==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-OCT-06 2NLK . COMPND 2 MOLECULE: PROTEIN TYROSINE PHOSPHATASE, RECEPTOR TYPE, G VA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.FILIPPAKOPOULOS,O.GILEADI,C.JOHANSSON,E.UGOCHUKWU,A.EDWARD . 553 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25032.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 379 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 79 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 1.3 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 . 39 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 151 27.3 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 0 0 0 0 2 1 0 3 3 0 0 0 1 0 0 2 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 4 1 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 4 1 2 1 0 0 1 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 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 1 827 A A 0 0 84 0, 0.0 256,-0.2 0, 0.0 254,-0.0 0.000 360.0 360.0 360.0 -26.1 15.9 15.3 50.3 2 828 A I E -A 256 0A 53 254,-1.9 254,-1.3 2,-0.0 5,-0.1 -0.934 360.0-126.9-124.6 106.7 16.2 12.3 47.8 3 829 A P E > -A 255 0A 69 0, 0.0 3,-1.8 0, 0.0 252,-0.3 -0.202 26.7-118.3 -50.2 143.4 14.0 9.3 48.4 4 830 A V G > S+ 0 0 30 250,-3.2 3,-0.8 1,-0.3 4,-0.4 0.666 111.4 63.0 -67.2 -17.8 16.2 6.1 48.5 5 831 A K G 3 S+ 0 0 79 249,-0.3 4,-0.4 1,-0.2 -1,-0.3 0.745 98.6 56.7 -72.9 -25.4 14.4 4.6 45.4 6 832 A Q G <> S+ 0 0 106 -3,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.438 87.1 85.3 -83.4 1.9 15.7 7.6 43.3 7 833 A F H <> S+ 0 0 3 -3,-0.8 4,-2.7 2,-0.3 5,-0.3 0.903 81.4 52.5 -80.8 -45.5 19.3 6.9 44.2 8 834 A V H > S+ 0 0 81 -4,-0.4 4,-1.1 -3,-0.2 -1,-0.2 0.939 120.5 39.6 -45.7 -49.1 20.3 4.2 41.6 9 835 A K H > S+ 0 0 58 -4,-0.4 4,-1.4 1,-0.2 -2,-0.3 0.817 112.2 57.1 -71.9 -35.7 18.9 6.8 39.1 10 836 A H H X S+ 0 0 45 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.874 108.0 44.6 -65.8 -43.0 20.4 9.8 41.0 11 837 A I H X S+ 0 0 2 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.798 107.3 61.0 -75.3 -29.5 24.0 8.6 40.9 12 838 A G H X S+ 0 0 42 -4,-1.1 4,-1.1 -5,-0.3 -1,-0.2 0.880 106.6 45.9 -59.2 -41.7 23.6 7.6 37.2 13 839 A E H < S+ 0 0 119 -4,-1.4 8,-0.4 2,-0.2 -1,-0.2 0.676 111.3 51.9 -74.7 -24.3 22.8 11.3 36.5 14 840 A L H < S+ 0 0 10 -4,-0.9 8,-1.3 7,-0.2 7,-0.5 0.834 113.0 45.5 -77.5 -34.5 25.8 