22.5 76 75 A V H X S+ 0 0 32 -4,-2.2 4,-2.1 2,-0.2 3,-0.3 0.939 112.9 49.3 -63.6 -48.8 -36.5 -10.4 25.1 77 76 A H H X S+ 0 0 106 -4,-2.7 4,-1.2 1,-0.2 -1,-0.2 0.805 108.4 56.3 -59.5 -30.6 -38.9 -9.1 22.4 78 77 A G H < S+ 0 0 10 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.872 107.2 47.3 -69.2 -38.9 -38.8 -12.6 20.9 79 78 A I H >< S+ 0 0 0 -4,-1.6 3,-1.1 -3,-0.3 7,-0.5 0.896 111.4 50.2 -67.9 -42.7 -40.0 -14.2 24.2 80 79 A L H 3< S+ 0 0 68 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.747 111.0 49.8 -70.5 -25.1 -42.8 -11.6 24.7 81 80 A H T 3< S+ 0 0 133 -4,-1.2 2,-0.4 -5,-0.2 -1,-0.3 -0.167 95.3 91.2-106.3 37.6 -44.0 -12.2 21.1 82 81 A N <> - 0 0 30 -3,-1.1 4,-2.0 1,-0.1 3,-0.2 -0.993 65.5-147.4-136.5 127.8 -44.1 -16.0 21.4 83 82 A A T 4 S+ 0 0 95 -2,-0.4 -1,-0.1 1,-0.2 -4,-0.0 0.793 99.3 40.7 -63.0 -31.8 -47.1 -18.1 22.5 84 83 A K T 4 S+ 0 0 51 2,-0.1 4,-0.5 1,-0.1 -1,-0.2 0.729 119.5 40.8 -92.1 -24.2 -45.0 -20.8 24.1 85 84 A L T > S+ 0 0 0 -6,-0.2 4,-2.8 -7,-0.2 5,-0.2 0.846 100.6 66.1 -94.4 -39.4 -42.3 -18.7 25.8 86 85 A K H X S+ 0 0 83 -4,-2.0 4,-2.5 -7,-0.5 5,-0.2 0.880 101.0 50.3 -54.1 -45.5 -44.2 -15.7 27.2 87 86 A P H > S+ 0 0 49 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.909 114.0 44.8 -61.4 -42.7 -46.2 -17.8 29.8 88 87 A V H > S+ 0 0 2 -4,-0.5 4,-0.5 1,-0.2 -2,-0.2 0.897 113.6 51.2 -65.5 -41.5 -43.0 -19.5 31.1 89 88 A Y H >< S+ 0 0 37 -4,-2.8 3,-0.9 1,-0.2 -1,-0.2 0.883 106.3 54.4 -63.3 -41.2 -41.2 -16.1 31.2 90 89 A D H 3< S+ 0 0 77 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.842 105.6 52.0 -63.2 -36.6 -44.0 -14.4 33.1 91 90 A S H 3< S+ 0 0 41 -4,-1.3 -1,-0.2 -5,-0.2 2,-0.2 0.578 95.0 93.8 -79.0 -10.3 -44.0 -17.0 36.0 92 91 A L S << S- 0 0 5 -3,-0.9 2,-0.1 -4,-0.5 31,-0.0 -0.542 74.9-116.8 -92.7 150.5 -40.3 -16.7 36.6 93 92 A D > - 0 0 64 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.371 42.5 -94.5 -74.0 160.3 -38.3 -14.6 39.0 94 93 A A H > S+ 0 0 75 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.841 123.2 48.2 -44.2 -48.3 -35.8 -12.0 37.7 95 94 A V H > S+ 0 0 24 1,-0.2 4,-1.3 2,-0.2 3,-0.5 0.944 114.2 43.2 -63.4 -51.8 -32.8 -14.3 37.9 96 95 A R H > S+ 0 0 19 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.781 107.9 62.4 -66.3 -26.8 -34.4 -17.3 36.2 97 96 A R H X S+ 0 0 79 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.882 101.1 52.6 -62.7 -38.2 -35.9 -14.9 33.6 98 97 A A H X S+ 0 0 5 -4,-1.4 4,-2.8 -3,-0.5 -2,-0.2 0.897 104.5 55.4 -63.5 -42.0 -32.3 -14.0 32.6 99 98 A A H X S+ 0 0 0 -4,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.888 108.6 47.4 -58.6 -41.2 -31.5 -17.7 32.1 100 99 A L H X S+ 0 0 1 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.888 112.0 48.9 -69.3 -40.9 -34.4 -18.1 29.7 101 100 A I H X S+ 0 0 9 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.881 107.5 58.2 -61.4 -39.4 -33.3 -14.9 27.8 102 101 A N H X S+ 0 0 0 -4,-2.8 4,-1.3 2,-0.2 -2,-0.2 0.930 106.8 46.2 -54.6 -49.7 -29.8 -16.4 27.8 103 102 A M H X>S+ 0 0 5 -4,-1.9 4,-3.6 1,-0.2 5,-0.6 0.902 113.1 48.4 -62.8 -44.4 -31.0 -19.5 25.9 104 103 A V H X5S+ 0 0 9 -4,-2.1 4,-1.0 1,-0.2 -1,-0.2 0.877 107.5 56.2 -63.5 -38.7 -33.1 -17.4 23.4 105 104 A F H <5S+ 0 0 28 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.835 118.7 34.9 -59.4 -32.6 -30.0 -15.2 22.9 106 105 A Q H <5S+ 0 0 54 -4,-1.3 -2,-0.2 -3,-0.2 -3,-0.2 0.946 135.1 17.1 -87.5 -58.7 -28.1 -18.4 22.0 107 106 A M H <5S- 0 0 63 -4,-3.6 4,-0.3 1,-0.1 -3,-0.2 0.766 102.8-117.9 -90.4 -29.4 -30.6 -20.7 20.2 108 107 A G X< - 0 0 27 -4,-1.0 4,-1.7 -5,-0.6 3,-0.3 -0.085 35.6 -74.1 98.0 155.1 -33.4 -18.3 19.2 109 108 A E H > S+ 0 0 70 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.856 129.4 50.2 -53.6 -44.4 -37.0 -18.4 20.3 110 109 A T H > S+ 0 0 108 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.891 108.8 52.2 -64.2 -40.6 -38.0 -21.4 18.1 111 110 A G H 4 S+ 0 0 37 -3,-0.3 3,-0.3 -4,-0.3 -1,-0.2 0.848 113.5 42.7 -65.4 -36.7 -35.1 -23.5 19.4 112 111 A V H >< S+ 0 0 1 -4,-1.7 3,-1.7 1,-0.2 -1,-0.2 0.795 103.7 66.3 -79.4 -29.8 -36.0 -22.9 23.0 113 112 A A H 3< S+ 0 0 28 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.731 91.9 66.2 -60.9 -21.4 -39.7 -23.4 22.3 114 113 A G T 3< S+ 0 0 59 -4,-0.7 2,-2.2 -3,-0.3 -1,-0.3 0.613 72.2 92.1 -78.9 -14.4 -38.8 -27.0 21.5 115 114 A F <> + 0 0 42 -3,-1.7 4,-2.2 1,-0.2 5,-0.2 -0.464 53.5 165.2 -80.1 69.7 -37.8 -27.8 25.1 116 115 A T H > + 0 0 104 -2,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.913 66.8 40.1 -54.6 -58.1 -41.3 -29.0 26.0 117 116 A N H > S+ 0 0 76 -3,-0.2 4,-2.9 1,-0.2 3,-0.4 0.970 116.6 47.5 -59.1 -58.6 -40.7 -30.8 29.3 118 117 A S H > S+ 0 0 5 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.852 110.4 53.7 -53.6 -40.3 -38.2 -28.4 30.8 119 118 A L H X S+ 0 0 12 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.887 112.7 42.6 -64.6 -40.1 -40.4 -25.4 29.9 120 119 A R H X S+ 0 0 86 -4,-1.7 4,-1.5 -3,-0.4 -2,-0.2 0.918 111.6 54.0 -71.2 -44.5 -43.5 -26.9 31.7 121 120 A M H <>S+ 0 0 10 -4,-2.9 5,-3.3 1,-0.2 -2,-0.2 0.821 110.0 49.5 -57.8 -32.4 -41.4 -28.1 34.6 122 121 A L H ><5S+ 0 0 4 -4,-1.8 3,-0.9 -5,-0.3 -1,-0.2 0.861 108.1 51.7 -73.3 -37.6 -40.2 -24.5 34.9 123 122 A Q H 3<5S+ 0 0 89 -4,-1.5 -2,-0.2 1,-0.3 -1,-0.2 0.713 114.2 45.2 -71.8 -19.3 -43.8 -23.2 34.8 124 123 A Q T 3<5S- 0 0 103 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.314 115.6-118.2-104.2 3.4 -44.6 -25.6 37.6 125 124 A K T < 5 + 0 0 121 -3,-0.9 2,-1.6 1,-0.2 -3,-0.2 0.713 63.8 146.1 67.6 23.9 -41.5 -24.7 39.6 126 125 A R >< + 0 0 85 -5,-3.3 4,-2.0 1,-0.2 -1,-0.2 -0.626 19.6 169.5 -86.8 76.6 -39.9 -28.2 39.4 127 126 A W H > + 0 0 43 -2,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.910 67.1 46.7 -60.7 -51.4 -36.4 -26.7 39.2 128 127 A D H > S+ 0 0 118 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.895 112.2 50.6 -62.9 -42.3 -34.3 -29.9 39.7 129 128 A E H > S+ 0 0 81 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.929 111.5 48.5 -59.7 -46.2 -36.3 -31.9 37.2 130 129 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.894 111.6 49.9 -61.2 -42.0 -35.9 -29.2 34.6 131 130 A A H X S+ 0 0 14 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.931 112.5 47.0 -61.4 -47.2 -32.2 -29.0 35.3 132 131 A V H X S+ 0 0 83 -4,-2.8 4,-0.7 1,-0.2 -2,-0.2 0.888 113.8 49.0 -60.2 -41.0 -31.9 -32.7 34.9 133 132 A N H < S+ 0 0 42 -4,-2.7 3,-0.2 1,-0.2 -1,-0.2 0.804 110.5 49.0 -71.4 -31.8 -33.9 -32.6 31.7 134 133 A L H < S+ 0 0 2 -4,-2.2 3,-0.5 1,-0.2 6,-0.3 0.706 102.5 64.6 -78.6 -20.4 -31.9 -29.8 30.2 135 134 A A H < S+ 0 0 41 -4,-1.3 2,-0.6 1,-0.3 -1,-0.2 0.754 95.9 57.8 -75.3 -26.4 -28.7 -31.6 31.0 136 135 A K S < S+ 0 0 151 -4,-0.7 2,-0.3 -3,-0.2 -1,-0.3 -0.475 89.1 107.1-101.2 60.5 -29.6 -34.5 28.6 137 136 A S S > S- 0 0 16 -2,-0.6 4,-1.5 -3,-0.5 