==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 16-JAN-11 3QCE . COMPND 2 MOLECULE: RECEPTOR-TYPE TYROSINE-PROTEIN PHOSPHATASE GAMMA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.SHERIFF . 572 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26090.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 400 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 84 14.7 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.4 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 . 45 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 171 29.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 0 0 0 2 0 2 0 1 1 0 0 1 1 0 2 0 0 0 0 0 0 0 0 1 0 1 RESIDUES PER ALPHA HELIX . 0 0 2 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 PARALLEL BRIDGES PER LADDER . 0 6 0 2 2 0 0 2 2 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 . 4 0 0 0 0 0 0 2 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 1 825 A M 0 0 158 0, 0.0 2,-1.0 0, 0.0 253,-0.0 0.000 360.0 360.0 360.0 139.9 -6.9 25.4 48.2 2 826 A E - 0 0 159 248,-0.0 2,-0.2 2,-0.0 251,-0.2 -0.665 360.0-173.6 -93.8 102.3 -5.7 26.3 44.7 3 827 A A - 0 0 41 -2,-1.0 247,-0.2 247,-0.1 245,-0.0 -0.503 9.7-145.3 -90.9 158.2 -2.8 24.2 43.6 4 828 A I E -A 249 0A 46 245,-2.2 245,-2.3 -2,-0.2 5,-0.1 -0.964 21.5-104.0-128.6 141.8 -0.7 24.7 40.4 5 829 A P E > -A 248 0A 76 0, 0.0 4,-2.4 0, 0.0 3,-0.4 -0.241 36.0-112.3 -57.3 148.1 1.0 22.3 38.0 6 830 A V H > S+ 0 0 8 241,-1.8 4,-2.6 1,-0.2 5,-0.2 0.870 116.1 56.1 -49.1 -45.7 4.7 22.0 38.3 7 831 A K H > S+ 0 0 147 283,-0.3 4,-1.2 1,-0.2 -1,-0.2 0.913 111.7 42.2 -58.4 -44.1 5.3 23.6 34.9 8 832 A Q H > S+ 0 0 97 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.857 111.2 56.0 -69.9 -34.7 3.4 26.7 35.9 9 833 A F H X S+ 0 0 3 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.914 104.4 53.6 -64.4 -41.4 5.0 26.7 39.4 10 834 A V H X S+ 0 0 45 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.871 111.0 45.4 -59.2 -39.0 8.4 26.8 37.8 11 835 A K H X S+ 0 0 122 -4,-1.2 4,-1.4 -5,-0.2 -1,-0.2 0.849 108.5 57.8 -74.5 -32.4 7.4 29.9 35.7 12 836 A H H X S+ 0 0 59 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.871 101.5 55.8 -63.1 -38.4 5.9 31.4 38.8 13 837 A I H X S+ 0 0 3 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.892 104.3 52.8 -60.9 -41.8 9.3 31.2 40.6 14 838 A G H X S+ 0 0 46 -4,-1.2 4,-1.1 1,-0.2 -1,-0.2 0.878 110.2 49.8 -61.3 -34.4 10.9 33.1 37.8 15 839 A E H < S+ 0 0 131 -4,-1.4 8,-0.4 1,-0.2 -2,-0.2 0.880 105.3 54.4 -73.2 -38.7 8.2 35.8 38.3 16 840 A L H < S+ 0 0 5 -4,-2.3 8,-1.4 1,-0.2 7,-0.7 0.844 110.1 49.6 -63.7 -32.0 8.7 36.0 42.0 17 841 A Y H X S+ 0 0 77 -4,-1.6 4,-2.9 -5,-0.2 -1,-0.2 0.806 93.4 96.5 -73.2 -31.1 12.4 36.7 41.4 18 842 A S H X>S+ 0 0 63 -4,-1.1 4,-1.4 2,-0.2 5,-0.6 -0.087 76.8 29.1 -65.8 159.7 11.9 39.4 38.8 19 843 A N H 45S- 0 0 114 1,-0.2 3,-0.5 2,-0.2 -1,-0.2 0.938 143.3 -47.2 60.0 48.0 11.9 43.1 39.6 20 844 A N H 45S- 0 0 106 1,-0.2 -2,-0.2 -3,-0.2 -1,-0.2 0.911 105.1 -58.7 58.3 47.2 14.4 42.6 42.5 21 845 A Q H X5S+ 0 0 58 -4,-2.9 4,-1.8 1,-0.1 -1,-0.2 0.804 88.7 155.2 58.6 31.3 12.5 39.7 44.0 22 846 A H H X5 + 0 0 98 -4,-1.4 4,-1.9 -3,-0.5 5,-0.2 0.870 67.7 52.3 -58.7 -39.3 9.4 42.0 44.3 23 847 A G H > S+ 0 0 0 -8,-1.4 4,-2.6 -3,-0.2 5,-0.2 0.907 108.8 52.1 -60.8 -40.2 8.8 37.2 47.1 25 849 A S H X S+ 0 0 48 -4,-1.8 4,-2.1 -9,-0.3 -2,-0.2 0.915 110.8 44.2 -67.5 -43.2 8.6 40.3 49.2 26 850 A E H X S+ 0 0 110 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.892 113.2 53.1 -70.2 -36.6 4.9 40.7 48.8 27 851 A D H X S+ 0 0 18 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.965 112.6 42.7 -55.5 -56.0 4.3 37.0 49.3 28 852 A F H X S+ 0 0 13 -4,-2.6 4,-3.1 1,-0.2 -2,-0.2 0.862 111.0 55.1 -66.0 -35.6 6.2 36.9 52.6 29 853 A E H X S+ 0 0 80 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.2 0.926 108.3 49.8 -60.9 -42.3 4.6 40.2 53.8 30 854 A E H X S+ 0 0 83 -4,-2.1 4,-1.0 1,-0.2 3,-0.4 0.929 111.8 48.5 -60.2 -45.1 1.2 38.5 53.2 31 855 A V H >< S+ 0 0 1 -4,-2.4 3,-0.8 1,-0.2 4,-0.3 0.917 107.3 55.6 -58.9 -42.9 2.4 35.5 55.2 32 856 A Q H 3< S+ 0 0 81 -4,-3.1 -1,-0.2 1,-0.2 3,-0.2 0.797 116.1 36.8 -65.0 -24.8 3.7 37.8 58.0 33 857 A R H >< S+ 0 0 169 -4,-1.4 3,-1.8 -3,-0.4 4,-0.3 0.543 85.8 100.9 -99.5 -10.1 0.3 39.4 58.4 34 858 A C T << S+ 0 0 29 -4,-1.0 -1,-0.1 -3,-0.8 -2,-0.1 0.601 89.9 33.2 -69.4 -13.5 -2.1 36.5 57.8 35 859 A T T > S+ 0 0 26 -4,-0.3 3,-2.2 -3,-0.2 5,-0.4 0.374 82.6 112.3-114.1 4.8 -3.0 35.7 61.4 36 860 A A T < S+ 0 0 75 -3,-1.8 3,-0.2 1,-0.3 -2,-0.1 0.682 83.4 37.4 -58.9 -25.4 -2.9 39.2 62.9 37 861 A D T 3 S+ 0 0 160 -4,-0.3 -1,-0.3 1,-0.1 -2,-0.1 0.259 92.1 89.2-109.6 13.1 -6.6 39.5 63.6 38 862 A M S < S- 0 0 107 -3,-2.2 3,-0.2 2,-0.1 -1,-0.1 0.474 79.0-143.2 -91.7 -3.6 -7.2 35.9 64.7 39 863 A N - 0 0 138 -4,-0.3 2,-0.2 -3,-0.2 -3,-0.1 0.784 26.4-175.2 45.0 34.2 -6.5 36.5 68.4 40 864 A I - 0 0 43 -5,-0.4 -1,-0.2 1,-0.1 2,-0.2 -0.451 16.5-142.2 -61.2 123.7 -4.9 33.0 68.5 41 865 A T - 0 0 62 -2,-0.2 22,-2.9 -3,-0.2 23,-0.4 -0.540 31.1-177.0 -97.1 156.8 -4.0 32.6 72.2 42 866 A A > + 0 0 7 20,-0.3 4,-1.7 -2,-0.2 5,-0.2 -0.275 26.6 148.2-140.3 51.7 -1.1 31.1 74.0 43 867 A E H > S+ 0 0 130 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.881 73.1 53.7 -57.6 -41.8 -2.0 31.5 77.7 44 868 A H H >4 S+ 