12.5 38.6 15 841 A Y H X S+ 0 0 81 -4,-2.1 4,-1.8 4,-0.1 -2,-0.2 0.740 98.9 94.4 -75.7 -25.6 28.1 10.1 36.6 16 842 A S H X>S+ 0 0 62 -4,-1.1 4,-1.2 2,-0.2 5,-0.6 -0.232 76.1 29.2 -74.2 158.0 26.6 11.1 33.3 17 843 A N H >45S- 0 0 130 1,-0.2 3,-1.2 2,-0.2 -1,-0.2 0.985 142.8 -45.5 56.7 64.5 28.0 13.8 30.9 18 844 A N H 345S- 0 0 158 1,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.848 103.0 -66.6 43.9 46.7 31.6 13.3 32.1 19 845 A Q H 3X5S+ 0 0 67 -4,-1.8 4,-1.8 1,-0.1 -1,-0.2 0.850 86.6 155.2 50.4 42.4 30.5 13.3 35.8 20 846 A H H S+ 0 0 0 -8,-1.3 4,-2.7 2,-0.2 5,-0.2 0.900 115.1 49.3 -56.4 -45.8 29.6 15.3 40.8 23 849 A S H X S+ 0 0 42 -4,-1.8 4,-2.1 -9,-0.3 -2,-0.2 0.906 113.4 44.2 -62.7 -50.5 32.0 18.1 39.7 24 850 A E H X S+ 0 0 116 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.902 115.6 49.4 -54.5 -50.1 29.4 20.9 40.0 25 851 A D H X S+ 0 0 27 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.914 112.5 44.5 -60.4 -52.1 28.2 19.5 43.4 26 852 A F H X S+ 0 0 13 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.894 112.1 53.1 -68.0 -37.5 31.6 19.1 45.0 27 853 A E H X S+ 0 0 102 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.861 108.7 51.6 -57.5 -38.2 32.6 22.6 43.6 28 854 A E H X S+ 0 0 84 -4,-2.0 4,-0.9 2,-0.2 -2,-0.2 0.911 109.6 48.7 -63.5 -45.8 29.4 23.9 45.3 29 855 A V H >< S+ 0 0 0 -4,-2.3 3,-0.7 1,-0.2 4,-0.2 0.922 110.3 52.6 -57.4 -48.5 30.5 22.2 48.6 30 856 A Q H 3< S+ 0 0 61 -4,-2.9 3,-0.3 1,-0.2 -2,-0.2 0.867 118.4 35.0 -55.1 -40.3 34.0 23.8 48.2 31 857 A R H >< S+ 0 0 162 -4,-1.8 3,-0.7 1,-0.2 4,-0.5 0.451 90.2 96.8 -95.4 -0.9 32.5 27.4 47.8 32 858 A C T << S+ 0 0 31 -4,-0.9 -1,-0.2 -3,-0.7 -2,-0.1 0.546 91.2 33.6 -76.8 -8.0 29.5 27.2 50.1 33 859 A T T >> S+ 0 0 20 -3,-0.3 3,-1.5 -4,-0.2 4,-0.5 0.434 87.8 96.6-120.1 -1.2 31.1 28.8 53.2 34 860 A A G X4 S+ 0 0 37 -3,-0.7 3,-1.2 1,-0.3 -2,-0.1 0.915 87.4 47.9 -54.6 -49.1 33.5 31.3 51.6 35 861 A D G 34 S+ 0 0 155 -4,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.535 97.8 71.3 -69.6 -11.4 31.0 34.2 52.0 36 862 A M G <4 S- 0 0 106 -3,-1.5 -1,-0.2 2,-0.0 -2,-0.2 0.627 90.3-144.0 -83.5 -15.0 30.2 33.3 55.7 37 863 A N << - 0 0 133 -3,-1.2 2,-0.2 -4,-0.5 -3,-0.1 0.890 21.9-167.3 52.3 48.3 33.7 34.6 56.7 38 864 A I - 0 0 39 -5,-0.5 2,-0.2 1,-0.1 -1,-0.2 -0.458 11.1-139.5 -68.3 127.5 34.0 31.8 59.4 39 865 A T - 0 0 71 -2,-0.2 22,-2.2 