==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 12-OCT-11 3U6J . COMPND 2 MOLECULE: VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.A.WHITTINGTON,A.LONG,P.ROSE,Y.GU,H.ZHAO . 308 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16270.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 204 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 19 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 28.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 0 2 0 1 0 1 0 0 0 0 1 0 2 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 2 1 1 1 0 0 1 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 . 1 0 1 0 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 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 1 815 A E 0 0 150 0, 0.0 64,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 3.4 6.6 -0.7 -6.2 2 816 A H > + 0 0 142 63,-0.1 3,-1.7 4,-0.0 4,-0.1 0.245 360.0 16.3-136.9-111.4 5.8 1.9 -3.5 3 817 A C G > S+ 0 0 27 1,-0.3 3,-2.1 2,-0.2 63,-0.1 0.709 104.5 73.0 -61.8 -31.0 7.0 3.1 -0.1 4 818 A E G 3 S+ 0 0 21 1,-0.3 -1,-0.3 61,-0.1 62,-0.0 0.722 92.3 61.7 -55.5 -20.2 10.4 1.4 -0.0 5 819 A R G < S+ 0 0 170 -3,-1.7 -1,-0.3 2,-0.0 -2,-0.2 0.344 76.2 116.2 -95.6 4.8 11.5 4.1 -2.5 6 820 A L S < S- 0 0 71 -3,-2.1 66,-0.0 1,-0.1 -4,-0.0 -0.401 79.4 -84.8 -70.5 150.0 10.9 7.1 -0.3 7 821 A P - 0 0 127 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.251 42.6-144.9 -60.1 143.6 13.9 9.3 0.7 8 822 A Y - 0 0 56 -3,-0.1 2,-1.1 67,-0.0 64,-0.0 -0.951 5.8-146.3-119.8 127.1 15.9 8.2 3.7 9 823 A D >> + 0 0 82 -2,-0.5 4,-2.4 1,-0.2 3,-0.5 -0.758 20.1 176.3 -92.3 93.8 17.6 10.5 6.3 10 824 A A H 3> S+ 0 0 38 -2,-1.1 4,-1.9 1,-0.2 -1,-0.2 0.834 76.6 60.0 -68.6 -34.5 20.7 8.5 7.3 11 825 A S H 34 S+ 0 0 114 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.782 115.6 35.7 -64.3 -26.7 22.0 11.3 9.6 12 826 A K H <4 S+ 0 0 146 -3,-0.5 -2,-0.2 3,-0.0 -1,-0.2 0.855 133.2 21.2 -90.5 -42.3 18.8 11.0 11.6 13 827 A W H < S+ 0 0 39 -4,-2.4 76,-2.2 75,-0.1 -3,-0.2 0.716 85.3 112.1-107.1 -26.9 18.1 7.3 11.5 14 828 A E B < -a 89 0A 42 -4,-1.9 76,-0.2 -5,-0.3 -4,-0.0 -0.332 41.3-172.9 -64.0 122.8 21.3 5.3 10.7 15 829 A F - 0 0 12 74,-2.6 2,-0.2 -2,-0.2 76,-0.1 -0.958 28.7-111.0-115.2 133.2 22.6 3.2 13.6 16 830 A P > - 0 0 39 0, 0.0 3,-1.2 0, 0.0 74,-0.1 -0.428 14.8-142.9 -64.9 130.4 25.9 1.3 13.4 17 831 A R G > S+ 0 0 55 1,-0.2 3,-1.3 -2,-0.2 73,-0.0 0.797 100.1 62.0 -58.9 -32.9 25.5 -2.5 13.3 18 832 A D G 3 S+ 0 0 142 1,-0.3 -1,-0.2 3,-0.1 -3,-0.0 0.664 96.2 59.0 -69.4 -19.0 28.6 -2.8 15.5 19 833 A R G < S+ 0 0 136 -3,-1.2 21,-2.2 20,-0.0 2,-0.4 0.171 96.8 79.4 -93.2 16.1 26.8 -1.0 18.4 20 834 A L E < -B 39 0A 18 -3,-1.3 2,-0.6 19,-0.2 19,-0.2 -0.988 59.7-166.7-132.4 119.8 24.1 -3.6 18.3 21 835 A K E -B 38 0A 159 17,-2.8 17,-2.3 -2,-0.4 2,-0.2 -0.940 18.1-144.9-110.2 111.7 24.4 -7.1 19.9 22 836 A L E +B 37 0A 76 -2,-0.6 15,-0.2 15,-0.2 14,-0.1 -0.533 25.4 169.5 -76.3 136.7 21.7 -9.4 18.8 23 