0 0 59 1,-0.2 3,-1.2 2,-0.2 6,-0.3 0.955 107.1 50.5 -60.5 -49.3 -0.2 28.3 78.7 45 869 A S H 34 S+ 0 0 0 16,-0.5 -1,-0.2 1,-0.3 -2,-0.2 0.869 115.4 45.4 -51.1 -38.3 3.0 29.4 77.1 46 870 A N H 3< S+ 0 0 74 -4,-1.7 -1,-0.3 3,-0.0 -2,-0.2 0.566 82.7 116.4 -88.2 -9.7 2.6 32.7 79.0 47 871 A H S XX S- 0 0 63 -3,-1.2 3,-2.8 -4,-1.1 4,-0.8 -0.418 72.5-127.0 -64.4 131.1 1.7 31.2 82.4 48 872 A P T 34 S+ 0 0 89 0, 0.0 4,-0.3 0, 0.0 3,-0.2 0.721 107.9 59.7 -54.8 -25.2 4.4 32.1 84.9 49 873 A E T 34 S+ 0 0 111 1,-0.2 3,-0.1 2,-0.1 -2,-0.1 0.679 108.2 44.4 -78.5 -17.2 4.8 28.4 85.9 50 874 A N T X4 S+ 0 0 0 -3,-2.8 3,-2.6 -6,-0.3 4,-0.5 0.511 84.1 100.8 -99.7 -7.2 5.8 27.5 82.3 51 875 A K G >< S+ 0 0 106 -4,-0.8 3,-1.9 1,-0.3 -2,-0.1 0.863 81.1 48.9 -46.7 -51.3 8.1 30.4 81.8 52 876 A H G 3 S+ 0 0 112 -4,-0.3 -1,-0.3 1,-0.3 53,-0.1 0.543 101.8 68.0 -71.7 -4.6 11.3 28.5 82.3 53 877 A K G < S+ 0 0 26 -3,-2.6 2,-0.4 -8,-0.1 30,-0.4 0.585 86.6 80.9 -87.1 -12.1 10.0 25.9 79.9 54 878 A N < - 0 0 16 -3,-1.9 3,-0.1 -4,-0.5 6,-0.1 -0.825 65.7-154.0-100.7 131.4 10.2 28.3 76.9 55 879 A R S S+ 0 0 23 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.905 89.5 24.6 -69.9 -41.7 13.6 28.8 75.2 56 880 A Y S > S- 0 0 17 3,-0.3 3,-1.5 169,-0.1 -1,-0.2 -0.992 75.0-139.3-124.2 135.8 12.6 32.3 74.0 57 881 A I T 3 S+ 0 0 102 271,-2.5 272,-0.1 -2,-0.4 -1,-0.1 0.768 103.8 47.0 -66.7 -23.8 10.0 34.4 75.8 58 882 A N T 3 S+ 0 0 49 270,-0.5 2,-0.7 1,-0.1 -1,-0.3 0.401 92.7 84.3 -99.9 5.0 8.5 35.6 72.6 59 883 A I < + 0 0 1 -3,-1.5 -3,-0.3 -14,-0.1 2,-0.2 -0.885 65.5 174.1-106.1 105.3 8.3 32.2 70.8 60 884 A L - 0 0 31 -2,-0.7 2,-0.5 -6,-0.1 203,-0.4 -0.504 34.2-124.2-109.2 170.5 5.1 30.6 72.0 61 885 A A - 0 0 0 -19,-0.2 -16,-0.5 -2,-0.2 5,-0.1 -0.975 34.9-120.2-115.9 118.8 3.0 27.6 71.3 62 886 A Y >> - 0 0 30 -2,-0.5 3,-0.8 199,-0.3 4,-0.6 -0.246 16.5-131.3 -60.0 141.2 -0.6 28.3 70.4 63 887 A D G >4 S+ 0 0 27 -22,-2.9 3,-0.9 1,-0.2 -1,-0.1 0.897 99.7 58.2 -62.4 -41.3 -3.2 26.8 72.7 64 888 A H G 34 S+ 0 0 122 -23,-0.4 -1,-0.2 1,-0.3 -22,-0.1 0.704 120.3 25.2 -68.8 -19.5 -5.4 25.2 70.1 65 889 A S G <4 S+ 0 0 11 -3,-0.8 21,-2.7 196,-0.2 -1,-0.3 0.222 88.5 128.7-127.2 10.2 -2.7 23.1 68.5 66 890 A R E << -B 85 0B 10 -3,-0.9 2,-0.5 -4,-0.6 19,-0.3 -0.339 63.4-113.8 -69.8 152.5 -0.2 22.6 71.3 67 891 A V E - 0 0 0 17,-2.0 15,-0.5 15,-0.4 2,-0.5 -0.749 33.5-147.7 -83.0 129.6 1.0 19.1 72.2 68 892 A K E -B 81 0B 120 -2,-0.5 2,-0.2 13,-0.1 13,-0.2 -0.854 0.6-143.0-103.6 133.6 -0.2 18.2 75.7 69 893 A L - 0 0 4 11,-3.3 3,-0.1 -2,-0.5 44,-0.1 -0.624 35.7 -98.3 -80.4 150.0 1.7 16.0 78.1 70 894 A R - 0 0 45 -2,-0.2 -1,-0.1 1,-0.1 46,-0.0 -0.495 