1,-0.0 23,-0.4 -0.592 26.8-177.1 -95.1 158.2 37.0 32.7 61.7 40 866 A A > + 0 0 9 20,-0.3 4,-1.1 -2,-0.2 20,-0.1 -0.478 27.2 147.2-145.6 65.5 39.7 30.4 63.2 41 867 A E T 4 S+ 0 0 138 2,-0.2 4,-0.3 1,-0.2 19,-0.1 0.836 70.7 50.4 -80.2 -34.8 41.7 32.9 65.3 42 868 A H T >4 S+ 0 0 66 2,-0.2 3,-0.7 1,-0.2 6,-0.2 0.887 109.3 52.7 -69.8 -43.9 42.7 30.5 68.2 43 869 A S T 34 S+ 0 0 2 16,-0.5 -1,-0.2 1,-0.2 -2,-0.2 0.879 114.1 44.8 -49.0 -44.5 44.0 27.9 65.6 44 870 A N T 3< S+ 0 0 101 -4,-1.1 -1,-0.2 3,-0.0 -2,-0.2 0.447 84.3 116.3 -86.8 -2.9 46.1 30.8 64.1 45 871 A H S X S- 0 0 67 -3,-0.7 3,-2.1 -4,-0.3 4,-0.3 -0.547 72.6-127.3 -68.1 132.0 47.3 32.1 67.4 46 872 A P G > S+ 0 0 105 0, 0.0 3,-0.9 0, 0.0 4,-0.3 0.760 107.1 58.7 -48.0 -34.7 51.2 31.8 67.5 47 873 A E G 3 S+ 0 0 59 1,-0.2 3,-0.2 2,-0.1 -4,-0.1 0.642 107.8 45.3 -73.5 -18.2 51.0 29.9 70.9 48 874 A N G X S+ 0 0 0 -3,-2.1 3,-1.3 -6,-0.2 -1,-0.2 0.289 83.7 101.4-104.3 3.5 48.8 27.2 69.5 49 875 A K G X S+ 0 0 125 -3,-0.9 3,-1.1 -4,-0.3 -2,-0.1 0.866 79.3 50.9 -59.0 -43.1 50.9 26.8 66.4 50 876 A H G 3 S+ 0 0 109 -4,-0.3 -1,-0.3 1,-0.2 50,-0.2 0.525 102.3 62.9 -71.6 -8.4 52.7 23.6 67.7 51 877 A K G < S+ 0 0 20 -3,-1.3 27,-0.5 -8,-0.1 2,-0.4 0.219 88.6 83.0-101.3 3.3 49.3 22.0 68.5 52 878 A N < - 0 0 20 -3,-1.1 3,-0.1 1,-0.1 6,-0.1 -0.969 65.6-155.2-108.2 130.6 48.2 22.0 64.8 53 879 A R S S+ 0 0 37 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.936 84.6 26.4 -69.0 -47.7 49.4 19.2 62.5 54 880 A Y S > S- 0 0 75 3,-0.3 3,-1.1 178,-0.1 -1,-0.2 -0.957 72.2-136.2-124.5 138.8 49.2 21.2 59.4 55 881 A I T 3 S+ 0 0 125 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.0 0.781 105.6 47.8 -56.0 -33.0 49.4 25.1 59.0 56 882 A N T 3 S+ 0 0 92 1,-0.1 2,-0.7 2,-0.1 -1,-0.2 0.491 93.8 82.0 -89.0 -12.8 46.3 25.1 56.6 57 883 A I < + 0 0 2 -3,-1.1 -3,-0.3 -14,-0.1 2,-0.2 -0.874 63.6 172.7-110.5 110.3 44.0 22.9 58.6 58 884 A L - 0 0 29 -2,-0.7 2,-0.6 -6,-0.1 212,-0.4 -0.578 36.4-122.5-120.0 164.5 42.2 24.9 61.3 59 885 A A - 0 0 0 -2,-0.2 -16,-0.5 210,-0.1 -17,-0.2 -0.976 35.9-126.2-109.4 111.3 39.5 24.6 63.9 60 886 A Y >> - 0 0 28 -2,-0.6 4,-1.2 208,-0.3 3,-0.9 -0.327 16.9-126.2 -53.8 136.8 36.8 27.3 63.4 61 887 A D T 34 S+ 0 0 28 -22,-2.2 3,-0.2 1,-0.2 -21,-0.1 0.822 102.3 54.5 -59.7 -41.0 36.2 29.3 66.5 62 888 A H T 34 S+ 0 0 122 -23,-0.4 -1,-0.2 1,-0.2 -22,-0.1 0.757 121.4 26.4 -69.2 -25.2 