==== 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 3QCH . COMPND 2 MOLECULE: RECEPTOR-TYPE TYROSINE-PROTEIN PHOSPHATASE GAMMA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.SHERIFF . 284 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13471.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 193 68.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 18 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 79 27.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 1 0 1 0 1 0 0 0 1 0 0 1 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 PARALLEL BRIDGES PER LADDER . 1 2 0 1 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 1 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 0 137 0, 0.0 2,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 62.4 24.5 6.9 70.3 2 826 A E - 0 0 85 1,-0.1 251,-0.1 251,-0.0 247,-0.0 -0.620 360.0 -86.6 -83.6 159.2 21.5 4.8 69.3 3 827 A A - 0 0 40 -2,-0.2 247,-0.2 247,-0.1 -1,-0.1 -0.251 39.7-120.6 -62.9 155.1 18.6 6.8 67.7 4 828 A I E -A 249 0A 45 245,-3.4 245,-2.5 -3,-0.1 5,-0.1 -0.865 29.0-111.4 -98.8 130.5 16.0 8.3 70.0 5 829 A P E > -A 248 0A 55 0, 0.0 3,-2.0 0, 0.0 4,-0.5 -0.349 26.4-122.3 -60.5 142.7 12.4 7.1 69.4 6 830 A V G >> S+ 0 0 28 241,-2.7 3,-1.2 1,-0.3 4,-0.6 0.840 108.1 63.3 -59.7 -32.5 10.4 10.0 68.0 7 831 A K G 34 S+ 0 0 184 240,-0.3 -1,-0.3 1,-0.3 4,-0.2 0.602 109.8 38.9 -70.2 -10.6 7.9 9.8 70.9 8 832 A Q G <> S+ 0 0 98 -3,-2.0 4,-1.6 2,-0.1 -1,-0.3 0.359 91.2 90.8-116.6 1.2 10.6 10.7 73.4 9 833 A F H <> S+ 0 0 2 -3,-1.2 4,-2.0 -4,-0.5 -2,-0.1 0.878 86.0 48.0 -73.8 -38.5 12.5 13.3 71.4 10 834 A V H X S+ 0 0 42 -4,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.902 109.9 54.8 -67.9 -39.2 10.6 16.4 72.5 11 835 A K H > S+ 0 0 162 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.914 108.7 49.5 -52.4 -40.8 11.0 15.1 76.1 12 836 A H H X S+ 0 0 47 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.835 104.7 56.6 -75.1 -31.8 14.7 15.1 75.3 13 837 A I H X S+ 0 0 3 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.918 103.0 56.7 -60.4 -42.3 14.6 18.6 73.9 14 838 A G H X S+ 0 0 44 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.923 108.8 45.8 -52.4 -45.9 13.2 19.7 77.3 15 839 A E H < S+ 0 0 129 -4,-1.4 8,-0.4 1,-0.2 -1,-0.2 0.896 110.3 51.6 -69.9 -40.4 16.3 18.2 79.0 16 840 A L H < S+ 0 0 7 -4,-2.3 8,-1.6 1,-0.2 7,-0.7 0.881 112.6 48.0 -61.2 -37.6 18.8 19.7 76.6 17 841 A Y H X S+ 0 0 69 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.789 92.1 104.2 -71.0 -30.0 