54.6 -99.3 -61.3 136.4 -0.4 13.6 80.2 71 895 A P - 0 0 100 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 -0.174 36.7-136.9 -61.3 154.9 -0.7 15.4 83.6 72 896 A L - 0 0 71 4,-0.7 2,-0.2 -3,-0.1 7,-0.2 -0.801 18.7-102.9-113.2 155.7 1.6 14.4 86.5 73 897 A P 0 0 128 0, 0.0 -1,-0.0 0, 0.0 4,-0.0 -0.543 360.0 360.0 -73.9 139.1 0.9 13.8 90.3 74 898 A G 0 0 101 -2,-0.2 3,-0.1 2,-0.0 0, 0.0 -0.963 360.0 360.0 123.6 360.0 1.9 16.6 92.7 75 ! 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 76 901 A S > 0 0 52 0, 0.0 3,-1.2 0, 0.0 -4,-0.7 0.000 360.0 360.0 360.0 -16.8 1.3 19.4 88.7 77 902 A K T 3 + 0 0 78 1,-0.3 3,-0.3 2,-0.1 -3,-0.0 0.920 360.0 30.7 -53.0 -50.5 -1.4 21.6 87.2 78 903 A H T > S+ 0 0 29 1,-0.2 3,-2.5 2,-0.1 -1,-0.3 0.258 82.9 111.5 -97.5 12.0 0.8 22.7 84.3 79 904 A S T < + 0 0 22 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.464 69.9 70.5 -64.7 3.0 2.9 19.5 84.1 80 905 A D T 3 S+ 0 0 23 -3,-0.3 -11,-3.3 -4,-0.1 2,-0.3 0.537 78.7 107.2 -90.9 -8.7 1.0 19.1 80.8 81 906 A Y E < +B 68 0B 0 -3,-2.5 2,-0.3 -13,-0.2 -13,-0.1 -0.541 31.8 155.8 -85.8 132.2 2.9 21.9 79.0 82 907 A I E - 0 0 7 -15,-0.5 2,-1.8 -2,-0.3 -15,-0.4 -0.971 48.9-114.9-143.5 141.1 5.6 21.7 76.4 83 908 A N E S+ 0 0 1 -30,-0.4 17,-1.4 -2,-0.3 2,-0.3 -0.515 78.7 108.1 -72.1 88.1 6.5 24.4 73.8 84 909 A A E - C 0 99B 0 -2,-1.8 -17,-2.0 15,-0.2 2,-0.4 -0.974 47.7-160.1-164.1 144.0 5.4 22.3 70.8 85 910 A N E -BC 66 98B 0 13,-2.4 13,-2.7 -2,-0.3 2,-0.2 -0.990 24.6-116.5-135.3 145.1 2.6 22.3 68.3 86 911 A Y E - C 0 97B 36 -21,-2.7 2,-0.4 -2,-0.4 11,-0.2 -0.575 36.0-166.8 -67.9 137.7 1.0 19.7 65.9 87 912 A V E - C 0 96B 0 9,-2.6 9,-2.3 -2,-0.2 8,-0.5 -0.998 17.7-118.3-133.3 136.8 1.5 20.9 62.3 88 913 A D E - 0 0 28 -2,-0.4 5,-0.2 6,-0.2 2,-0.2 -0.279 26.2-166.3 -68.9 155.7 -0.2 19.5 59.2 89 914 A G E > - C 0 92B 7 3,-2.6 3,-1.0 149,-0.1 2,-0.5 -0.525 48.8 -45.9-121.7-164.6 1.6 17.9 56.4 90 915 A Y T 3 S- 0 0 40 1,-0.3 -1,-0.0 -2,-0.2 3,-0.0 -0.549 122.4 -20.8 -72.2 118.1 0.6 16.9 52.9 91 916 A N T 3 S+ 0 0 126 -2,-0.5 -1,-0.3 1,-0.1 2,-0.2 0.918 123.7 89.0 48.8 51.2 -2.8 15.3 53.1 92 917 A K E X -C 89 0B 80 -3,-1.0 -3,-2.6 0, 0.0 3,-0.9 -0.566 70.0-136.9-176.4 106.5 -2.4 14.4 56.8 93 918 A A E 3 S+ 0 0 68 1,-0.2 -5,-0.1 -5,-0.2 -6,-0.1 -0.344 88.9 11.4 -65.1 146.2 -3.3 16.5 59.8 94 919 A K E 3 S+ 0 0 118 1,-0.1 -6,-0.2 -5,-0.1 -1,-0.2 0.858 75.0 150.3 55.9 39.9 -0.8 16.6 62.6 95 920 A A E < + 0 0 3 -3,-0.9 124,-2.4 -8,-0.5 2,-0.3 0.718 65.1 33.1 -72.2 -21.2 2.0 14.9 60.5 96 921 A Y E -Cd 87 219B 1 -9,-2.3 -9,-2.6 122,-0.3 2,-0.5 -0.930 62.8-144.4-130.9 156.4 4.6 16.8 62.5 97 922 A I E -Cd 86 220B 0 122,-2.4 