32.4 28.8 66.8 63 889 A S T <4 S+ 0 0 12 -3,-0.9 18,-3.0 205,-0.2 -1,-0.2 0.343 88.2 125.1-121.7 -1.6 32.4 25.0 66.7 64 890 A R E < -B 80 0B 7 -4,-1.2 2,-0.3 16,-0.3 16,-0.3 -0.369 66.5-115.2 -62.3 140.2 35.9 24.2 68.1 65 891 A V E - 0 0 0 14,-1.6 12,-0.6 12,-0.2 2,-0.5 -0.627 33.3-146.4 -73.9 132.0 36.0 21.9 71.1 66 892 A K E -B 76 0B 124 -2,-0.3 2,-0.3 10,-0.1 10,-0.2 -0.887 1.6-140.3-105.8 133.2 37.3 23.8 74.1 67 893 A L - 0 0 3 8,-3.1 3,-0.1 -2,-0.5 41,-0.1 -0.706 35.4-101.2 -80.0 140.0 39.5 22.3 76.8 68 894 A R - 0 0 134 -2,-0.3 -1,-0.1 1,-0.1 43,-0.0 -0.379 51.5 -96.3 -52.1 136.5 38.7 23.5 80.4 69 895 A P - 0 0 112 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.261 38.2-151.1 -58.7 146.6 41.3 26.1 81.3 70 896 A L 0 0 89 -3,-0.1 4,-0.2 0, 0.0 5,-0.1 -0.916 360.0 360.0-113.8 148.0 44.4 25.0 83.4 71 897 A P 0 0 174 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.574 360.0 360.0 -69.6 360.0 46.4 27.0 85.9 72 ! 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 73 903 A H > 0 0 101 0, 0.0 3,-1.3 0, 0.0 -28,-0.0 0.000 360.0 360.0 360.0 1.2 45.6 29.1 75.2 74 904 A S T 3 + 0 0 39 1,-0.2 -6,-0.0 -4,-0.2 -7,-0.0 0.739 360.0 68.2 -69.3 -20.6 45.3 25.9 77.3 75 905 A D T 3 S+ 0 0 36 -9,-0.1 -8,-3.1 -5,-0.1 2,-0.4 0.586 81.3 108.5 -71.7 -9.7 41.7 25.6 76.0 76 906 A Y E < +B 66 0B 0 -3,-1.3 2,-0.3 -10,-0.2 -10,-0.1 -0.570 30.3 151.3 -90.3 129.7 42.8 24.9 72.5 77 907 A I E - 0 0 7 -12,-0.6 2,-1.8 -2,-0.4 -12,-0.2 -0.990 49.4-117.8-142.5 141.5 42.6 21.7 70.5 78 908 A N E S+ 0 0 0 -27,-0.5 17,-1.7 -2,-0.3 2,-0.3 -0.628 77.9 110.5 -80.5 82.3 42.3 21.3 66.7 79 909 A A E - C 0 94B 0 -2,-1.8 -14,-1.6 15,-0.2 2,-0.3 -0.963 47.7-162.3-154.8 139.9 38.9 19.5 67.0 80 910 A N E -BC 64 93B 0 13,-2.6 13,-3.0 -2,-0.3 -16,-0.3 -0.990 24.1-117.8-128.5 146.5 35.4 20.6 66.0 81 911 A Y E - C 0 92B 45 -18,-3.0 2,-0.4 -2,-0.3 11,-0.2 -0.531 36.4-172.7 -68.5 146.6 31.9 19.4 67.0 82 912 A V E - C 0 91B 0 9,-2.1 9,-2.7 -2,-0.2 8,-0.4 -0.988 19.7-116.8-148.9 134.0 30.1 18.2 63.9 83 913 A D E - 0 0 26 -2,-0.4 5,-0.2 6,-0.2 2,-0.2 -0.291 23.2-162.6 -70.1 160.3 26.5 17.1 63.6 84 914 A G E > - C 0 87B 9 3,-2.8 3,-0.6 161,-0.1 2,-0.5 -0.453 47.2 -51.4-114.6-161.6 25.2 13.7 62.8 85 915 A Y T 3 S- 0 0 42 1,-0.2 3,-0.0 -2,-0.2 161,-0.0 -0.693 121.5 -14.6 -77.9 121.6 21.8 12.5 61.6 86 916 A N T 3 S+ 0 0 94 -2,-0.5 2,-0.3 1,-0.1 -1,-0.2 0.701 