17.2 23.1 77.1 18 842 A S H X>S+ 0 0 49 -4,-1.4 4,-1.4 2,-0.2 5,-0.6 -0.014 77.0 20.6 -61.0 158.5 17.2 22.9 80.9 19 843 A N H >45S- 0 0 136 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.935 142.0 -44.9 51.4 56.0 19.6 24.7 83.1 20 844 A N H 345S- 0 0 144 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.2 0.858 105.5 -60.5 55.8 41.6 20.5 27.3 80.5 21 845 A Q H 3X5S+ 0 0 73 -4,-2.5 4,-1.8 -3,-0.1 -1,-0.2 0.828 84.7 153.1 64.7 32.1 20.9 24.9 77.7 22 846 A H H S+ 0 0 0 -8,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.883 112.0 52.8 -57.7 -36.8 22.8 21.5 74.1 25 849 A S H X S+ 0 0 31 -4,-1.8 4,-2.3 -9,-0.3 -2,-0.2 0.943 107.4 48.1 -69.1 -50.3 26.2 22.9 75.0 26 850 A E H X S+ 0 0 80 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.930 112.8 51.5 -50.2 -48.7 27.7 19.5 76.0 27 851 A D H X S+ 0 0 26 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.893 112.0 42.9 -57.9 -44.9 26.3 18.1 72.7 28 852 A F H X S+ 0 0 12 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.816 110.4 56.4 -78.6 -31.0 27.8 20.8 70.4 29 853 A E H X S+ 0 0 80 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.866 107.3 51.0 -60.5 -37.3 31.1 20.8 72.3 30 854 A E H X S+ 0 0 58 -4,-1.7 4,-1.6 -5,-0.2 -2,-0.2 0.920 109.4 50.2 -67.1 -44.8 31.2 17.1 71.4 31 855 A V H >< S+ 0 0 0 -4,-1.9 3,-0.6 1,-0.2 -2,-0.2 0.957 111.4 46.8 -55.8 -54.0 30.5 17.9 67.8 32 856 A Q H 3< S+ 0 0 98 -4,-2.8 3,-0.4 1,-0.2 -1,-0.2 0.758 115.6 47.5 -64.1 -25.4 33.3 20.4 67.6 33 857 A R H >< S+ 0 0 128 -4,-1.4 3,-3.8 1,-0.2 4,-0.3 0.710 86.7 86.4 -84.0 -24.2 35.6 18.0 69.3 34 858 A C T << S+ 0 0 38 -4,-1.6 -1,-0.2 -3,-0.6 -2,-0.1 0.400 87.1 55.4 -69.8 7.9 34.8 15.0 67.2 35 859 A T T > S+ 0 0 47 -3,-0.4 3,-2.4 -4,-0.1 -1,-0.3 0.450 80.6 104.6-101.4 -9.4 37.4 16.1 64.7 36 860 A A T < S+ 0 0 71 -3,-3.8 2,-0.3 1,-0.3 -2,-0.1 0.846 86.9 30.7 -42.8 -65.1 40.1 16.2 67.5 37 861 A D T 3 S+ 0 0 166 -4,-0.3 2,-0.4 1,-0.0 -1,-0.3 -0.118 108.1 98.4 -89.1 36.9 42.0 13.0 66.6 38 862 A M < - 0 0 85 -3,-2.4 2,-0.6 -2,-0.3 -1,-0.0 -0.924 51.5-169.7-136.2 109.1 41.2 13.5 63.0 39 863 A N - 0 0 149 -2,-0.4 2,-0.5 2,-0.0 -2,-0.0 -0.854 12.1-174.8 -92.7 123.4 43.4 15.1 60.3 40 864 A I - 0 0 35 -2,-0.6 2,-0.1 -5,-0.0 -2,-0.0 -0.984 18.9-132.9-122.0 124.1 41.4 15.7 57.1 41 865 A T + 0 0 77 -2,-0.5 22,-2.4 1,-0.1 23,-0.4 -0.427 29.2 170.1 -81.4 145.7 43.3 17.0 54.1 42 866 A A > + 0 0 9 20,-0.3 4,-1.2 -2,-0.1 19,-0.2 -0.329 21.4 147.7-142.7 55.0 42.2 19.9 51.9 43 867 A E T 4 S+ 0 0 134 1,-0.2 4,-0.2 2,-0.2 3,-0.2 0.860 70.6 