124,-3.1 -2,-0.3 2,-0.6 -0.993 21.3-159.0-111.2 121.6 5.3 18.2 65.9 98 923 A A E +Cd 85 221B 0 -13,-2.7 -13,-2.4 -2,-0.5 2,-0.3 -0.888 25.2 160.3 -97.5 123.0 7.2 21.4 65.7 99 924 A T E -Cd 84 222B 2 122,-1.9 124,-0.6 -2,-0.6 -15,-0.2 -0.924 39.1-100.5-142.1 161.3 9.1 22.2 68.9 100 925 A Q - 0 0 3 -17,-1.4 125,-0.2 -2,-0.3 124,-0.2 -0.296 56.6 -80.3 -72.7 163.6 12.0 24.3 70.2 101 926 A G - 0 0 0 123,-3.1 -1,-0.1 34,-0.3 37,-0.1 -0.566 64.8-102.6 -61.6 126.1 15.4 22.8 70.9 102 927 A P - 0 0 2 0, 0.0 35,-1.5 0, 0.0 2,-0.3 -0.174 31.1-138.7 -57.7 142.5 14.9 21.1 74.3 103 928 A L >> - 0 0 29 -50,-0.2 3,-2.2 33,-0.1 4,-0.7 -0.685 25.0-112.8 -93.8 154.3 16.2 22.8 77.5 104 929 A K G >4 S+ 0 0 155 1,-0.3 3,-1.4 -2,-0.3 4,-0.4 0.935 122.8 54.7 -48.8 -44.9 18.0 20.9 80.2 105 930 A S G 34 S+ 0 0 69 1,-0.3 -1,-0.3 -53,-0.1 4,-0.2 0.606 112.6 43.4 -68.0 -10.3 15.0 21.8 82.3 106 931 A T G <> S+ 0 0 5 -3,-2.2 4,-3.0 2,-0.1 -1,-0.3 0.332 78.2 104.6-116.4 7.0 12.7 20.2 79.7 107 932 A F H S+ 0 0 115 -4,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.952 113.1 47.2 -59.4 -50.6 12.1 14.8 80.8 109 934 A D H > S+ 0 0 25 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.916 109.8 54.6 -55.2 -47.1 9.1 16.5 79.1 110 935 A F H X S+ 0 0 2 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.943 113.0 40.0 -55.3 -53.5 10.7 16.2 75.7 111 936 A W H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.856 112.8 56.2 -69.2 -31.7 11.2 12.4 76.0 112 937 A R H X S+ 0 0 36 -4,-2.6 4,-3.2 -5,-0.3 5,-0.2 0.923 107.5 49.2 -64.2 -41.8 7.9 11.9 77.7 113 938 A M H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 6,-0.3 0.928 108.7 53.4 -60.9 -45.1 6.2 13.6 74.7 114 939 A I H <>S+ 0 0 1 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-4,-2.5 4,-0.4 -5,-0.2 -1,-0.2 0.888 111.2 51.2 -59.4 -35.2 -0.5 30.5 55.4 257 1094 A H H >< S+ 0 0 74 -4,-1.8 3,-1.7 -5,-0.2 4,-0.3 0.960 110.7 43.7 -66.9 -51.8 -2.3 27.4 56.7 258 1095 A I H >X S+ 0 0 0 -4,-2.6 3,-2.2 1,-0.3 4,-1.5 0.790 99.2 72.9 -70.4 -22.3 0.4 26.1 59.0 259 1096 A R T 3< S+ 0 0 7 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.743 91.5 59.5 -60.1 -20.0 1.1 29.6 60.3 260 1097 A T T <4 S+ 0 0 33 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.687 104.9 50.8 -76.2 -16.3 -2.2 29.2 62.1 261 1098 A Q T <4 S+ 0 0 19 -3,-2.2 2,-0.3 1,-0.3 -199,-0.3 0.779 124.5 7.0 -98.4 -29.2 -0.7 26.2 63.9 262 1099 A R S >< S- 0 0 0 -4,-1.5 3,-1.2 -201,-0.1 -1,-0.3 -0.949 84.7-102.6-152.8 137.5 2.5 27.6 65.2 263 1100 A N T 3 S+ 0 0 6 -203,-0.4 -3,-0.1 -2,-0.3 4,-0.1 -0.193 94.2 1.3 -61.0 142.6 3.8 31.2 65.2 264 1101 A Y T 3 S+ 0 0 95 1,-0.2 -1,-0.2 -5,-0.2 -33,-0.1 0.542 