123.3 91.9 58.5 22.1 19.0 13.8 63.9 87 917 A K E X -C 84 0B 84 -3,-0.6 -3,-2.8 0, 0.0 3,-0.7 -0.920 68.1-138.6-153.3 121.4 21.7 14.8 66.5 88 918 A A E 3 S+ 0 0 72 -2,-0.3 -5,-0.1 1,-0.2 -3,-0.1 -0.543 90.1 7.8 -72.5 139.9 23.6 17.9 67.2 89 919 A K E 3 S+ 0 0 110 -2,-0.2 -6,-0.2 1,-0.1 -1,-0.2 0.861 76.6 151.9 55.3 44.5 27.2 17.5 68.1 90 920 A A E < + 0 0 3 -3,-0.7 136,-2.3 -8,-0.4 2,-0.3 0.818 63.1 36.0 -71.9 -32.0 27.3 13.7 67.3 91 921 A Y E -Cd 82 226B 1 -9,-2.7 -9,-2.1 134,-0.3 2,-0.5 -0.881 59.8-149.7-121.4 148.5 30.9 13.8 66.4 92 922 A I E -Cd 81 227B 0 134,-2.2 136,-2.6 -2,-0.3 2,-0.5 -0.996 25.1-162.9-101.0 116.9 34.2 15.5 67.5 93 923 A A E +Cd 80 228B 0 -13,-3.0 -13,-2.6 -2,-0.5 2,-0.3 -0.897 24.0 156.4 -99.2 128.5 36.3 15.6 64.2 94 924 A T E -Cd 79 229B 3 134,-1.9 136,-0.7 -2,-0.5 -15,-0.2 -0.925 40.5 -91.5-149.2 158.6 39.9 16.3 65.0 95 925 A Q - 0 0 5 -17,-1.7 137,-0.2 -2,-0.3 136,-0.2 -0.314 54.8 -84.1 -66.5 159.2 43.5 15.8 63.7 96 926 A G - 0 0 0 135,-2.5 -1,-0.1 34,-0.2 135,-0.1 -0.533 64.3-108.3 -58.7 120.9 45.7 12.9 64.3 97 927 A P - 0 0 2 0, 0.0 35,-1.7 0, 0.0 2,-0.2 -0.135 28.0-139.2 -58.9 155.9 47.1 13.9 67.7 98 928 A L >> - 0 0 29 33,-0.1 3,-1.2 -47,-0.1 4,-0.9 -0.672 28.5-106.9-105.3 161.8 50.8 15.0 68.1 99 929 A K G >4 S+ 0 0 161 1,-0.3 3,-0.7 -2,-0.2 4,-0.4 0.907 124.5 53.6 -52.8 -40.5 53.1 14.1 70.9 100 930 A S G 34 S+ 0 0 62 1,-0.2 -1,-0.3 -50,-0.2 4,-0.2 0.673 114.9 40.9 -68.8 -18.1 52.7 17.7 72.2 101 931 A T G <> S+ 0 0 4 -3,-1.2 4,-2.6 2,-0.1 -1,-0.2 0.364 79.9 102.1-114.6 5.6 48.8 17.2 72.1 102 932 A F H S+ 0 0 103 -4,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.949 112.2 47.7 -59.1 -54.4 47.4 15.1 77.0 104 934 A D H > S+ 0 0 24 -4,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.904 111.0 52.8 -52.0 -49.7 44.9 17.6 75.5 105 935 A F H X S+ 0 0 2 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.954 113.9 40.2 -50.6 -56.8 43.4 14.8 73.3 106 936 A W H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.863 114.5 54.0 -69.8 -34.7 42.8 12.3 76.2 107 937 A R H X S+ 0 0 26 -4,-2.6 4,-3.3 2,-0.2 -1,-0.2 0.923 109.0 48.5 -58.8 -49.7 41.6 15.2 78.4 108 938 A M H X S+ 0 0 0 -4,-2.9 4,-1.6 2,-0.2 6,-0.2 0.838 109.4 52.9 -58.3 -39.3 39.1 16.2 75.8 109 939 A I H X>S+ 0 0 1 -4,-2.0 5,-2.0 -5,-0.2 4,-0.6 0.949 114.1 42.8 -63.8 -45.2 38.0 12.5 75.6 110 940 A W H ><5S+ 0 0 21 