53.9 -67.6 -37.7 45.3 20.4 49.8 44 868 A H T >4 S+ 0 0 62 1,-0.2 3,-1.8 2,-0.2 6,-0.3 0.921 104.6 54.2 -61.4 -45.5 43.4 21.6 46.7 45 869 A S T 34 S+ 0 0 0 16,-0.5 -1,-0.2 1,-0.3 -2,-0.2 0.837 110.5 49.0 -56.9 -32.2 41.6 24.3 48.6 46 870 A N T 3< S+ 0 0 78 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.369 83.5 117.1 -92.3 3.7 44.9 25.6 49.8 47 871 A H S X> S- 0 0 73 -3,-1.8 3,-2.1 -4,-0.2 4,-1.0 -0.596 71.9-123.6 -83.8 137.0 46.6 25.7 46.4 48 872 A P T 34 S+ 0 0 86 0, 0.0 4,-0.4 0, 0.0 3,-0.2 0.726 111.2 52.5 -49.5 -33.3 47.7 29.1 45.1 49 873 A E T 34 S+ 0 0 98 1,-0.2 3,-0.3 2,-0.1 4,-0.1 0.861 113.4 44.1 -68.8 -35.3 45.7 28.7 41.9 50 874 A N T X4 S+ 0 0 0 -3,-2.1 3,-1.5 -6,-0.3 4,-0.2 0.558 87.4 89.5 -92.3 -9.3 42.6 27.9 43.8 51 875 A K G >< S+ 0 0 124 -4,-1.0 3,-1.6 1,-0.3 -1,-0.2 0.845 83.4 54.3 -62.8 -37.5 42.7 30.6 46.6 52 876 A H G 3 S+ 0 0 112 -4,-0.4 -1,-0.3 -3,-0.3 52,-0.1 0.656 100.8 66.4 -69.6 -11.2 40.8 33.3 44.7 53 877 A K G < S+ 0 0 20 -3,-1.5 2,-0.5 -8,-0.1 29,-0.5 0.483 86.3 82.6 -89.2 -5.4 38.1 30.6 44.3 54 878 A N < - 0 0 19 -3,-1.6 3,-0.1 -4,-0.2 6,-0.1 -0.884 63.9-156.7-100.3 132.2 37.4 30.6 48.1 55 879 A R S S+ 0 0 44 -2,-0.5 2,-0.4 1,-0.2 -1,-0.2 0.956 87.0 27.3 -65.3 -54.7 35.1 33.2 49.6 56 880 A Y S > S- 0 0 78 3,-0.3 3,-1.5 169,-0.1 -1,-0.2 -0.945 78.1-136.5-113.4 134.8 36.6 32.8 53.1 57 881 A I T 3 S+ 0 0 156 -2,-0.4 -1,-0.1 1,-0.3 -2,-0.0 0.865 102.3 44.6 -56.8 -41.5 40.2 31.7 53.6 58 882 A N T 3 S+ 0 0 59 1,-0.1 2,-0.8 2,-0.1 -1,-0.3 0.370 92.1 88.2 -92.0 5.6 39.5 29.3 56.5 59 883 A I < + 0 0 15 -3,-1.5 -3,-0.3 -14,-0.1 2,-0.2 -0.857 64.6 173.7-105.9 103.3 36.4 27.7 55.0 60 884 A L - 0 0 29 -2,-0.8 2,-0.6 -6,-0.1 203,-0.5 -0.537 35.9-119.5-114.1 169.0 37.8 24.8 52.9 61 885 A A - 0 0 0 -2,-0.2 -16,-0.5 -19,-0.2 -17,-0.2 -0.940 33.4-125.4-110.0 114.6 36.7 21.8 50.8 62 886 A Y >> - 0 0 31 -2,-0.6 4,-1.3 199,-0.2 3,-0.7 -0.328 16.9-131.2 -61.3 133.5 37.9 18.5 52.1 63 887 A D T 34 S+ 0 0 31 -22,-2.4 3,-0.4 1,-0.2 -1,-0.1 0.870 99.5 56.0 -53.0 -45.0 39.8 16.5 49.4 64 888 A H T 34 S+ 0 0 119 -23,-0.4 -1,-0.2 1,-0.2 197,-0.1 0.821 120.4 26.3 -66.9 -31.0 38.0 13.2 49.8 65 889 A S T <4 S+ 0 0 11 -3,-0.7 20,-2.6 195,-0.1 -1,-0.2 0.435 88.8 129.5-110.1 -3.5 34.4 14.5 49.4 66 890 A R B < -B 84 0B 12 -4,-1.3 2,-0.4 -3,-0.4 18,-0.3 -0.184 63.6-114.6 -58.5 142.3 35.1 17.6 47.2 67 891 A V - 0 0 0 16,-1.8 2,-0.5 14,-0.3 14,-0.5 -0.673 32.0-142.9 -76.8 129.6 33.0 17.9 44.1 68 892 A K - 0 0 132 -2,-0.4 2,-0.3 12,-0.1 12,-0.2 -0.832 2.1-144.7-100.2 