837 A G E - 0 0 48 13,-3.2 -1,-0.1 1,-0.3 14,-0.1 0.100 43.7 -8.5-115.6-131.0 20.3 -11.9 21.3 24 838 A K E - 0 0 127 11,-0.1 12,-2.8 1,-0.1 -1,-0.3 -0.443 69.0-109.2 -73.9 141.5 17.3 -14.3 21.5 25 839 A P E -B 35 0A 83 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.534 28.4-170.9 -62.9 134.5 14.6 -14.3 18.8 26 840 A L E + 0 0 73 8,-3.1 2,-0.3 1,-0.3 9,-0.2 0.846 66.9 8.2 -92.0 -48.6 11.3 -12.9 20.2 27 841 A G E -B 34 0A 25 7,-1.6 7,-2.6 159,-0.0 2,-0.5 -0.998 60.3-149.5-143.9 143.5 8.9 -13.7 17.4 28 842 A R E -B 33 0A 199 -2,-0.3 159,-0.4 5,-0.2 5,-0.2 -0.949 19.2-179.6-119.9 120.8 9.1 -15.6 14.1 29 843 A G - 0 0 1 3,-2.3 158,-0.2 -2,-0.5 156,-0.2 -0.452 44.6 -92.0-108.9-176.4 7.0 -14.7 11.1 30 844 A A S S+ 0 0 38 156,-0.6 155,-0.1 -2,-0.2 157,-0.1 0.859 119.0 3.1 -64.8 -36.4 6.5 -16.1 7.6 31 845 A F S S+ 0 0 80 153,-1.4 25,-1.9 155,-0.2 2,-0.2 0.715 129.2 32.3-120.1 -41.6 9.2 -13.9 6.0 32 846 A G E - C 0 55A 0 152,-2.3 -3,-2.3 23,-0.2 2,-0.3 -0.544 61.1-143.3-118.2-178.2 10.9 -11.9 8.8 33 847 A Q E -BC 28 54A 43 21,-3.0 21,-2.4 -5,-0.2 2,-0.5 -0.988 10.5-135.1-147.6 150.8 11.8 -12.1 12.5 34 848 A V E -BC 27 53A 18 -7,-2.6 -8,-3.1 -2,-0.3 -7,-1.6 -0.953 26.3-170.3-109.8 127.1 12.0 -9.9 15.7 35 849 A I E -BC 25 52A 13 17,-2.8 17,-2.6 -2,-0.5 2,-0.2 -0.954 23.4-123.4-122.2 133.4 15.1 -10.3 17.8 36 850 A E E + C 0 51A 59 -12,-2.8 -13,-3.2 -2,-0.4 2,-0.3 -0.551 42.8 172.4 -69.8 134.2 15.9 -9.0 21.3 37 851 A A E -BC 22 50A 2 13,-2.2 13,-3.5 -2,-0.2 2,-0.5 -0.992 35.1-128.6-146.6 151.0 19.1 -6.9 21.2 38 852 A D E -BC 21 49A 73 -17,-2.3 -17,-2.8 -2,-0.3 2,-0.4 -0.896 28.8-168.8 -97.8 130.5 21.2 -4.6 23.3 39 853 A A E -BC 20 48A 0 9,-3.1 9,-2.5 -2,-0.5 2,-0.5 -0.962 9.1-147.1-122.3 137.1 22.0 -1.2 21.6 40 854 A F E S- C 0 47A 106 -21,-2.2 7,-0.2 -2,-0.4 -21,-0.0 -0.912 75.1 -0.7-111.2 126.0 24.6 1.3 22.8 41 855 A G S S+ 0 0 32 5,-2.6 -1,-0.2 -2,-0.5 6,-0.1 0.728 80.6 131.9 78.0 25.6 24.2 5.1 22.4 42 856 A I 0 0 28 4,-0.5 -2,-0.1 -3,-0.3 5,-0.1 0.755 360.0 360.0 -78.4 -25.1 20.9 5.0 20.5 43 857 A D 0 0 119 3,-0.3 3,-0.1 0, 0.0 5,-0.0 0.032 360.0 360.0-132.3 360.0 19.4 7.7 22.8 44 ! 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 45 860 A A 0 0 112 0, 0.0 2,-0.3 0, 0.0 -5,-0.0 0.000 360.0 360.0 360.0 52.4 26.6 6.8 26.4 46 861 A T - 0 0 74 -3,-0.1 -5,-2.6 2,-0.0 -4,-0.5 -0.957 360.0-127.2-130.6 146.4 23.9 4.4 27.7 47 862 A C E -C 40 0A 81 -2,-0.3 2,-0.3 -7,-0.2 -7,-0.2 -0.716 28.6-176.5 -90.9 142.7 22.9 0.8 26.9 48 863 A R E -C 39 0A 74 -9,-2.5 -9,-3.1 -2,-0.3 2,-0.4 -0.999 27.5-121.9-142.7 138.1 19.3 0.0 26.0 49 864 A T E +C 38 0A 57 -2,-0.3 54,-0.8 -11,-0.2 2,-0.3 -0.690 41.6 178.1 -78.4 130.5 17.3 -3.1 25.2 50 865 A V E -CD 37 102A 0 -13,-3.5 -13,-2.2 -2,-0.4 2,-0.5 -0.828 31.7-120.5-128.9 165.4 15.7 -2.9 21.7 51 866 A A E -CD 36 101A 11 50,-2.8 50,-3.0 -2,-0.3 2,-0.6 -0.957 27.6-160.7-107.1 127.1 13.6 -4.9 19.3 52 867 A V E -CD 35 100A 0 -17,-2.6 -17,-2.8 -2,-0.5 2,-0.5 -0.933 3.4-161.1-115.4 