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.960 116.2 48.6 -58.2 -50.8 37.5 12.6 79.4 111 941 A E H 3<5S+ 0 0 44 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.722 114.1 44.1 -67.3 -23.8 35.8 16.1 79.4 112 942 A Q H 3<5S- 0 0 40 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.488 107.7-120.1-101.3 -2.0 33.4 15.3 76.6 113 943 A N T <<5 + 0 0 62 -3,-1.1 111,-3.2 -4,-0.6 2,-0.3 0.865 49.0 174.7 62.8 40.5 32.4 11.8 77.9 114 944 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223 1053 A T - 0 0 40 -3,-0.5 -1,-0.2 1,-0.1 -109,-0.2 -0.805 57.5-109.4-120.2 161.0 27.4 9.1 75.8 224 1054 A G - 0 0 9 -111,-3.2 -109,-0.3 -2,-0.3 -111,-0.2 -0.151 58.7 -56.0 -76.7-179.4 29.5 12.0 74.6 225 1055 A P - 0 0 13 0, 0.0 2,-0.4 0, 0.0 -109,-0.3 -0.234 54.0-111.9 -59.8 146.5 30.4 12.6 70.9 226 1056 A V E -d 91 0B 5 -136,-2.3 -134,-2.2 -112,-0.1 2,-0.5 -0.680 31.3-134.1 -74.9 129.7 32.1 9.9 68.9 227 1057 A L E -df 92 117B 0 -111,-2.8 -109,-3.4 -2,-0.4 2,-0.4 -0.806 24.9-176.3 -93.0 126.6 35.7 11.1 68.1 228 1058 A V E +df 93 118B 0 -136,-2.6 -134,-1.9 -2,-0.5 2,-0.3 -0.993 11.6 160.4-125.3 123.5 36.7 10.6 64.5 229 1059 A H E +df 94 119B 0 -111,-2.7 -109,-2.7 -2,-0.4 -134,-0.2 -0.972 16.9 163.6-139.4 161.8 40.2 11.4 63.3 230 1060 A C - 0 0 6 -136,-0.7 -109,-0.2 -2,-0.3 -100,-0.0 -0.219 68.3 -61.3-135.4-124.0 42.6 10.7 60.5 231 1061 A S S S+ 0 0 7 -111,-0.2 -135,-2.5 -136,-0.2 -178,-0.1 0.853 134.2 15.6 -91.0 -67.5 45.7 12.8 59.8 232 1062 A A S S- 0 0 12 -137,-0.2 -178,-0.1 -179,-0.1 -137,-0.1 0.791 98.7-129.5 -74.1 -29.1 44.3 16.3 59.0 233 1063 A G S S+ 0 0 0 -138,-0.1 -138,-0.1 -154,-0.0 -5,-0.1 0.780 86.4 77.2 81.7 32.9 40.9 15.3 60.5 234 1064 A V S > S+ 0 0 0 3,-0.1 4,-1.4 37,-0.1 39,-0.5 0.595 85.6 40.1-135.2 -50.2 38.9 16.5 57.5 235 1065 A G H > S+ 0 0 1 2,-0.2 4,-2.2 38,-0.2 38,-0.3 0.997 126.3 23.1 -82.5 -66.5 38.9 14.1 54.4 236 1066 A R H > S+ 0 0 23 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.865 126.4 55.2 -63.1 -39.5 38.7 10.5 55.6 237 1067 A T H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.934 110.6 42.5 -57.4 -49.3 37.1 11.8 58.8 238 1068 A G H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 5,-0.2 0.876 111.1 56.8 -68.3 -41.7 34.3 13.7 56.8 239 1069 A T H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.943 109.2 46.2 -46.2 -57.2 33.8 10.8 54.5 240 1070 A Y H X S+ 0 0 7 