128.8 35.3 17.7 41.0 69 893 A L - 0 0 4 10,-3.1 3,-0.1 -2,-0.5 39,-0.0 -0.706 33.9-105.0 -79.4 137.6 34.7 19.7 37.9 70 894 A R - 0 0 47 -2,-0.3 -1,-0.1 1,-0.1 45,-0.1 -0.489 52.0-107.4 -54.9 130.2 35.6 17.9 34.7 71 895 A P - 0 0 96 0, 0.0 8,-0.1 0, 0.0 -1,-0.1 -0.291 29.8-128.7 -72.6 153.7 38.9 19.6 33.8 72 896 A L 0 0 76 3,-0.4 6,-0.2 1,-0.2 5,-0.1 -0.815 360.0 360.0-108.3 140.7 39.2 22.1 30.9 73 897 A P 0 0 167 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 0.837 360.0 360.0 -61.8 360.0 41.7 22.2 28.0 74 ! 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 75 901 A S > 0 0 96 0, 0.0 3,-1.2 0, 0.0 -3,-0.4 0.000 360.0 360.0 360.0 142.9 44.9 23.8 33.4 76 902 A K T 3 + 0 0 83 1,-0.3 3,-0.1 2,-0.1 0, 0.0 0.496 360.0 40.1 -75.3 -5.0 45.7 21.5 36.3 77 903 A H T > S+ 0 0 29 1,-0.1 3,-1.9 -5,-0.1 -1,-0.3 0.313 76.0 103.2-128.6 6.0 43.3 23.2 38.7 78 904 A S T < S+ 0 0 18 -3,-1.2 -2,-0.1 1,-0.3 -1,-0.1 0.358 75.6 70.8 -69.7 8.4 40.2 24.0 36.6 79 905 A D T 3 S+ 0 0 25 -8,-0.1 -10,-3.1 -3,-0.1 2,-0.3 0.561 80.1 100.1-100.5 -10.7 38.8 21.0 38.4 80 906 A Y < + 0 0 0 -3,-1.9 2,-0.3 -12,-0.2 -12,-0.1 -0.574 34.5 155.3 -87.6 137.0 38.4 22.8 41.7 81 907 A I - 0 0 7 -14,-0.5 2,-1.6 -2,-0.3 -14,-0.3 -0.964 50.7-108.3-148.0 144.3 35.4 24.4 43.3 82 908 A N S S+ 0 0 1 -29,-0.5 17,-1.4 -2,-0.3 2,-0.3 -0.549 79.9 105.6 -76.1 92.3 34.7 25.0 47.0 83 909 A A E - C 0 98B 0 -2,-1.6 -16,-1.8 15,-0.2 2,-0.3 -0.973 47.1-160.2-168.3 144.2 32.0 22.3 47.5 84 910 A N E -BC 66 97B 0 13,-2.1 13,-2.5 -2,-0.3 -18,-0.2 -0.987 24.3-116.9-136.0 148.2 31.6 18.8 49.0 85 911 A Y E - C 0 96B 38 -20,-2.6 2,-0.3 -2,-0.3 11,-0.2 -0.568 35.8-169.8 -72.2 146.1 29.2 16.0 48.6 86 912 A V E - C 0 95B 0 9,-2.3 9,-2.4 -2,-0.2 8,-0.9 -0.984 19.6-111.1-140.1 149.5 27.3 15.3 51.8 87 913 A D E - 0 0 24 -2,-0.3 5,-0.2 6,-0.3 2,-0.2 -0.479 21.1-158.2 -83.0 148.7 25.0 12.4 52.8 88 914 A G E > - C 0 91B 6 3,-1.3 3,-1.1 -2,-0.2 2,-0.4 -0.350 53.0 -53.0 -99.3-166.8 21.3 12.5 53.3 89 915 A Y T 3 S- 0 0 36 1,-0.3 -1,-0.1 -2,-0.2 3,-0.1 -0.564 122.1 -14.8 -71.8 126.1 19.4 10.0 55.4 90 916 A N T 3 S+ 0 0 134 -2,-0.4 2,-0.3 1,-0.1 -1,-0.3 0.845 124.5 90.7 51.2 35.9 20.1 6.4 54.2 91 917 A K E < S-C 88 0B 104 -3,-1.1 -3,-1.3 0, 0.0 3,-0.4 -0.964 70.2-130.6-157.5 145.4 21.7 7.8 51.0 92 918 A A E S+ 0 0 65 -2,-0.3 -5,-0.1 1,-0.2 -3,-0.1 -0.791 86.2 3.4-102.5 144.1 25.2 8.9 50.0 93 919 A K E S+ 0 0 111 -2,-0.3 -6,-0.3 1,-0.1 -1,-0.2 0.919 74.0 150.7 50.5 49.2 25.9 12.2 48.3 94 920 A A E + 0 0 2 -8,-0.9 125,-2.8 -3,-0.4 2,-0.3 0.734 