115.2 15.2 -5.6 16.0 53 868 A K E +CD 34 99A 29 46,-3.0 46,-3.0 -2,-0.6 2,-0.3 -0.833 28.0 147.3 -92.7 126.1 13.1 -6.6 13.0 54 869 A M E -CD 33 98A 22 -21,-2.4 -21,-3.0 -2,-0.5 2,-0.2 -0.915 45.2 -88.1-146.8 173.5 15.1 -8.2 10.1 55 870 A L E -C 32 0A 27 42,-0.5 -23,-0.2 -2,-0.3 3,-0.1 -0.599 38.7-112.1 -90.0 149.0 14.6 -10.8 7.4 56 871 A K > - 0 0 68 -25,-1.9 3,-0.9 -2,-0.2 -1,-0.1 -0.273 52.2 -72.4 -66.2 161.0 15.2 -14.6 7.8 57 872 A E T 3 S+ 0 0 202 1,-0.2 -1,-0.2 -25,-0.0 0, 0.0 -0.261 118.8 25.0 -55.3 137.3 18.1 -16.3 5.9 58 873 A G T 3 S+ 0 0 75 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.755 82.4 173.7 77.9 26.6 17.5 -16.6 2.1 59 874 A A < - 0 0 41 -3,-0.9 -1,-0.2 1,-0.1 2,-0.1 -0.347 25.1-127.1 -65.8 145.1 15.1 -13.7 1.8 60 875 A T > - 0 0 72 1,-0.1 4,-2.0 -2,-0.0 5,-0.1 -0.300 23.7-103.6 -86.2 173.8 14.0 -12.7 -1.7 61 876 A H H > S+ 0 0 136 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.882 122.5 53.0 -64.6 -41.1 14.2 -9.2 -3.3 62 877 A S H > S+ 0 0 60 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.839 109.2 50.0 -63.8 -33.3 10.5 -8.7 -2.9 63 878 A E H > S+ 0 0 45 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.866 109.4 51.3 -70.3 -39.9 10.9 -9.5 0.9 64 879 A H H X S+ 0 0 93 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.919 110.7 49.0 -57.9 -47.0 13.8 -7.0 1.0 65 880 A R H X S+ 0 0 66 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.878 108.5 53.7 -59.0 -42.7 11.4 -4.4 -0.6 66 881 A A H X S+ 0 0 35 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.898 109.1 47.3 -63.0 -41.9 8.7 -5.2 1.9 67 882 A L H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.901 112.4 49.5 -66.6 -40.8 11.0 -4.6 4.9 68 883 A M H X S+ 0 0 35 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.870 109.5 52.3 -64.4 -37.6 12.3 -1.3 3.4 69 884 A S H X S+ 0 0 23 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.914 107.9 52.1 -62.5 -44.0 8.6 -0.3 2.8 70 885 A E H X S+ 0 0 45 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.922 108.8 50.3 -56.1 -47.8 7.9 -1.0 6.4 71 886 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.920 110.7 48.6 -56.3 -47.1 10.8 1.2 7.5 72 887 A K H X S+ 0 0 15 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.859 109.7 51.8 -65.8 -37.9 9.7 4.1 5.4 73 888 A I H X S+ 0 0 70 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.918 109.0 51.1 -63.1 -45.1 6.1 3.9 6.7 74 889 A L H X S+ 0 0 44 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.912 111.5 48.0 -55.4 -46.0 7.5 4.0 10.3 75 890 A I H < S+ 0 0 41 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.919 111.4 50.0 -62.0 -45.9 9.5 7.1 9.4 76 891 A H H < S+ 0 0 79 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.921 109.0 52.2 -58.5 -47.2 6.5 8.8 7.8 77 892 A I H < S- 0 0 23 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.925 94.9-172.4 -57.4 -51.2 4.3 8.1 10.8 78 893 A G < - 0 0 28 -4,-2.1 2,-0.3 -5,-0.2 -1,-0.1 -0.268 28.1 -21.6 87.3-172.0 6.7 9.6 13.3 