3,-0.5 -0.907 82.0-115.8-132.6 159.4 -29.9 -32.3 25.5 138 137 A R H > S+ 0 0 186 -2,-0.3 4,-2.8 1,-0.2 5,-0.4 0.798 117.0 65.4 -60.8 -28.0 -27.9 -31.7 22.3 139 138 A W H > S+ 0 0 18 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.901 103.9 42.9 -59.4 -43.3 -27.6 -28.2 23.8 140 139 A Y H 4 S+ 0 0 82 -3,-0.5 -1,-0.2 -6,-0.3 -2,-0.2 0.805 116.7 47.0 -75.3 -30.8 -25.5 -29.5 26.7 141 140 A N H < S+ 0 0 109 -4,-1.5 -2,-0.2 2,-0.2 -1,-0.2 0.881 115.4 42.3 -80.7 -39.2 -23.4 -31.9 24.5 142 141 A Q H < S+ 0 0 106 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.897 136.8 16.0 -72.4 -41.6 -22.5 -29.4 21.8 143 142 A T S X S+ 0 0 34 -4,-1.6 4,-0.9 -5,-0.4 -1,-0.2 -0.605 72.7 160.6-133.3 73.6 -21.9 -26.5 24.2 144 143 A P H > S+ 0 0 14 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.846 78.9 44.2 -64.2 -39.4 -21.5 -28.1 27.7 145 144 A N H > S+ 0 0 42 1,-0.2 4,-0.8 2,-0.2 -2,-0.1 0.845 111.5 53.2 -76.1 -34.2 -19.7 -25.1 29.3 146 145 A R H 4 S+ 0 0 23 1,-0.2 4,-0.3 2,-0.1 -1,-0.2 0.689 118.3 38.6 -70.8 -17.7 -22.0 -22.6 27.7 147 146 A A H X S+ 0 0 0 -4,-0.9 4,-2.8 -7,-0.2 5,-0.3 0.707 98.1 73.5-105.9 -28.1 -24.9 -24.5 29.2 148 147 A K H X S+ 0 0 36 -4,-1.8 4,-2.3 1,-0.2 5,-0.2 0.928 100.8 45.0 -56.7 -50.0 -23.7 -25.6 32.6 149 148 A R H X S+ 0 0 23 -4,-0.8 4,-1.6 1,-0.2 -1,-0.2 0.907 114.0 49.9 -59.8 -44.7 -23.9 -22.1 34.2 150 149 A V H > S+ 0 0 0 -4,-0.3 4,-1.0 2,-0.2 -2,-0.2 0.917 111.5 47.3 -62.8 -46.6 -27.4 -21.5 32.7 151 150 A I H >X S+ 0 0 15 -4,-2.8 4,-1.5 1,-0.2 3,-0.7 0.911 109.9 52.9 -61.9 -44.2 -28.8 -24.8 33.9 152 151 A T H 3X S+ 0 0 63 -4,-2.3 4,-2.2 -5,-0.3 5,-0.4 0.840 105.5 56.1 -59.5 -33.4 -27.4 -24.3 37.4 153 152 A T H 3X S+ 0 0 0 -4,-1.6 4,-1.2 1,-0.2 -1,-0.3 0.775 104.3 53.1 -71.1 -27.4 -29.1 -20.9 37.4 154 153 A F H << S+ 0 0 0 -4,-1.0 -1,-0.2 -3,-0.7 -2,-0.2 0.844 112.5 44.2 -73.6 -35.3 -32.5 -22.6 36.7 155 154 A R H < S+ 0 0 28 -4,-1.5 -2,-0.2 1,-0.1 -27,-0.2 0.901 125.8 27.5 -77.1 -43.9 -32.1 -24.9 39.7 156 155 A T H < S- 0 0 69 -4,-2.2 -3,-0.2 2,-0.2 -2,-0.1 0.868 84.9-140.5 -89.8 -41.5 -30.8 -22.5 42.3 157 156 A G < + 0 0 16 -4,-1.2 -62,-0.2 1,-0.4 2,-0.2 0.591 69.8 102.5 84.3 12.7 -32.3 -19.2 41.2 158 157 A T S S- 0 0 51 -6,-0.3 -1,-0.4 -63,-0.1 3,-0.3 -0.646 82.0-119.3-118.2 176.2 -29.1 -17.5 42.2 159 158 A W S >> S+ 0 0 51 -2,-0.2 3,-2.9 1,-0.2 4,-2.7 0.155 71.5 123.9 -99.4 18.0 -26.0 -16.1 40.3 160 159 A D T 34 + 0 0 106 1,-0.3 -1,-0.2 2,-0.2 -7,-0.0 0.607 67.2 58.5 -60.9 -15.8 -23.7 -18.5 42.1 161 160 A A T 34 S+ 0 0 18 -3,-0.3 -1,-0.3 -12,-0.2 22,-0.2 0.510 120.4 28.0 -88.1 -5.2 -22.4 -20.0 38.9 162 161 A Y T <4 0 0 0 -3,-2.9 21,-0.9 20,-0.1 -2,-0.2 0.719 360.0 360.0-119.7 -50.0 -21.2 -16.5 37.8 163 162 A K < 0 0 49 -4,-2.7 -2,-0.1 19,-0.1 19,-0.1 -0.231 360.0 360.0 43.6 360.0 -20.4 -14.4 40.9 164 !* 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 0.0 165 1 B M 0 0 79 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 146.1 -2.8 -14.5 12.5 166 2 B N > - 0 0 73 156,-0.1 4,-2.4 95,-0.0 5,-0.2 -0.918 360.0 -79.5-157.2 179.6 -0.7 -15.6 15.5 167 3 B I H > S+ 0 0 22 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.829 123.7 54.5 -59.1 -34.5 -0.9 -17.3 18.9 168 4 B F H > S+ 0 0 60 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.955 113.6 38.5 -66.6 -52.2 -2.3 -14.1 20.6 169 5 B E H > S+ 0 0 23 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.817 113.9 58.7 -66.4 -31.3 -5.2 -13.7 18.2 170 6 B M H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.927 113.7 36.1 -62.8 -46.3 -5.6 -17.5 18.2 171 7 B L H X>S+ 0 0 0 -4,-2.3 4,-3.4 2,-0.2 5,-0.7 0.823 110.7 62.4 -76.1 -33.2 -6.1 -17.6 22.0 172 8 B R H X5S+ 0 0 57 -4,-2.5 4,-1.3 -5,-0.2 -2,-0.2 0.888 111.1 40.5 -56.1 -39.8 -8.1 -14.3 21.9 173 9 B I H <5S+ 0 0 3 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.893 119.5 43.2 -77.1 -43.6 -10.6 -16.1 19.7 174 10 B D H <5S+ 0 0 10 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.866 126.9 29.9 -71.2 -38.5 -10.6 -19.4 21.6 175 11 B E H <5S- 0 0 24 -4,-3.4 19,-0.2 -5,-0.1 -3,-0.2 0.876 93.6-156.4 -90.9 -44.0 -10.6 -17.9 25.1 176 12 B G << - 0 0 0 -4,-1.3 2,-0.5 -5,-0.7 18,-0.2 -0.029 23.6 -78.2 82.7 168.3 -12.5 -14.6 24.6 177 13 B L B +A 14 0A 14 -163,-1.7 -163,-1.7 16,-0.1 2,-0.4 -0.915 39.1 175.0-114.3 128.8 -12.4 -11.4 26.7 178 14 B R E -E 192 0D 30 14,-1.3 14,-2.9 -2,-0.5 4,-0.1 -0.966 11.7-167.2-132.3 116.6 -14.1 -10.9 30.0 179 15 B L E + 0 0 28 -2,-0.4 43,-2.6 12,-0.2 2,-0.3 0.385 69.4 58.7 -89.0 2.3 -13.4 -7.6 31.9 180 16 B K E S-G 221 0E 121 41,-0.2 41,-0.2 12,-0.1 10,-0.1 -0.981 97.6 -87.3-132.8 147.5 -14.9 -8.6 35.2 181 17 B I E + 0 0 14 39,-2.1 2,-0.3 -2,-0.3 10,-0.2 -0.214 56.6 166.9 -54.5 130.9 -14.2 -11.4 37.6 182 18 B Y E -E 190 0D 10 8,-2.6 8,-3.7 -4,-0.1 2,-0.3 -0.939 37.7-103.3-143.2 163.0 -16.1 -14.6 36.8 183 19 B K E -E 189 0D 37 -21,-0.9 6,-0.2 -2,-0.3 -22,-0.0 -0.721 37.4-145.3 -89.3 139.9 -16.3 -18.3 37.6 184 20 B D > - 0 0 35 4,-1.9 3,-1.0 -2,-0.3 -1,-0.1 0.089 43.3 -66.1 -89.0-158.7 -14.9 -20.7 35.0 185 21 B T T 3 S+ 0 0 76 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.348 138.1 37.0 -76.6 6.9 -15.8 -24.2 33.8 186 22 B E T 3 S- 0 0 142 2,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.282 123.3 -96.6-135.9 2.3 -14.9 -25.5 37.3 187 23 B G S < S+ 0 0 38 -3,-1.0 2,-0.4 1,-0.3 -2,-0.1 0.607 76.3 144.0 89.6 14.8 -16.1 -22.6 39.4 188 24 B Y - 0 0 60 1,-0.1 -4,-1.9 9,-0.0 -1,-0.3 -0.706 57.9-106.7 -92.0 137.2 -12.7 -21.0 39.7 189 25 B Y E +EF 183 198D 8 9,-1.1 8,-3.1 11,-0.4 9,-1.1 -0.438 51.4 166.7 -66.7 124.0 -12.4 -17.2 39.7 190 26 B T E -EF 182 196D 4 -8,-3.7 -8,-2.6 -2,-0.3 2,-0.3 -0.850 14.7-176.0-135.5 163.9 -11.0 -16.0 36.4 191 27 B I E > + F 0 195D 0 4,-1.7 4,-1.8 -2,-0.3 2,-0.2 -0.989 49.2 1.9-160.5 160.9 -10.6 -12.7 34.4 192 28 B G E 4 S-E 178 0D 0 -14,-2.9 -14,-1.3 -2,-0.3 2,-1.1 -0.440 124.4 -0.7 66.2-126.5 -9.5 -11.3 31.1 193 29 B I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -2,-0.2 -16,-0.1 -0.652 128.1 -57.1 -99.9 74.7 -8.4 -13.9 28.6 194 30 B G T 4 S+ 0 0 22 -2,-1.1 2,-0.7 -18,-0.2 -2,-0.2 0.694 84.3 162.7 66.2 23.5 -8.8 -17.1 30.6 195 31 B H E < -F 191 0D 32 -4,-1.8 -4,-1.7 32,-0.0 2,-0.3 -0.656 32.3-140.6 -82.1 113.4 -6.5 -15.9 33.5 196 32 B L E +F 190 0D 84 -2,-0.7 -6,-0.2 -6,-0.2 3,-0.1 -0.547 21.3 179.1 -72.3 128.2 -7.1 -18.0 36.6 197 33 B L E - 0 0 15 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.862 60.1 -24.6 -96.3 -47.2 -6.9 -15.8 39.8 198 34 B T E -F 189 0D 30 -9,-1.1 -9,-1.1 2,-0.1 -1,-0.4 -0.983 34.6-136.9-163.9 155.1 -7.6 -18.3 42.5 199 35 B K S S+ 0 0 141 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.410 73.4 117.4 -90.9 -1.6 -9.1 -21.7 43.4 200 36 B S - 0 0 38 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.407 69.8-135.9 -69.2 141.8 -10.5 -20.1 46.5 201 37 B P S S+ 0 0 