65.0 36.4 -75.5 -21.6 22.3 13.4 48.6 95 921 A Y E -Cd 86 219B 3 -9,-2.4 -9,-2.3 123,-0.3 2,-0.5 -0.919 60.5-149.7-129.3 150.0 23.6 17.0 48.8 96 922 A I E -Cd 85 220B 0 123,-3.0 125,-2.9 -2,-0.3 2,-0.6 -0.996 21.9-164.7-109.0 121.2 26.2 19.3 47.5 97 923 A A E +Cd 84 221B 0 -13,-2.5 -13,-2.1 -2,-0.5 2,-0.3 -0.918 23.0 157.6-100.8 122.5 27.0 21.8 50.1 98 924 A T E -Cd 83 222B 2 123,-2.5 125,-0.6 -2,-0.6 -15,-0.2 -0.944 41.3 -94.5-143.8 165.1 28.9 24.8 48.7 99 925 A Q - 0 0 3 -17,-1.4 126,-0.2 -2,-0.3 125,-0.1 -0.302 54.5 -87.2 -69.1 158.8 29.7 28.4 49.3 100 926 A G - 0 0 0 124,-2.9 -1,-0.1 34,-0.2 2,-0.1 -0.579 61.3-105.3 -62.0 129.4 27.7 31.2 47.7 101 927 A P - 0 0 1 0, 0.0 35,-0.9 0, 0.0 5,-0.1 -0.355 29.6-139.4 -69.8 138.4 29.5 31.6 44.3 102 928 A L > - 0 0 29 -49,-0.2 3,-1.2 33,-0.1 4,-0.2 -0.332 30.4-102.1 -82.3 168.3 31.8 34.6 43.6 103 929 A K G > S+ 0 0 137 1,-0.2 3,-1.5 2,-0.2 4,-0.3 0.957 124.4 53.1 -49.2 -53.7 31.9 36.6 40.4 104 930 A S G 3 S+ 0 0 71 1,-0.3 -1,-0.2 -52,-0.1 4,-0.1 0.472 113.7 42.4 -70.1 -2.3 35.1 34.7 39.5 105 931 A T G <> S+ 0 0 5 -3,-1.2 4,-2.1 2,-0.1 -1,-0.3 0.181 75.5 105.5-129.7 19.5 33.4 31.3 40.0 106 932 A F H <> S+ 0 0 17 -3,-1.5 4,-1.9 -4,-0.2 5,-0.2 0.838 84.4 51.3 -64.4 -35.0 29.9 31.7 38.4 107 933 A E H > S+ 0 0 113 -4,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.950 110.5 47.0 -67.5 -49.1 31.1 29.5 35.5 108 934 A D H > S+ 0 0 22 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.905 110.2 56.1 -57.7 -41.1 32.3 26.8 37.7 109 935 A F H X S+ 0 0 1 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.896 111.9 38.9 -62.2 -44.8 29.1 26.9 39.7 110 936 A W H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.777 113.7 56.4 -79.1 -24.6 26.8 26.4 36.8 111 937 A R H X S+ 0 0 37 -4,-2.1 4,-3.3 2,-0.2 3,-0.4 0.974 107.0 48.6 -66.6 -55.2 29.1 23.8 35.2 112 938 A M H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.3 6,-0.3 0.889 108.8 55.4 -46.2 -45.3 29.0 21.8 38.4 113 939 A I H <>S+ 0 0 0 -4,-1.5 5,-1.7 -5,-0.2 4,-0.3 0.907 114.3 39.4 -59.0 -40.6 25.3 22.1 38.3 114 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S+ 0 0 11 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.896 109.0 47.5 -65.8 -41.6 21.2 23.1 59.4 233 1070 A Y H X S+ 0 0 9 -4,-2.3 4,-3.1 2,-0.2 5,-0.2 0.956 112.8 49.5 -61.0 -50.6 19.1 22.5 56.3 234 1071 A I H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.916 111.9 45.7 -59.8 -50.3 20.8 19.2 55.7 235 1072 A V H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.899 115.0 47.6 -61.8 -40.9 20.4 17.8 59.2 236 1073 A I H X S+ 0 0 1 -4,-2.0 4,-1.4 -5,-0.2 -2,-0.2 0.945 114.8 45.7 -68.1 -47.1 16.7 18.9 59.4 237 1074 A D H >X S+ 0 0 3 -4,-3.1 4,-2.0 -5,-0.2 3,-0.8 0.968 113.9 48.0 -54.9 -56.2 15.9 17.5 56.0 238 1075 A S H 3X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.874 111.1 52.4 -55.5 -38.5 17.7 14.2 56.7 239 1076 A M H 3X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.711 104.8 52.2 -78.0 -23.8 16.0 13.8 60.1 240 1077 A L H S+ 0 0 21 -4,-2.0 4,-3.0 1,-0.2 5,-1.0 0.878 111.6 50.8 -68.1 -38.0 14.5 9.3 59.2 243 1080 A I H X5S+ 0 0 30 -4,-1.8 4,-2.0 4,-0.2 -1,-0.2 0.970 111.1 48.9 -59.8 -50.5 11.5 10.1 61.2 244 1081 A K H <5S+ 0 0 83 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.848 120.5 36.6 -57.8 -37.5 9.2 9.2 58.3 245 1082 A D H <5S+ 0 0 99 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.909 139.6 6.3 -86.0 -46.6 11.0 6.0 57.7 246 1083 A K H <5S- 0 0 123 -4,-3.0 -3,-0.2 2,-0.2 -2,-0.2 0.510 86.6-125.4-117.0 -12.4 11.9 4.6 61.1 247 1084 A S S < + 0 0 36 -2,-0.4 4,-1.7 -247,-0.2 5,-0.2 -0.554 15.1 155.1-140.4 77.0 19.7 10.9 65.7 251 1088 A V H > S+ 0 0 3 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.938 77.1 47.2 -65.5 -46.6 20.7 14.5 65.4 252 1089 A L H > S+ 0 0 23 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.915 113.6 45.8 -66.4 -45.6 24.0 14.1 67.2 253 1090 A G H > S+ 0 0 10 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.902 114.7 47.3 -63.2 -41.5 25.2 11.0 65.4 254 1091 A F H X S+ 0 0 20 -4,-1.7 4,-2.4 2,-0.2 5,-0.2 0.851 111.1 49.9 -73.2 -34.6 24.4 12.3 62.0 255 1092 A L H X S+ 0 0 0 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.908 107.8 53.9 -72.1 -40.5 26.0 15.7 62.5 256 1093 A K H < S+ 0 0 50 -4,-1.9 4,-0.3 -5,-0.2 -1,-0.2 0.888 111.6 49.1 -53.8 -41.7 29.2 14.0 63.8 257 1094 A H H >< S+ 0 0 86 -4,-1.5 3,-1.9 1,-0.2 4,-0.4 0.961 110.9 43.6 -65.7 -56.6 29.2 12.0 60.6 258 1095 A I H >X S+ 0 0 0 -4,-2.4 3,-1.1 1,-0.3 4,-0.9 0.718 99.3 75.4 -70.6 -15.4 28.6 14.7 58.0 259 1096 A R T 3< S+ 0 0 11 -4,-1.6 -1,-0.3 1,-0.3 5,-0.2 0.708 90.9 55.7 -63.4 -22.2 31.2 16.8 59.8 260 1097 A T T <4 S+ 0 0 41 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.686 105.2 55.2 -77.3 -18.9 33.9 14.6 58.3 261 1098 A Q T <4 S+ 0 0 22 -3,-1.1 2,-0.2 -4,-0.4 -2,-0.2 0.666 123.9 4.8 -92.9 -19.5 32.4 15.4 54.9 262 1099 A R S >< S- 0 0 0 -4,-0.9 3,-0.9 -201,-0.1 -1,-0.3 -0.836 85.1-103.2-166.2 129.3 32.7 19.3 55.1 263 1100 A N T 3 S+ 0 0 7 -203,-0.5 -3,-0.1 -2,-0.2 4,-0.1 -0.157 92.7 2.0 -61.7 142.9 34.2 