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.859 111.5 51.6 -50.6 -48.2 33.1 8.6 57.5 241 1071 A I H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.827 112.8 44.9 -66.5 -35.9 30.8 11.1 59.1 242 1072 A V H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.907 114.7 45.7 -79.5 -42.1 28.7 11.5 55.9 243 1073 A I H X S+ 0 0 1 -4,-2.5 4,-2.6 -5,-0.2 -2,-0.2 0.929 117.0 47.5 -64.1 -44.6 28.4 7.7 55.1 244 1074 A D H X S+ 0 0 2 -4,-2.7 4,-1.9 -5,-0.2 -2,-0.2 0.965 114.7 44.7 -54.7 -56.9 27.6 7.1 58.8 245 1075 A S H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.876 116.9 45.3 -58.6 -41.7 25.0 9.9 58.9 246 1076 A M H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.869 107.0 58.2 -73.8 -34.3 23.4 8.9 55.6 247 1077 A L H X S+ 0 0 26 -4,-2.6 4,-1.6 -5,-0.3 -2,-0.2 0.909 111.7 43.5 -54.2 -42.5 23.5 5.2 56.6 248 1078 A Q H X S+ 0 0 60 -4,-1.9 4,-1.1 2,-0.2 -2,-0.2 0.790 111.3 53.1 -73.6 -31.1 21.3 6.3 59.6 249 1079 A Q H X>S+ 0 0 22 -4,-1.7 4,-3.1 2,-0.2 5,-1.1 0.918 108.6 50.2 -68.4 -45.3 19.1 8.7 57.5 250 1080 A I H X5S+ 0 0 31 -4,-2.5 4,-1.1 1,-0.2 -2,-0.2 0.947 109.3 52.0 -56.3 -50.9 18.3 5.8 55.0 251 1081 A K H <5S+ 0 0 187 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.807 119.9 34.3 -52.3 -35.2 17.3 3.5 57.9 252 1082 A D H <5S+ 0 0 114 -4,-1.1 -2,-0.2 -3,-0.3 -1,-0.2 0.862 138.1 9.0 -98.3 -44.4 14.9 6.1 59.4 253 1083 A K H <5S- 0 0 147 -4,-3.1 -3,-0.2 2,-0.2 -2,-0.1 0.626 87.5-123.5-110.7 -22.0 13.3 8.0 56.5 254 1084 A S S < + 0 0 49 -2,-0.3 4,-2.3 -256,-0.2 5,-0.3 -0.361 18.6 151.8-148.0 56.0 20.8 14.0 51.6 258 1088 A V H > S+ 0 0 9 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.935 74.8 42.6 -62.5 -50.6 24.6 14.0 50.8 259 1089 A L H > S+ 0 0 41 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.911 118.0 42.9 -66.3 -48.4 24.9 17.4 49.4 260 1090 A G H > S+ 0 0 34 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.898 117.6 45.9 -68.1 -42.8 22.8 19.3 51.9 261 1091 A F H X S+ 0 0 17 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.928 114.5 48.5 -61.4 -48.0 24.1 17.5 54.9 262 1092 A L H X S+ 0 0 0 -4,-2.8 4,-1.6 -5,-0.3 -2,-0.2 0.881 109.7 51.9 -61.5 -43.7 27.8 17.9 53.7 263 1093 A K H < S+ 0 0 64 -4,-2.5 4,-0.4 -5,-0.2 -1,-0.2 0.887 109.4 52.3 -61.3 -37.0 27.2 21.7 53.0 264 1094 A H H >< S+ 0 0 85 -4,-1.7 3,-1.8 1,-0.2 4,-0.3 0.959 108.9 47.3 -58.1 -53.7 25.9 22.0 56.6 265 1095 A I H >X S+ 0 