79 894 A H + 0 0 145 -4,-0.1 2,-0.3 6,-0.1 5,-0.1 -0.532 57.2 146.8 -84.4 134.5 6.9 9.7 17.1 80 895 A H > - 0 0 47 3,-0.3 3,-1.5 -2,-0.3 70,-0.0 -0.930 49.9-123.5-154.6 147.2 4.0 9.3 19.5 81 896 A L T 3 S+ 0 0 90 -2,-0.3 4,-0.1 1,-0.3 69,-0.1 0.832 111.9 48.2 -54.9 -34.7 3.9 7.8 23.0 82 897 A N T 3 S+ 0 0 2 96,-0.1 97,-2.9 64,-0.1 2,-0.4 0.144 99.9 74.2-104.4 19.9 1.2 5.4 21.9 83 898 A V B < S-f 179 0B 12 -3,-1.5 2,-0.4 95,-0.3 -3,-0.3 -0.962 95.2-101.7-123.7 143.3 2.8 4.1 18.7 84 899 A V - 0 0 12 95,-2.4 2,-0.4 -2,-0.4 -2,-0.1 -0.553 49.9-137.1 -64.6 119.9 5.8 1.7 18.6 85 900 A N - 0 0 8 -2,-0.4 17,-1.9 -4,-0.1 2,-0.3 -0.704 1.9-127.0 -97.4 132.8 8.6 4.1 17.9 86 901 A L E - E 0 101A 16 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.553 23.3-179.6 -67.8 128.9 11.5 3.7 15.5 87 902 A L E - 0 0 37 13,-3.1 2,-0.3 1,-0.4 14,-0.2 0.671 60.0 -41.9-102.8 -25.8 14.8 4.2 17.2 88 903 A G E - E 0 100A 1 12,-1.6 12,-2.5 -73,-0.1 -1,-0.4 -0.971 49.2-126.6 173.9 174.2 17.1 3.6 14.2 89 904 A A E -aE 14 99A 0 -76,-2.2 -74,-2.6 -2,-0.3 2,-0.6 -0.995 9.2-142.1-145.9 148.1 17.9 1.5 11.2 90 905 A C E + E 0 98A 0 8,-2.8 8,-1.8 -2,-0.3 -76,-0.1 -0.916 44.5 139.7-110.2 101.4 20.8 -0.4 9.7 91 906 A T + 0 0 42 -2,-0.6 -1,-0.1 6,-0.2 6,-0.1 0.511 35.1 104.4-119.9 -13.8 20.6 0.2 5.9 92 907 A K S > S- 0 0 125 1,-0.1 3,-0.9 4,-0.1 -2,-0.0 -0.306 80.3 -85.7 -74.1 155.3 24.2 0.7 4.9 93 908 A P T 3 S+ 0 0 130 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.209 101.3 62.0 -53.8 148.9 26.4 -2.0 3.0 94 909 A G T 3 S+ 0 0 87 1,-0.2 -2,-0.0 -3,-0.1 -3,-0.0 -0.124 105.8 19.4 124.2 -35.8 28.2 -4.6 5.1 95 910 A G S < S- 0 0 32 -3,-0.9 -1,-0.2 1,-0.1 3,-0.1 -0.861 91.8 -57.6-151.2-176.9 25.2 -6.4 6.8 96 911 A P - 0 0 67 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 -0.180 56.9 -92.4 -69.8 158.2 21.5 -7.0 6.6 97 912 A L - 0 0 15 -6,-0.1 -42,-0.5 -8,-0.1 2,-0.4 -0.572 51.8-176.2 -66.6 126.7 18.6 -4.5 6.6 98 913 A M E -DE 54 90A 8 -8,-1.8 -8,-2.8 -2,-0.3 2,-0.6 -0.996 20.9-157.1-137.2 131.4 17.5 -4.0 10.2 99 914 A V E -DE 53 89A 2 -46,-3.0 -46,-3.0 -2,-0.4 2,-0.6 -0.933 13.9-157.6-109.0 118.0 14.7 -2.0 11.8 100 915 A I E +DE 52 88A 0 -12,-2.5 -13,-3.1 -2,-0.6 -12,-1.6 -0.851 18.6 168.8-103.8 115.0 15.3 -1.0 15.4 101 916 A T E -DE 51 86A 25 -50,-3.0 -50,-2.8 -2,-0.6 -15,-0.2 -0.763 43.0 -78.0-117.7 166.6 12.2 -0.2 17.5 102 917 A E E -D 50 0A 22 -17,-1.9 2,-0.4 -2,-0.3 -52,-0.2 -0.347 48.9-117.3 -61.9 141.0 11.6 0.3 21.2 103 918 A F - 0 0 48 -54,-0.8 2,-0.7 -66,-0.1 -1,-0.1 -0.720 20.0-161.2 -86.0 128.8 11.3 -2.9 23.3 104 919 A C > - 0 0 13 -2,-0.4 3,-1.7 1,-0.1 67,-0.2 -0.903 6.1-163.6-113.2 99.8 8.0 -3.5 25.0 105 920 A K T 3 S+ 0 0 118 -2,-0.7 67,-0.2 1,-0.3 -1,-0.1 0.690 81.2 53.7 -65.9 -25.3 8.8 -6.1 27.7 106 921 A F T 3 S- 0 0 87 65,-1.7 -1,-0.3 1,-0.2 66,-0.1 0.501 95.9-149.9 -90.1 -3.7 5.3 -7.3 28.5 107 922 A G < + 0 0 28 -3,-1.7 64,-2.7 64,-0.5 -1,-0.2 -0.275 48.8 3.6 73.8-156.3 4.5 -8.2 24.8 108 923 A N B > -G 170 0B 43 62,-0.2 4,-1.9 1,-0.1 62,-0.3 -0.276 64.1-128.1 -69.3 150.2 1.1 -8.1 23.2 109 924 A L H > S+ 0 0 0 60,-2.7 4,-3.0 57,-1.2 5,-0.2 0.847 102.3 57.7 -68.6 -38.0 -2.0 -6.9 25.1 110 925 A S H > S+ 0 0 11 56,-0.7 4,-2.0 59,-0.3 -1,-0.2 0.965 111.8 40.3 -57.1 -57.5 -4.3 -9.9 24.4 111 926 A T H > S+ 0 0 71 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.893 116.8 51.1 -58.8 -43.4 -1.8 -12.4 25.9 112 927 A Y H < S+ 0 0 36 -4,-1.9 3,-0.4 1,-0.2 4,-0.3 0.920 109.7 48.5 -62.1 -45.5 -1.0 -10.1 28.8 113 928 A L H >< S+ 0 0 0 -4,-3.0 3,-1.2 1,-0.2 -1,-0.2 0.875 108.8 54.6 -62.2 -37.0 -4.6 -9.4 29.7 114 929 A R H >< S+ 0 0 114 -4,-2.0 3,-0.9 1,-0.3 -1,-0.2 0.776 101.6 58.9 -67.7 -26.4 -5.3 -13.2 29.7 115 930 A S T 3< S+ 0 0 77 -4,-1.2 -1,-0.3 -3,-0.4 3,-0.2 0.549 103.4 53.5 -78.1 -7.6 -2.5 -13.7 32.2 116 931 A K T X + 0 0 16 -3,-1.2 3,-1.7 -4,-0.3 19,-0.3 0.138 66.3 116.4-116.2 15.3 -4.2 -11.4 34.7 117 932 A R T < S+ 0 0 92 -3,-0.9 3,-0.4 1,-0.3 -1,-0.1 0.829 88.8 37.8 -51.8 -36.7 -7.6 -13.1 34.8 118 933 A N T 3 S+ 0 0 156 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.311 111.4 62.8 -98.3 5.3 -7.0 -13.9 38.5 119 934 A E S < S+ 0 0 82 -3,-1.7 16,-2.9 14,-0.1 2,-0.4 -0.338 81.8 104.0-124.1 46.7 -5.3 -10.6 39.1 120 935 A F B +i 135 0C 30 -3,-0.4 16,-0.2 14,-0.2 3,-0.1 -0.993 33.0 164.8-132.2 128.8 -8.2 -8.2 38.4 121 936 A V - 0 0 26 14,-2.1 16,-0.3 -2,-0.4 3,-0.1 -0.989 39.8-128.2-131.1 144.0 -10.4 -6.2 40.7 122 937 A P S S+ 0 0 68 0, 0.0 15,-2.3 0, 0.0 16,-0.5 0.916 96.0 1.7 -56.3 -44.3 -12.7 -3.3 39.5 123 938 A Y S S- 0 0 67 13,-0.2 2,-0.1 14,-0.1 12,-0.0 -0.992 81.9-115.7-140.5 141.9 -11.3 -1.1 42.2 124 939 A K - 0 0 65 -2,-0.3 2,-0.4 -3,-0.1 4,-0.1 -0.457 25.6-151.0 -73.5 149.9 -8.6 -1.7 44.8 125 990 A V - 0 0 90 2,-0.2 5,-0.2 -2,-0.1 6,-0.2 -0.968 36.0 -70.6-121.3 140.5 -9.6 -1.7 48.5 126 991 A A S S+ 0 0 38 -2,-0.4 2,-0.0 1,-0.2 182,-0.0 -0.534 120.2 54.9 -71.7 135.9 -7.2 -0.7 51.4 127 992 A P S > S- 0 0 77 0, 0.0 3,-1.2 0, 0.0 -2,-0.2 0.287 78.2-177.2 -69.9 124.2 -4.9 -2.5 52.3 128 993 A E G > + 0 0 64 1,-0.3 3,-2.0 2,-0.2 -2,-0.1 0.616 66.9 80.8 -74.7 -16.2 -4.0 -2.2 48.6 129 994 A D G > S+ 0 0 123 1,-0.3 3,-1.1 2,-0.2 -1,-0.3 0.689 81.3 68.9 -65.5 -18.1 -0.9 -4.5 48.8 130 995 A L G < S+ 0 0 116 -3,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.736 105.1 41.9 -63.6 -24.9 -3.4 -7.3 48.6 131 996 A Y G X S+ 0 0 60 -3,-2.0 3,-2.3 -6,-0.2 -1,-0.2 -0.052 83.9 161.0-115.0 28.8 -4.0 -6.2 45.0 132 997 A K T < S- 0 0 149 -3,-1.1 3,-0.1 1,-0.3 -3,-0.1 -0.301 74.7 -0.5 -53.7 125.9 -0.3 -5.5 44.2 133 998 A D T 3 S+ 0 0 110 1,-0.2 -1,-0.3 -2,-0.0 2,-0.1 0.577 98.7 147.9 66.2 13.4 0.2 -5.5 40.4 134 999 A F < - 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0 0 36 -2,-0.6 4,-1.3 1,-0.0 3,-0.3 -0.824 64.8 -97.0-135.5 175.9 -11.0 3.7 5.9 219 1084 A I H > S+ 0 0 42 -2,-0.3 4,-1.1 1,-0.2 -64,-0.1 0.771 125.1 59.7 -62.8 -25.6 -10.2 5.3 9.2 220 1085 A Q H > S+ 0 0 79 