72.9 176.0 65.7 13.1 6.5 32.3 62.7 265 1102 A L S < S+ 0 0 0 -3,-1.2 -37,-0.2 -7,-0.1 -1,-0.2 -0.309 77.6 20.2 -52.2 130.4 6.8 29.0 60.8 266 1103 A V S S- 0 0 0 -39,-2.4 -38,-0.2 -38,-0.4 -1,-0.1 0.956 89.5-165.1 56.4 90.2 9.3 29.9 58.0 267 1104 A Q + 0 0 35 -4,-0.1 2,-0.3 -40,-0.0 -39,-0.1 0.734 53.5 41.6 -87.8 -26.5 10.5 33.0 59.9 268 1105 A T S > S- 0 0 8 1,-0.1 4,-2.0 -40,-0.1 3,-0.2 -0.878 71.9-124.3-127.5 155.3 12.4 35.0 57.2 269 1106 A E H > S+ 0 0 53 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.870 113.8 60.9 -63.7 -35.9 11.9 36.0 53.6 270 1107 A E H > S+ 0 0 74 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.918 105.9 46.7 -55.7 -42.9 15.3 34.5 52.9 271 1108 A Q H > S+ 0 0 22 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.897 109.3 53.7 -66.6 -40.6 13.9 31.1 54.1 272 1109 A Y H X S+ 0 0 0 -4,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.891 111.0 47.0 -59.7 -40.8 10.8 31.5 52.0 273 1110 A I H >X S+ 0 0 22 -4,-2.5 4,-2.3 1,-0.2 3,-0.6 0.936 107.1 56.5 -67.8 -46.1 13.0 32.1 48.9 274 1111 A F H 3X S+ 0 0 7 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.881 100.8 59.3 -51.1 -42.3 15.2 29.1 49.7 275 1112 A I H 3X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.914 107.9 44.9 -53.4 -44.7 12.1 26.9 49.7 276 1113 A H H < S+ 0 0 16 -4,-2.6 3,-0.7 1,-0.2 -2,-0.2 0.925 115.0 45.0 -68.3 -43.5 11.7 19.7 39.9 284 1121 A L H 3< S+ 0 0 128 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.805 113.6 50.8 -67.6 -29.5 14.6 20.1 37.4 285 1122 A G H 3< S- 0 0 63 -4,-1.7 2,-0.3 -5,-0.2 -1,-0.2 0.546 108.7-108.7 -89.8 -5.9 16.5 17.2 38.8 286 1123 A K << + 0 0 52 -3,-0.7 -1,-0.2 -4,-0.6 2,-0.1 -0.937 61.6 137.6 166.7 176.8 13.8 14.6 38.6 287 1124 A E - 0 0 98 -2,-0.3 2,-0.3 -3,-0.1 -4,-0.1 -0.803 60.5 -38.2-131.1 -37.7 11.7 12.6 38.7 288 1125 A T S S+ 0 0 85 -2,-0.1 -41,-0.1 1,-0.1 -2,-0.0 -0.941 97.2 17.1-159.9 138.5 8.4 11.9 36.7 289 1126 A E 0 0 79 -2,-0.3 -283,-0.2 -283,-0.0 -1,-0.1 0.911 360.0 360.0 71.2 46.8 5.6 13.9 35.1 290 1127 A V 0 0 89 -284,-0.1 -283,-0.3 -285,-0.1 -6,-0.1 0.809 360.0 360.0-106.4 360.0 7.2 17.4 35.0 291 !* 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 0.0 292 825 B M 0 0 134 0, 0.0 2,-0.1 0, 0.0 253,-0.1 0.000 360.0 360.0 360.0 -52.7 13.9 44.7 89.7 293 826 B E - 0 0 73 1,-0.2 252,-0.1 252,-0.1 251,-0.1 -0.298 360.0 -48.0 -95.6-170.9 11.8 47.9 89.7 294 827 B A - 0 0 49 -2,-0.1 248,-0.2 248,-0.1 -1,-0.2 -0.341 56.3-163.8 -63.7 132.5 12.8 51.4 90.7 295 828 B I E -K 541 0D 32 246,-2.5 246,-2.3 -3,-0.1 5,-0.1 -0.897 27.9 -95.2-115.6 151.9 14.6 51.7 94.1 296 829 B P E > -K 540 0D 67 0, 0.0 4,-2.8 0, 0.0 3,-0.2 -0.248 