21.5 57.7 264 1101 A Y T 3 S+ 0 0 103 1,-0.2 2,-0.4 -5,-0.2 -1,-0.2 0.779 72.0 174.9 60.7 35.1 32.0 23.4 60.2 265 1102 A L S < S+ 0 0 0 -3,-0.9 -37,-0.2 1,-0.2 -1,-0.2 -0.642 76.2 19.1 -73.6 132.1 28.6 22.1 59.1 266 1103 A V S S- 0 0 0 -39,-2.3 -38,-0.2 -2,-0.4 -1,-0.2 0.969 86.4-165.0 60.4 87.5 26.2 23.6 61.6 267 1104 A Q + 0 0 85 -3,-0.1 2,-0.3 -4,-0.1 -39,-0.1 0.578 55.5 38.7 -89.3 -14.3 28.6 26.2 62.8 268 1105 A T S > S- 0 0 51 -40,-0.1 4,-2.0 1,-0.1 5,-0.1 -0.965 72.8-121.9-137.1 155.6 27.0 27.4 66.1 269 1106 A E H > S+ 0 0 42 -2,-0.3 4,-2.8 2,-0.2 5,-0.2 0.858 113.1 60.2 -55.6 -39.8 25.2 26.1 69.0 270 1107 A E H > S+ 0 0 115 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.918 107.4 45.5 -60.5 -43.9 22.2 28.4 68.3 271 1108 A Q H > S+ 0 0 38 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.885 109.7 55.2 -60.4 -40.4 21.9 26.6 64.9 272 1109 A Y H X S+ 0 0 1 -4,-2.0 4,-1.0 1,-0.2 -2,-0.2 0.903 111.4 44.9 -63.0 -37.8 22.3 23.3 66.6 273 1110 A I H X S+ 0 0 23 -4,-2.8 4,-2.2 1,-0.2 3,-0.4 0.902 106.5 59.0 -69.6 -40.8 19.3 24.3 68.8 274 1111 A F H X S+ 0 0 28 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.873 99.3 59.6 -56.4 -38.2 17.3 25.6 65.9 275 1112 A I H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.907 106.5 46.3 -55.9 -45.4 17.5 22.1 64.3 276 1113 A H H X S+ 0 0 2 -4,-1.0 4,-2.9 -3,-0.4 -1,-0.2 0.923 109.3 54.4 -65.3 -43.6 15.7 20.6 67.3 277 1114 A D H X S+ 0 0 40 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.867 108.7 50.1 -57.1 -37.9 13.1 23.4 67.3 278 1115 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.948 112.2 45.4 -67.5 -45.8 12.3 22.6 63.7 279 1116 A L H X S+ 0 0 0 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.846 110.0 56.2 -69.0 -31.5 12.0 18.9 64.4 280 1117 A L H X S+ 0 0 36 -4,-2.9 4,-2.7 2,-0.2 5,-0.4 0.945 106.8 48.9 -61.8 -47.5 9.9 19.7 67.5 281 1118 A E H X S+ 0 0 73 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.883 110.5 52.2 -56.3 -40.3 7.5 21.7 65.3 282 1119 A A H < S+ 0 0 8 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.801 114.5 41.3 -68.7 -30.1 7.3 18.8 62.9 283 1120 A I H >< S+ 0 0 36 -4,-1.5 3,-1.6 -3,-0.4 -2,-0.2 0.928 116.6 44.4 -87.1 -49.5 6.5 16.2 65.6 284 1121 A L H 3< S+ 0 0 113 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.841 107.7 64.1 -59.2 -31.7 4.0 18.3 67.6 285 1122 A G T 3< 0 0 64 -4,-1.6 -1,-0.3 -5,-0.4 -2,-0.2 0.661 360.0 360.0 -67.6 -14.1 2.5 19.2 64.3 286 1123 A K < 0 0 123 -3,-1.6 -2,-0.2 -4,-0.1 -1,-0.1 0.867 360.0 360.0-106.5 360.0 1.5 15.6 63.7