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.779 101.8 49.8 -75.8 -29.4 -13.9 4.6 10.0 221 1086 A S H > S+ 0 0 4 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.784 105.5 58.3 -77.6 -27.6 -13.4 0.9 9.5 222 1087 A D H X S+ 0 0 1 -4,-1.3 4,-2.5 2,-0.2 -2,-0.2 0.830 101.8 55.4 -61.0 -37.0 -10.5 1.2 11.9 223 1088 A V H X S+ 0 0 3 -4,-1.1 4,-1.8 2,-0.2 -2,-0.2 0.899 104.6 52.1 -63.6 -43.0 -13.0 2.6 14.4 224 1089 A W H >X S+ 0 0 0 -4,-1.2 4,-1.4 2,-0.2 3,-0.5 0.963 110.9 48.0 -53.3 -52.9 -15.1 -0.6 14.0 225 1090 A S H 3X S+ 0 0 8 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.875 106.7 56.4 -55.3 -43.3 -11.8 -2.5 14.8 226 1091 A F H 3X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.849 103.6 54.9 -57.5 -36.9 -11.2 -0.3 17.8 227 1092 A G H <>S+ 0 0 4 -4,-2.2 5,-3.4 1,-0.2 3,-0.8 0.887 111.2 49.1 -59.5 -43.4 -11.0 -7.7 23.9 233 1098 A I H ><5S+ 0 0 0 -4,-2.5 3,-1.0 1,-0.2 -2,-0.2 0.919 113.6 45.1 -63.9 -43.6 -9.7 -5.4 26.6 234 1099 A F T 3<5S+ 0 0 0 -4,-2.5 31,-2.4 1,-0.3 32,-0.3 0.249 111.0 52.5 -92.7 11.6 -12.9 -5.7 28.8 235 1100 A S T < 5S- 0 0 8 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.2 0.230 117.3-116.4-109.8 2.5 -13.0 -9.5 28.3 236 1101 A L T < 5S- 0 0 0 -3,-1.0 -3,-0.2 1,-0.2 -120,-0.1 0.930 79.2 -35.6 52.8 53.2 -9.4 -9.5 29.5 237 1102 A G S S- 0 0 17 1,-0.2 3,-1.8 20,-0.1 -36,-0.0 0.935 92.0-134.1 48.1 65.3 -17.6 -13.7 18.7 242 1107 A P T 3 S- 0 0 89 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.221 75.8 -9.6 -57.6 122.7 -17.2 -16.6 21.2 243 1108 A G T 3 S+ 0 0 89 1,-0.2 2,-0.4 -3,-0.2 -2,-0.1 0.411 99.1 134.1 73.7 -0.8 -18.0 -20.0 19.7 244 1109 A V < - 0 0 52 -3,-1.8 2,-0.2 -4,-0.1 -1,-0.2 -0.698 59.0-123.2 -88.3 127.7 -19.5 -18.5 16.6 245 1110 A K - 0 0 157 -2,-0.4 2,-1.5 -3,-0.1 5,-0.2 -0.512 18.5-134.5 -68.9 130.8 -18.4 -20.0 13.2 246 1111 A I + 0 0 38 -2,-0.2 2,-0.1 4,-0.1 -1,-0.1 -0.643 61.7 116.5 -92.3 80.7 -16.8 -17.3 11.0 247 1112 A D S > S- 0 0 50 -2,-1.5 4,-1.6 0, 0.0 5,-0.1 -0.351 84.1 -66.4-125.3-158.4 -18.6 -18.2 7.8 248 1113 A E H > S+ 0 0 134 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.850 130.3 54.5 -68.5 -37.0 -21.1 -16.6 5.3 249 1114 A E H > S+ 0 0 98 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.896 106.1 52.7 -63.4 -41.7 -23.9 -16.6 7.9 250 1115 A F H > S+ 0 0 4 -5,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.919 111.6 45.2 -57.4 -48.1 -21.6 -14.7 10.4 251 1116 A C H X S+ 0 0 6 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.882 114.0 49.5 -66.1 -40.8 -20.9 -12.0 7.7 252 1117 A R H X S+ 0 0 114 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.948 111.5 47.7 -60.8 -52.3 -24.6 -11.8 6.8 253 1118 A R H <>S+ 0 0 56 -4,-2.9 5,-2.8 1,-0.2 4,-0.4 0.779 108.7 55.6 -62.4 -30.1 -25.8 -11.5 10.4 254 1119 A L H ><5S+ 0 0 4 -4,-1.6 3,-0.8 -5,-0.2 -1,-0.2 0.897 108.4 47.0 -69.0 -42.0 -23.2 -8.8 11.0 255 1120 A K H 3<5S+ 0 0 129 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.841 108.3 57.8 -64.7 -34.4 -24.6 -6.7 