34.3-116.0 -58.8 148.9 15.1 54.9 96.2 297 830 B V H > S+ 0 0 25 242,-1.6 4,-3.1 1,-0.2 5,-0.2 0.880 114.8 55.9 -53.1 -46.5 18.4 56.7 95.7 298 831 B K H > S+ 0 0 165 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.916 113.2 42.3 -55.5 -43.8 19.5 56.1 99.3 299 832 B Q H > S+ 0 0 100 -3,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.894 112.2 54.1 -69.2 -41.0 19.0 52.4 98.6 300 833 B F H X S+ 0 0 7 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.922 105.5 54.3 -58.2 -44.9 20.6 52.6 95.2 301 834 B V H X S+ 0 0 45 -4,-3.1 4,-1.0 1,-0.2 -1,-0.2 0.866 110.4 44.9 -61.2 -38.7 23.7 54.2 96.7 302 835 B K H X S+ 0 0 135 -4,-1.4 4,-1.7 -5,-0.2 -1,-0.2 0.875 107.9 59.9 -68.9 -36.4 24.1 51.3 99.1 303 836 B H H X S+ 0 0 63 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.868 100.0 55.8 -59.8 -37.6 23.5 48.9 96.3 304 837 B I H X S+ 0 0 4 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.894 103.0 54.3 -64.2 -38.9 26.5 50.2 94.5 305 838 B G H X S+ 0 0 45 -4,-1.0 4,-1.2 1,-0.2 -1,-0.2 0.912 110.0 47.5 -61.5 -40.1 28.7 49.5 97.4 306 839 B E H >< S+ 0 0 131 -4,-1.7 3,-0.6 1,-0.2 8,-0.5 0.938 108.2 54.9 -62.6 -46.0 27.5 45.9 97.3 307 840 B L H 3< S+ 0 0 3 -4,-2.6 8,-1.6 1,-0.3 7,-0.4 0.846 110.0 47.2 -59.1 -33.9 28.1 45.7 93.6 308 841 B Y H 3X S+ 0 0 79 -4,-2.0 4,-2.8 6,-0.2 -1,-0.3 0.784 96.1 96.2 -76.0 -27.8 31.7 46.8 94.1 309 842 B S H S+ 0 0 62 -4,-1.2 4,-1.5 -3,-0.6 5,-0.7 -0.050 73.1 32.2 -70.7 165.9 32.4 44.4 96.9 310 843 B N H 45S- 0 0 109 1,-0.2 3,-0.3 2,-0.2 -1,-0.2 0.910 143.7 -47.6 56.1 44.1 34.0 41.0 96.7 311 844 B N H 45S- 0 0 147 1,-0.2 -2,-0.2 -3,-0.2 -1,-0.2 0.914 105.6 -56.9 65.0 45.3 36.1 42.2 93.8 312 845 B Q H X5S+ 0 0 74 -4,-2.8 4,-1.8 -6,-0.1 -1,-0.2 0.797 90.9 152.5 58.7 29.3 33.2 43.7 91.9 313 846 B H H X5 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2,-0.2 5,-0.2 0.900 112.1 52.5 -70.4 -37.5 16.1 50.1 82.0 547 1092 B L H X S+ 0 0 0 -4,-2.8 4,-2.1 -5,-0.2 -2,-0.2 0.945 107.4 51.1 -65.0 -46.5 19.1 48.6 80.4 548 1093 B K H < S+ 0 0 56 -4,-2.6 4,-0.4 -5,-0.2 -1,-0.2 0.897 110.4 52.4 -55.4 -39.5 17.4 45.3 79.8 549 1094 B H H >< S+ 0 0 83 -4,-1.6 3,-1.7 -5,-0.2 4,-0.3 0.960 110.5 43.1 -64.8 -51.5 14.6 47.1 78.2 550 1095 B I H >X S+ 0 0 0 -4,-2.4 3,-1.8 1,-0.3 4,-1.5 0.782 100.5 72.2 -70.4 -22.3 16.6 49.2 75.7 551 1096 B R T 3< S+ 0 0 11 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.716 92.1 58.5 -59.1 -20.5 18.7 46.1 74.9 552 1097 B T T <4 S+ 0 0 43 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.623 105.6 50.2 -81.8 -13.2 15.5 44.8 73.1 553 1098 B Q T <4 S+ 0 0 20 -3,-1.8 2,-0.3 1,-0.3 -200,-0.2 0.730 125.5 8.6-100.8 -25.4 15.7 47.9 70.9 554 