123 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.630 78.7 101.1 -68.7 -15.2 -14.3 -19.9 47.0 202 38 B S > - 0 0 51 1,-0.2 4,-1.3 2,-0.0 -2,-0.1 -0.608 57.4-163.0 -81.8 125.8 -13.8 -16.3 48.2 203 39 B L H > S+ 0 0 55 -2,-0.4 4,-2.5 2,-0.2 5,-0.2 0.839 96.1 57.0 -70.6 -35.3 -14.5 -13.4 45.8 204 40 B N H > S+ 0 0 119 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.848 104.8 52.0 -62.3 -34.7 -12.5 -11.1 48.0 205 41 B A H > S+ 0 0 29 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.856 109.3 49.5 -68.7 -35.9 -9.6 -13.5 47.6 206 42 B A H X S+ 0 0 0 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.887 113.3 46.1 -68.0 -40.8 -10.0 -13.3 43.9 207 43 B K H X S+ 0 0 48 -4,-2.5 4,-2.4 2,-0.2 11,-0.2 0.895 111.2 52.6 -66.6 -42.0 -10.1 -9.5 44.1 208 44 B S H X S+ 0 0 71 -4,-2.7 4,-1.2 1,-0.2 -2,-0.2 0.879 112.0 45.7 -60.0 -40.7 -7.1 -9.5 46.5 209 45 B E H X S+ 0 0 102 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.869 111.7 51.0 -71.8 -38.9 -5.1 -11.6 43.9 210 46 B L H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 5,-0.3 0.892 106.9 54.5 -64.6 -41.8 -6.2 -9.5 41.0 211 47 B D H X>S+ 0 0 39 -4,-2.4 4,-2.2 1,-0.2 5,-0.8 0.869 108.0 49.5 -60.5 -39.2 -5.1 -6.3 42.8 212 48 B K H <5S+ 0 0 80 -4,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.856 114.8 44.3 -69.5 -36.3 -1.6 -7.7 43.3 213 49 B A H <5S+ 0 0 41 -4,-1.5 -2,-0.2 1,-0.1 -1,-0.2 0.921 122.0 35.6 -74.0 -47.2 -1.2 -8.8 39.7 214 50 B I H <5S- 0 0 28 -4,-2.9 -3,-0.2 2,-0.2 -2,-0.2 0.930 103.4-125.3 -75.5 -47.7 -2.6 -5.6 38.1 215 51 B G T <5S+ 0 0 63 -4,-2.2 2,-0.3 1,-0.4 -3,-0.2 0.726 73.0 62.7 106.4 30.7 -1.2 -3.1 40.7 216 52 B R S - 0 0 9 -2,-1.0 3,-1.2 -11,-0.2 -1,-0.2 0.716 35.2-146.2 -97.5 -26.1 -9.7 -2.8 40.7 219 55 B N T 3 S- 0 0 105 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.869 75.8 -51.3 53.8 39.3 -12.7 -4.2 42.7 220 56 B G T 3 S+ 0 0 5 1,-0.2 -39,-2.1 -13,-0.2 2,-0.4 0.492 118.5 105.1 83.7 5.1 -13.0 -7.0 40.2 221 57 B V B < +G 180 0E 56 -3,-1.2 2,-0.3 -41,-0.2 -41,-0.2 -0.968 40.9 171.6-123.2 133.0 -13.0 -4.8 37.1 222 58 B I - 0 0 7 -43,-2.6 2,-0.1 -2,-0.4 -30,-0.1 -0.834 27.8-110.4-131.5 171.8 -10.1 -4.3 34.6 223 59 B T > - 0 0 68 -2,-0.3 4,-1.4 1,-0.1 5,-0.1 -0.453 34.4-105.5 -95.6 170.7 -9.5 -2.7 31.2 224 60 B K H > S+ 0 0 101 1,-0.2 4,-1.0 2,-0.2 -1,-0.1 0.836 122.7 51.5 -63.6 -31.7 -8.8 -4.4 27.8 225 61 B H H > S+ 0 0 147 2,-0.2 4,-1.3 1,-0.2 3,-0.2 0.903 107.4 49.5 -73.0 -42.8 -5.2 -3.3 28.2 226 62 B E H > S+ 0 0 35 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.761 107.4 56.8 -68.1 -24.6 -4.8 -4.8 31.7 227 63 B A H X S+ 0 0 0 -4,-1.4 4,-1.1 1,-0.2 -34,-0.4 0.820 105.8 50.4 -72.1 -32.2 -6.2 -8.0 30.4 228 64 B E H X S+ 0 0 32 -4,-1.0 4,-2.7 -3,-0.2 5,-0.2 0.749 102.5 62.0 -74.8 -26.2 -3.4 -8.0 27.8 229 65 B H H X S+ 0 0 83 -4,-1.3 4,-1.3 1,-0.2 -2,-0.2 0.948 111.0 37.2 -61.9 -50.3 -0.9 -7.4 30.6 230 66 B L H X S+ 0 0 4 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.759 115.1 59.7 -70.4 -26.1 -1.9 -10.8 32.2 231 67 B F H X S+ 0 0 1 -4,-1.1 4,-2.5 2,-0.2 5,-0.2 0.950 103.9 45.3 -70.7 -52.0 -2.3 -12.2 28.7 232 68 B N H X S+ 0 0 67 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.905 114.4 50.9 -57.7 -42.9 1.3 -11.6 27.5 233 69 B Q H X S+ 0 0 99 -4,-1.3 4,-2.2 -5,-0.2 -1,-0.2 0.927 110.9 47.6 -60.3 -47.3 2.6 -13.0 30.8 234 70 B D H X S+ 0 0 40 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.888 