8.1 256 1121 A E T 3<5S- 0 0 131 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.533 128.9 -93.4 -76.5 -9.1 -28.1 -7.3 9.5 257 1122 A G T < 5S+ 0 0 43 -3,-0.8 2,-0.3 -4,-0.4 -3,-0.2 0.514 71.2 150.0 110.8 7.7 -27.1 -5.7 12.9 258 1123 A T < + 0 0 65 -5,-2.8 -1,-0.3 -8,-0.1 2,-0.3 -0.557 21.6 178.5 -70.2 133.2 -26.0 -8.6 15.1 259 1124 A R - 0 0 53 -2,-0.3 2,-0.1 1,-0.0 16,-0.0 -0.911 32.4 -89.0-132.8 159.2 -23.4 -7.5 17.6 260 1125 A M - 0 0 8 -2,-0.3 2,-0.1 1,-0.1 15,-0.0 -0.357 43.6-115.4 -63.8 146.9 -21.4 -9.1 20.5 261 1126 A R - 0 0 220 1,-0.2 -20,-0.1 -2,-0.1 -1,-0.1 -0.277 49.4 -70.3 -73.1 167.8 -22.9 -9.2 24.0 262 1127 A A - 0 0 51 1,-0.1 -1,-0.2 2,-0.1 2,-0.1 -0.386 54.0-123.6 -61.5 132.1 -21.3 -7.2 26.8 263 1128 A P > - 0 0 9 0, 0.0 3,-1.5 0, 0.0 -28,-0.2 -0.362 28.4 -99.4 -77.8 165.9 -18.0 -8.8 28.0 264 1129 A D T 3 S+ 0 0 146 1,-0.3 -29,-0.2 -29,-0.1 -2,-0.1 0.689 115.8 38.6 -60.5 -27.8 -17.4 -9.9 31.6 265 1130 A Y T 3 S+ 0 0 58 -31,-2.4 -1,-0.3 2,-0.1 -30,-0.2 0.229 89.5 120.4-112.4 15.0 -15.4 -6.9 32.9 266 1131 A T < - 0 0 34 -3,-1.5 -129,-0.0 -32,-0.3 -4,-0.0 -0.380 54.2-136.3 -80.8 153.7 -17.2 -4.0 31.1 267 1132 A T > - 0 0 23 -2,-0.1 4,-1.8 -130,-0.1 5,-0.2 -0.675 32.6-109.9 -90.7 161.2 -19.0 -1.0 32.4 268 1133 A P H > S+ 0 0 102 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.841 120.2 52.6 -57.7 -35.3 -22.4 0.0 30.9 269 1134 A E H > S+ 0 0 100 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.889 106.9 51.0 -70.0 -40.6 -20.7 3.1 29.4 270 1135 A M H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.870 108.2 52.4 -64.7 -37.6 -17.9 1.1 27.8 271 1136 A Y H X S+ 0 0 54 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.901 108.1 50.0 -67.5 -42.2 -20.3 -1.3 26.1 272 1137 A Q H X S+ 0 0 104 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.893 108.5 54.2 -60.9 -40.1 -22.3 1.5 24.5 273 1138 A T H X S+ 0 0 1 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.917 107.2 50.6 -58.3 -43.9 -19.0 2.9 23.2 274 1139 A M H X S+ 0 0 0 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.943 111.5 47.9 -56.6 -49.9 -18.3 -0.5 21.6 275 1140 A L H < S+ 0 0 49 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.838 108.7 53.9 -60.5 -38.9 -21.8 -0.4 20.0 276 1141 A D H >< S+ 0 0 62 -4,-2.5 3,-1.3 1,-0.2 -1,-0.2 0.885 107.6 50.6 -60.7 -42.3 -21.2 3.2 18.8 277 1142 A C H 3< S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.755 107.7 56.6 -65.2 -25.5 -18.0 1.9 17.1 278 1143 A W T 3< S+ 0 0 1 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.067 73.5 145.6 -98.5 23.6 -20.0 -0.8 15.6 279 1144 A H < - 0 0 81 -3,-1.3 6,-0.1 1,-0.1 -3,-0.1 -0.389 53.7-133.5 -57.7 133.3 -22.6 1.5 13.8 280 1145 A G S S+ 0 0 45 1,-0.1 -1,-0.1 4,-0.1 -70,-0.1 0.785 95.3 69.5 -58.0 -29.5 -23.7 -0.1 10.5 281 1146 A E S >> S- 0 0 114 1,-0.2 3,-1.5 2,-0.0 4,-0.6 -0.853 73.8-154.9 -95.6 112.0 -23.1 3.4 9.0 282 1147 A P G >4 S+ 0 0 32 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.857 96.2 