0 0 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- 0 0 48 -40,-0.1 4,-2.0 1,-0.1 3,-0.3 -0.879 66.8-124.9-128.0 154.0 38.4 15.6 47.5 276 1106 A E H > S+ 0 0 47 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.791 114.7 57.8 -64.5 -28.3 35.9 15.1 44.7 277 1107 A E H > S+ 0 0 112 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.829 105.5 49.6 -73.0 -30.1 37.0 11.5 44.6 278 1108 A Q H > S+ 0 0 14 -3,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.880 109.1 52.5 -72.4 -40.1 36.0 11.2 48.3 279 1109 A Y H X S+ 0 0 1 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.857 110.6 47.5 -54.8 -46.0 32.6 12.8 47.4 280 1110 A I H X S+ 0 0 15 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.833 108.1 55.2 -68.2 -37.6 32.1 10.2 44.7 281 1111 A F H X S+ 0 0 5 -4,-1.5 4,-2.6 2,-0.2 5,-0.3 0.845 102.0 57.5 -67.1 -35.4 33.1 7.3 47.0 282 1112 A I H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.965 112.0 42.8 -55.0 -47.7 30.4 8.5 49.5 283 1113 A H H X S+ 0 0 2 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.898 113.8 49.5 -66.6 -47.2 27.9 8.0 46.7 284 1114 A D H X S+ 0 0 48 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.943 114.1 46.1 -52.8 -53.9 29.3 4.7 45.4 285 1115 A A H X S+ 0 0 0 -4,-2.6 4,-0.9 1,-0.2 -2,-0.2 0.842 112.1 48.9 -66.0 -39.3 29.4 3.2 48.9 286 1116 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.3 -1,-0.2 0.883 112.6 49.3 -68.0 -39.5 25.9 4.4 49.9 287 1117 A L H X S+ 0 0 35 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.920 109.3 52.0 -59.6 -48.3 24.5 3.0 46.6 288 1118 A E H X S+ 0 0 68 -4,-2.7 4,-1.1 1,-0.2 -1,-0.2 0.746 110.6 50.5 -55.1 -27.7 26.3 -0.2 47.3 289 1119 A A H < S+ 0 0 12 -4,-0.9 4,-0.4 2,-0.2 -2,-0.2 0.910 109.2 48.0 -80.3 -48.1 24.6 -0.2 50.7 290 1120 A I H < S+ 0 0 48 -4,-2.4 3,-0.3 1,-0.2 -2,-0.2 0.854 120.1 38.8 -57.3 -37.9 21.1 0.3 49.4 291 1121 A L H < S+ 0 0 87 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.654 106.9 59.1 -93.3 -23.1 21.5 -2.5 46.8 292 1122 A G S < S- 0 0 16 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.442 84.8-156.8 -90.3 0.6 23.5 -5.2 48.6 293 1123 A K - 0 0 71 -4,-0.4 2,-0.3 -3,-0.3 -1,-0.3 -0.307 41.8 -62.2 60.5-142.4 20.8 -5.6 51.4 294 1124 A E + 0 0 133 1,-0.1 -1,-0.1 -2,-0.0 -5,-0.0 -0.964 52.4 171.5-143.4 138.2 22.4 -7.1 54.5 295 1125 A T + 0 0 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