112.0 49.5 -63.3 -42.1 0.5 -16.2 30.5 235 71 B V H X S+ 0 0 4 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.917 111.3 49.5 -62.6 -44.3 1.5 -16.8 26.9 236 72 B D H X S+ 0 0 106 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.880 109.5 52.2 -61.4 -40.0 5.2 -16.4 27.8 237 73 B A H X S+ 0 0 58 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.880 108.8 50.3 -63.7 -39.6 4.7 -18.8 30.7 238 74 B A H X S+ 0 0 6 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.892 113.0 45.7 -66.4 -41.0 3.2 -21.4 28.4 239 75 B V H X S+ 0 0 36 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.906 112.6 50.8 -67.2 -43.4 6.1 -21.1 25.9 240 76 B H H X S+ 0 0 113 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.909 107.3 53.8 -60.2 -44.1 8.6 -21.2 28.7 241 77 B G H < S+ 0 0 3 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.815 109.5 49.1 -60.6 -32.5 7.0 -24.4 30.1 242 78 B I H >< S+ 0 0 1 -4,-1.2 3,-1.2 -3,-0.2 -1,-0.2 0.902 108.8 50.9 -73.6 -43.3 7.3 -26.0 26.7 243 79 B L H 3< S+ 0 0 82 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.805 113.6 44.3 -67.3 -31.4 11.0 -25.1 26.2 244 80 B H T 3< S+ 0 0 109 -4,-1.8 2,-0.5 -5,-0.2 -1,-0.3 0.184 94.6 97.2-100.5 16.3 12.1 -26.5 29.5 245 81 B N <> - 0 0 28 -3,-1.2 4,-2.4 1,-0.1 3,-0.2 -0.923 62.1-153.0-107.8 128.8 10.0 -29.7 29.2 246 82 B A T 4 S+ 0 0 94 -2,-0.5 -1,-0.1 1,-0.2 -4,-0.0 0.801 96.7 46.4 -69.1 -30.3 11.7 -32.8 28.0 247 83 B K T 4 S+ 0 0 51 1,-0.1 4,-0.3 2,-0.1 -1,-0.2 0.717 120.3 37.4 -84.9 -22.1 8.5 -34.3 26.6 248 84 B L T > S+ 0 0 0 -6,-0.2 4,-2.8 -3,-0.2 5,-0.2 0.756 101.1 69.3-101.5 -31.4 7.4 -31.1 24.8 249 85 B K H X S+ 0 0 90 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.889 99.1 49.6 -59.9 -43.7 10.6 -29.6 23.5 250 86 B P H > S+ 0 0 49 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.914 113.9 47.4 -62.0 -40.0 11.3 -32.3 20.9 251 87 B V H > S+ 0 0 4 -4,-0.3 4,-1.1 2,-0.2 -2,-0.2 0.911 113.3 47.4 -65.3 -44.4 7.7 -31.9 19.7 252 88 B Y H < S+ 0 0 41 -4,-2.8 3,-0.5 1,-0.2 -1,-0.2 0.908 109.7 53.8 -64.7 -43.0 7.9 -28.1 19.6 253 89 B D H < S+ 0 0 90 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.908 110.2 47.6 -54.6 -45.3 11.3 -28.3 17.7 254 90 B S H < S+ 0 0 37 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.702 97.2 90.7 -73.6 -22.6 9.8 -30.5 15.0 255 91 B L S < S- 0 0 5 -4,-1.1 2,-0.1 -3,-0.5 31,-0.0 -0.318 74.1-115.1 -83.7 158.9 6.7 -28.4 14.4 256 92 B D > - 0 0 54 1,-0.1 4,-2.2 -2,-0.1 3,-0.3 -0.464 39.9 -95.0 -85.3 161.9 5.9 -25.6 11.9 257 93 B A H > S+ 0 0 79 1,-0.2 4,-0.8 2,-0.2 -1,-0.1 0.789 123.6 45.9 -46.1 -39.0 5.1 -22.0 13.0 258 94 B V H > S+ 0 0 25 2,-0.2 4,-1.2 1,-0.2 3,-0.4 0.913 114.0 44.4 -76.1 -45.1 1.3 -22.7 12.8 259 95 B R H > S+ 0 0 19 -3,-0.3 4,-1.3 1,-0.2 -2,-0.2 0.707 106.4 63.8 -73.3 -19.2 1.2 -26.0 14.6 260 96 B R H X S+ 0 0 76 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.841 99.8 52.7 -70.0 -33.7 3.5 -24.6 17.2 261 97 B A H X S+ 0 0 7 -4,-0.8 4,-2.4 -3,-0.4 -2,-0.2 0.891 105.2 54.6 -66.0 -40.6 0.8 -22.1 18.1 262 98 B A H X S+ 0 0 0 -4,-1.2 4,-1.7 2,-0.2 -1,-0.2 0.846 108.1 49.7 -61.8 -35.2 -1.6 -25.0 18.6 263 99 B L H X S+ 0 0 0 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.939 111.0 47.3 -69.2 -48.5 0.8 -26.6 21.0 264 100 B I H X S+ 0 0 9 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.860 108.0 59.4 -57.9 -37.3 1.2 -23.4 23.1 265 101 B N