56.3 -51.0 -40.8 -19.4 4.3 8.8 283 1148 A S G 34 S+ 0 0 88 1,-0.2 -3,-0.0 -3,-0.1 -2,-0.0 0.743 104.3 54.5 -63.2 -24.5 -20.3 8.1 8.8 284 1149 A Q G <4 S+ 0 0 120 -3,-1.5 -1,-0.2 2,-0.1 -4,-0.1 0.530 85.3 99.5 -92.0 -6.8 -22.3 7.5 12.1 285 1150 A R S << S- 0 0 11 -3,-1.1 -8,-0.2 -4,-0.6 -9,-0.1 -0.481 84.7-101.1 -72.8 148.9 -19.4 6.0 14.0 286 1151 A P - 0 0 22 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.331 35.3-117.5 -65.5 154.2 -17.5 8.3 16.4 287 1152 A T > - 0 0 70 1,-0.1 4,-1.9 -3,-0.1 5,-0.1 -0.408 26.7-108.3 -78.6 168.4 -14.2 9.7 15.2 288 1153 A F H > S+ 0 0 8 2,-0.2 4,-2.8 1,-0.2 -136,-0.2 0.845 123.4 56.1 -67.2 -33.2 -11.0 8.8 17.1 289 1154 A S H > S+ 0 0 63 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.930 109.5 46.2 -58.1 -46.5 -10.9 12.4 18.4 290 1155 A E H > S+ 0 0 99 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.829 111.6 51.8 -64.2 -34.4 -14.4 11.8 19.7 291 1156 A L H X S+ 0 0 3 -4,-1.9 4,-2.8 2,-0.2 5,-0.3 0.898 108.8 50.2 -69.7 -41.4 -13.3 8.5 21.2 292 1157 A V H X S+ 0 0 21 -4,-2.8 4,-1.7 -144,-0.2 -2,-0.2 0.921 113.6 46.2 -58.2 -47.7 -10.3 10.3 22.9 293 1158 A E H X S+ 0 0 127 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.953 116.3 44.1 -60.4 -52.0 -12.8 12.8 24.4 294 1159 A H H X S+ 0 0 72 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.896 114.6 46.7 -62.9 -46.0 -15.3 10.2 25.5 295 1160 A L H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.805 109.4 56.2 -70.1 -30.7 -12.9 7.8 27.0 296 1161 A G H X S+ 0 0 20 -4,-1.7 4,-1.9 -5,-0.3 -1,-0.2 0.901 108.0 48.4 -61.0 -44.6 -11.2 10.7 28.8 297 1162 A N H X S+ 0 0 80 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.853 112.2 48.6 -62.2 -37.9 -14.6 11.5 30.3 298 1163 A L H X S+ 0 0 21 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.833 109.2 52.0 -73.2 -33.3 -15.0 7.8 31.3 299 1164 A L H X S+ 0 0 40 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.889 113.0 46.5 -65.1 -40.8 -11.5 7.7 32.9 300 1165 A Q H X S+ 0 0 138 -4,-1.9 4,-1.1 2,-0.2 -2,-0.2 0.908 111.9 49.1 -66.1 -48.4 -12.5 10.8 34.9 301 1166 A A H X S+ 0 0 55 -4,-2.4 4,-0.5 1,-0.2 3,-0.2 0.846 108.6 55.1 -60.8 -35.4 -15.9 9.4 35.9 302 1167 A N H >< S+ 0 0 9 -4,-1.9 3,-0.9 1,-0.2 4,-0.2 0.866 101.3 57.7 -68.0 -36.3 -14.1 6.2 37.0 303 1168 A A H >< S+ 0 0 47 -4,-1.4 3,-1.3 1,-0.2 -1,-0.2 0.815 99.8 58.4 -59.6 -34.9 -11.8 8.2 39.3 304 1169 A Q H 3< S+ 0 0 118 -4,-1.1 -1,-0.2 1,-0.3 3,-0.2 0.682 100.0 57.9 -72.0 -18.3 -14.8 9.6 41.2 305 1170 A Q T << S+ 0 0 140 -3,-0.9 2,-0.4 -4,-0.5 -1,-0.3 0.508 103.7 56.4 -83.9 -6.6 -15.8 6.0 42.0 306 1171 A D < + 0 0 66 -3,-1.3 -1,-0.2 -4,-0.2 3,-0.2 -0.714 63.5 137.4-127.4 80.4 -12.4 5.5 43.7 307 1172 A R + 0 0 181 -2,-0.4 -1,-0.1 -3,-0.2 -3,-0.1 0.364 25.3 113.7-113.2 3.2 -12.1 8.2 46.4 308 1173 A H 0 0 133 1,-0.2 -1,-0.1 -182,-0.0 -183,-0.0 0.839 360.0 360.0 -44.8 -45.2 -10.7 6.5 49.5 309 1174 A H 0 0 185 -3,-0.2 -1,-0.2 0, 0.0 -2,-0.1 0.772 360.0 360.0 -95.6 360.0 -7.5 8.5 49.1