1099 B R S >< S- 0 0 0 -4,-1.5 3,-1.2 -202,-0.1 -1,-0.3 -0.919 83.1-106.3-155.6 135.0 19.3 47.7 69.8 555 1100 B N T 3 S+ 0 0 10 -204,-0.4 -3,-0.1 -2,-0.3 4,-0.1 -0.216 93.6 3.7 -62.1 141.1 21.9 45.1 70.2 556 1101 B Y T 3 S+ 0 0 95 1,-0.2 -1,-0.2 -5,-0.2 -33,-0.1 0.549 72.1 174.1 67.3 12.7 24.8 45.5 72.7 557 1102 B L S < S+ 0 0 0 -3,-1.2 -37,-0.2 -7,-0.1 -1,-0.2 -0.355 78.0 20.1 -54.0 124.6 23.7 48.9 74.1 558 1103 B V S S- 0 0 0 -39,-2.6 -38,-0.2 -38,-0.4 -37,-0.1 0.912 88.5-166.0 64.3 95.1 26.2 49.3 76.9 559 1104 B Q + 0 0 75 -4,-0.1 2,-0.3 2,-0.0 -39,-0.1 0.808 52.8 39.3 -93.2 -32.1 28.7 47.0 75.5 560 1105 B T S > S- 0 0 47 1,-0.1 4,-1.7 -40,-0.0 3,-0.3 -0.814 73.7-119.8-123.4 159.4 31.3 46.2 78.2 561 1106 B E H > S+ 0 0 41 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.905 114.1 59.5 -60.1 -42.6 31.2 45.7 82.0 562 1107 B E H > S+ 0 0 124 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.855 105.2 49.4 -56.6 -36.4 33.5 48.7 82.5 563 1108 B Q H > S+ 0 0 39 -3,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.896 109.4 51.3 -69.5 -39.4 30.8 50.8 80.8 564 1109 B Y H X S+ 0 0 1 -4,-1.7 4,-1.3 1,-0.2 -2,-0.2 0.944 112.0 47.1 -61.9 -48.0 28.2 49.3 83.1 565 1110 B I H X S+ 0 0 20 -4,-3.1 4,-2.1 1,-0.2 3,-0.3 0.896 107.9 56.3 -57.1 -42.7 30.3 50.1 86.1 566 1111 B F H X S+ 0 0 42 -4,-2.1 4,-2.9 -5,-0.2 5,-0.2 0.892 100.2 58.9 -62.5 -39.2 31.0 53.6 84.8 567 1112 B I H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.918 107.9 46.5 -52.2 -44.4 27.2 54.3 84.6 568 1113 B H H X S+ 0 0 2 -4,-1.3 4,-2.9 -3,-0.3 -2,-0.2 0.909 111.1 51.1 -69.5 -38.9 27.0 53.6 88.3 569 1114 B D H X S+ 0 0 42 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.933 111.4 48.2 -61.3 -46.5 30.0 55.8 89.1 570 1115 B A H X S+ 0 0 0 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.907 113.7 46.7 -60.3 -43.4 28.6 58.7 87.2 571 1116 B L H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.2 5,-0.2 0.907 109.5 53.4 -72.0 -39.1 25.2 58.3 88.9 572 1117 B L H X S+ 0 0 40 -4,-2.9 4,-2.5 1,-0.2 5,-0.2 0.955 110.3 48.9 -55.2 -48.6 26.7 58.0 92.4 573 1118 B E H X S+ 0 0 83 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.912 109.4 51.6 -58.3 -43.2 28.6 61.3 91.7 574 1119 B A H >< S+ 0 0 16 -4,-2.2 3,-0.6 1,-0.2 -1,-0.2 0.944 112.3 46.2 -60.1 -45.9 25.4 63.0 90.5 575 1120 B I H 3< S+ 0 0 45 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.867 112.7 49.4 -65.0 -38.4 23.6 61.9 93.7 576 1121 B L H 3< 0 0 138 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.645 360.0 360.0 -76.1 -13.9 26.4 63.0 95.9 577 1122 B G << 0 0 97 -4,-1.2 -3,-0.0 -3,-0.6 0, 0.0 -0.395 360.0 360.0-100.9 360.0 26.7 66.4 94.2