H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.925 106.2 45.5 -58.0 -48.0 -2.6 -23.1 22.9 266 102 B M H X S+ 0 0 5 -4,-1.7 4,-3.1 2,-0.2 5,-0.5 0.896 113.8 48.7 -63.6 -42.5 -3.1 -26.5 24.7 267 103 B V H X S+ 0 0 8 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.883 108.9 53.9 -65.9 -39.0 -0.4 -25.7 27.3 268 104 B F H < S+ 0 0 31 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.919 117.6 37.6 -57.0 -44.2 -2.1 -22.3 27.9 269 105 B Q H < S+ 0 0 47 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.859 136.6 15.1 -77.6 -39.0 -5.3 -24.1 28.5 270 106 B M H < S- 0 0 67 -4,-3.1 4,-0.4 -5,-0.1 -3,-0.2 0.660 101.9-114.5-114.7 -22.7 -4.1 -27.2 30.4 271 107 B G X - 0 0 29 -4,-2.1 4,-1.5 -5,-0.5 5,-0.2 -0.100 37.0 -77.9 95.4 159.5 -0.5 -26.6 31.5 272 108 B E H > S+ 0 0 53 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.871 127.2 51.1 -64.5 -40.3 2.6 -28.3 30.4 273 109 B T H 4 S+ 0 0 115 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.918 109.2 50.9 -63.7 -44.3 2.2 -31.5 32.5 274 110 B G H >4 S+ 0 0 34 -4,-0.4 3,-0.5 1,-0.2 -1,-0.2 0.833 112.9 45.2 -63.5 -35.1 -1.4 -32.1 31.3 275 111 B V H >< S+ 0 0 1 -4,-1.5 3,-1.6 1,-0.2 -1,-0.2 0.817 103.8 62.9 -78.9 -32.0 -0.3 -31.8 27.6 276 112 B A T 3< S+ 0 0 25 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.535 89.6 73.4 -69.9 -5.2 2.7 -34.0 28.1 277 113 B G T < + 0 0 56 -3,-0.5 2,-1.7 -4,-0.3 -1,-0.3 0.561 69.0 89.7 -85.9 -9.9 0.3 -36.8 29.0 278 114 B F <> + 0 0 42 -3,-1.6 4,-2.9 1,-0.2 5,-0.3 -0.417 52.6 165.7 -86.1 62.0 -0.8 -37.2 25.4 279 115 B T H > S+ 0 0 108 -2,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.866 71.3 43.2 -43.6 -55.1 1.9 -39.8 24.7 280 116 B N H > S+ 0 0 73 -3,-0.2 4,-2.5 2,-0.2 3,-0.3 0.954 115.8 45.4 -60.6 -55.2 0.3 -41.1 21.4 281 117 B S H > S+ 0 0 5 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.891 111.6 52.1 -59.4 -43.6 -0.6 -37.7 19.9 282 118 B L H X S+ 0 0 15 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.845 111.5 48.5 -61.5 -34.3 2.7 -36.1 20.8 283 119 B R H X S+ 0 0 105 -4,-1.5 4,-1.1 -5,-0.3 -2,-0.2 0.911 111.9 48.2 -70.9 -43.3 4.4 -39.0 19.0 284 120 B M H <>S+ 0 0 11 -4,-2.5 5,-2.4 1,-0.2 -2,-0.2 0.847 111.2 50.5 -66.9 -36.0 2.2 -38.7 16.0 285 121 B L H ><5S+ 0 0 3 -4,-2.6 3,-1.5 1,-0.2 -1,-0.2 0.887 107.7 53.6 -67.3 -39.5 2.8 -35.0 15.8 286 122 B Q H 3<5S+ 0 0 84 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.764 111.0 47.6 -64.5 -25.9 6.5 -35.5 16.0 287 123 B Q T 3<5S- 0 0 95 -4,-1.1 -1,-0.3 2,-0.1 -2,-0.2 0.041 115.6-113.5-106.3 23.2 6.2 -37.9 13.0 288 124 B K T < 5 + 0 0 100 -3,-1.5 2,-2.1 1,-0.2 -3,-0.2 0.590 67.5 146.7 58.0 11.8 4.1 -35.6 10.9 289 125 B R >< + 0 0 108 -5,-2.4 4,-1.7 1,-0.2 -1,-0.2 -0.531 18.0 169.2 -78.0 78.2 1.1 -38.0 11.3 290 126 B W H > + 0 0 51 -2,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.887 67.6 44.3 -63.5 -46.7 -1.4 -35.2 11.2 291 127 B D H > S+ 0 0 110 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.883 110.8 53.2 -71.0 -39.9 -4.6 -37.2 10.9 292 128 B E H > S+ 0 0 84 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.890 110.7 48.5 -61.4 -39.8 -3.8 -39.9 13.4 293 129 B A H X S+ 0 0 0 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.916 110.5 50.5 -65.9 -44.7 -3.1 -37.1 16.0 294 130 B A H X S+ 0 0 8 -4,-1.9 4,-1.1 2,-0.2 -2,-0.2 0.914 110.9 48.7 -60.0 -45.9 -6.3 -35.3 15.3 295 131 B V H X S+ 0 0 80 -4,-2.5 4,-0.8 1,-0.2 3,-0.4 0.922 114.4 45.8 -59.7 -46.9 -8.3 -38.5 15.6 296 132 B N H >< S+ 0 0 55 -4,-2.1 3,-0.6 1,-0.2 4,-0.5 0.884 109.7 54.1 -63.5 -41.3 -6.6 -39.3 18.9 297 133 B L H 3< S+ 0 0 2 -4,-2.8 6,-0.3 1,-0.2 3,-0.3 0.698 102.8 58.0 -69.3 -19.5 -7.0 -35.8 20.3 298 134 B A H 3< S+ 0 0 43 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.776 99.8 58.7 -77.5 -27.5 -10.8 -35.9 19.6 299 135 B K S << S+ 0 0 172 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.650 88.3 107.2 -73.5 -17.0 -11.0 -39.0 21.9 300 136 B S S > S- 0 0 18 -4,-0.5 4,-1.0 -3,-0.3 3,-0.0 -0.018 79.1-124.9 -65.4 163.5 -9.6 -37.0 24.8 301 137 B R H > S+ 0 0 209 2,-0.2 4,-3.1 1,-0.2 5,-0.4 0.783 112.2 68.0 -71.5 -30.7 -11.4 -35.8 27.9 302 138 B W H > S+ 0 0 16 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.883 103.7 42.4 -53.0 -41.7 -10.0 -32.4 26.9 303 139 B Y H 4 S+ 0 0 85 -6,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.812 114.2 51.7 -76.3 -32.4 -12.3 -32.5 23.9 304 140 B N H < S+ 0 0 130 -4,-1.0 -2,-0.2 2,-0.2 -1,-0.1 0.926 114.1 40.2 -72.1 -45.5 -15.3 -33.8 25.9 305 141 B Q H < S+ 0 0 48 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.800 136.2 18.6 -74.0 -30.1 -15.2 -31.2 28.6 306 142 B T < + 0 0 13 -4,-1.2 4,-0.5 -5,-0.4 -1,-0.3 -0.525 67.3 158.5-142.3 70.4 -14.5 -28.4 26.2 307 143 B P S > S+ 0 0 16 0, 0.0 4,-2.2 0, 0.0 3,-0.2 0.814 80.1 47.3 -64.2 -32.6 -15.3 -29.4 22.6 308 144 B N H > S+ 0 0 36 2,-0.2 4,-0.7 1,-0.2 -2,-0.1 0.908 110.2 48.9 -76.7 -44.2 -15.6 -25.8 21.4 309 145 B R H 4 S+ 0 0 31 1,-0.2 -1,-0.2 2,-0.1 4,-0.1 0.530 123.9 36.0 -71.9 -4.1 -12.4 -24.5 23.0 310 146 B A H > S+ 0 0 0 -4,-0.5 4,-2.2 -3,-0.2 5,-0.3 0.679 93.8 80.5-119.4 -32.6 -10.7 -27.5 21.4 311 147 B K H X S+ 0 0 20 -4,-2.2 4,-1.8 1,-0.2 5,-0.1 0.892 98.5 44.2 -47.9 -52.4 -12.3 -28.1 18.0 312 148 B R H X S+ 0 0 23 -4,-0.7 4,-2.1 1,-0.2 -1,-0.2 0.911 110.1 56.1 -60.0 -45.7 -10.3 -25.4 16.2 313 149 B V H > S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.883 108.9 45.9 -56.7 -43.7 -7.0 -26.4 17.9 314 150 B I H X S+ 0 0 10 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.876 110.2 53.9 -68.0 -38.1 -7.3 -30.0 16.6 315 151 B T H X S+ 0 0 40 -4,-1.8 4,-2.8 -5,-0.3 5,-0.3 0.841 106.6 53.3 -64.3 -33.7 -8.3 -28.8 13.1 316 152 B T H X S+ 0 0 1 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.881 105.9 51.9 -69.1 -40.0 -5.1 -26.6 13.1 317 153 B F H < S+ 0 0 0 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.839 114.5 46.1 -61.3 -32.7 -3.0 -29.7 14.0 318 154 B R H < S+ 0 0 113 -4,-1.5 -2,-0.2 -5,-0.1 -1,-0.2 0.951 126.5 22.9 -76.0 -52.0 -4.7 -31.4 11.0 319 155 B T H < S- 0 0 63 -4,-2.8 -3,-0.2 2,-0.2 -2,-0.2 0.898 84.1-139.1 -87.0 -45.3 -4.5 -28.7 8.3 320 156 B G < + 0 0 15 -4,-1.8 2,-0.2 1,-0.4 -62,-0.2 0.641 69.4 101.4 87.9 17.1 -1.6 -26.5 9.4 321 157 B T S S- 0 0 54 -6,-0.3 -1,-0.4 -5,-0.1 3,-0.3 -0.727 81.5-117.5-123.6 175.1 -3.5 -23.4 8.4 322 158 B W S >> S+ 0 0 58 -2,-0.2 3,-2.1 1,-0.2 4,-1.7 0.172 74.2 119.8 -97.2 17.2 -5.5 -20.7 10.3 323 159 B D T 34 + 0 0 97 1,-0.3 -1,-0.2 3,-0.2 -7,-0.0 0.719 67.0 58.0 -60.6 -26.1 -8.7 -21.6 8.5 324 160 B A T 34 S+ 0 0 23 -3,-0.3 -1,-0.3 1,-0.2 -304,-0.2 0.666 111.7 43.4 -78.1 -14.1 -10.7 -22.5 11.7 325 161 B Y T <4 0 0 0 -3,-2.1 -305,-0.9 -306,-0.1 -2,-0.2 0.737 360.0 360.0-101.6 -31.0 -10.0 -19.0 13.0 326 162 B K < 0 0 67 -4,-1.7 -3,-0.2 -307,-0.2 -286,-0.1 0.053 360.0 360.0-178.9 360.0 -10.8 -17.0 9.8