==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 11-DEC-00 1HOX . COMPND 2 MOLECULE: PHOSPHOGLUCOSE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; . AUTHOR C.J.JEFFREY,J.H.LEE,K.Z.CHANG,V.PATEL . 1110 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36242.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 825 74.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 78 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 2 0.2 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 . 72 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 143 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 434 39.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 27 2.4 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 5 0 4 6 3 3 3 1 0 7 3 0 0 0 2 2 4 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 4 4 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 PARALLEL BRIDGES PER LADDER . 12 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 1 A A 0 0 36 0, 0.0 369,-0.1 0, 0.0 367,-0.1 0.000 360.0 360.0 360.0 63.3 -4.5 27.1 25.3 2 2 A A + 0 0 33 501,-0.1 3,-0.2 4,-0.0 4,-0.2 0.168 360.0 52.1-166.2 -44.6 -4.7 26.6 21.5 3 3 A L S > S+ 0 0 0 501,-0.2 3,-1.7 1,-0.2 6,-0.2 0.912 103.2 59.7 -73.1 -43.4 -6.8 23.5 20.9 4 4 A T T 3 S+ 0 0 24 1,-0.3 -1,-0.2 5,-0.1 366,-0.0 0.686 111.3 41.9 -59.3 -19.4 -9.7 24.7 23.0 5 5 A R T 3 S+ 0 0 180 -3,-0.2 -1,-0.3 4,-0.1 -2,-0.2 0.365 85.7 116.9-109.1 2.1 -10.1 27.7 20.8 6 6 A N <> - 0 0 13 -3,-1.7 4,-2.4 -4,-0.2 5,-0.2 -0.560 67.4-133.6 -73.0 132.5 -9.6 25.9 17.5 7 7 A P H > S+ 0 0 79 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.905 105.9 46.4 -51.3 -50.0 -12.7 26.1 15.3 8 8 A Q H > S+ 0 0 64 2,-0.2 4,-2.2 1,-0.2 62,-0.2 0.850 109.8 54.5 -65.5 -35.1 -12.6 22.4 14.4 9 9 A F H > S+ 0 0 2 -6,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.953 111.3 43.7 -64.2 -49.1 -12.0 21.4 18.0 10 10 A Q H X S+ 0 0 90 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.911 112.2 52.4 -62.8 -43.6 -15.1 23.3 19.3 11 11 A K H X S+ 0 0 114 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.923 111.1 49.0 -57.5 -41.9 -17.2 22.0 16.4 12 12 A L H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.922 111.2 50.1 -62.4 -45.2 -16.0 18.6 17.4 13 13 A Q H X S+ 0 0 58 -4,-2.6 4,-2.1 1,-0.2 5,-0.2 0.923 109.1 49.8 -60.5 -48.5 -16.9 19.3 21.1 14 14 A Q H X S+ 0 0 107 -4,-3.0 4,-0.7 1,-0.2 -1,-0.2 0.905 108.5 53.1 -59.0 -43.0 -20.4 20.5 20.3 15 15 A W H >X>S+ 0 0 13 -4,-2.0 4,-3.1 -5,-0.2 3,-0.8 0.936 109.1 50.6 -57.8 -47.2 -21.2 17.5 18.2 16 16 A H H 3X>S+ 0 0 33 -4,-1.9 4,-1.3 1,-0.3 5,-0.5 0.927 107.9 48.3 -59.7 -51.1 -20.2 15.2 21.0 17 17 A R H 3<5S+ 0 0 160 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.635 120.2 43.0 -67.2 -8.1 -22.3 16.7 23.8 18 18 A E H <<5S+ 0 0 109 -3,-0.8 -2,-0.2 -4,-0.7 -1,-0.2 0.769 138.0 5.9-103.7 -34.3 -25.1 16.6 21.4 19 19 A H H >X5S+ 0 0 48 -4,-3.1 3,-3.8 -5,-0.2 4,-0.9 0.674 100.0 95.3-120.5 -33.3 -24.7 13.1 19.9 20 20 A G G ><> - 0 0 65 1,-0.1 4,-2.7 -2,-0.0 3,-0.6 -0.873 23.0-152.7-143.0 105.8 -24.0 2.6 20.0 25 25 A L H 3> S+ 0 0 0 -2,-0.3 4,-2.0 1,-0.3 5,-0.2 0.820 97.5 51.9 -42.8 -47.5 -21.6 0.2 18.3 26 26 A R H 3> S+ 0 0 68 410,-0.4 4,-2.3 1,-0.2 -1,-0.3 0.922 113.2 45.1 -61.1 -42.7 -24.1 -2.6 18.1 27 27 A H H <> S+ 0 0 114 -3,-0.6 4,-1.2 1,-0.2 -2,-0.2 0.899 110.0 56.1 -67.0 -39.8 -26.6 -0.3 16.4 28 28 A L H < S+ 0 0 23 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.837 113.0 39.7 -62.4 -35.6 -23.9 1.1 14.1 29 29 A F H >< S+ 0 0 13 -4,-2.0 3,-1.2 -5,-0.2 -1,-0.2 0.864 111.1 57.9 -81.2 -37.2 -23.1 -2.4 12.8 30 30 A D H 3< S+ 0 0 121 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.712 114.0 40.2 -63.3 -21.1 -26.7 -3.5 12.7 31 31 A T T 3< S+ 0 0 74 -4,-1.2 -1,-0.2 1,-0.2 2,-0.2 0.272 115.1 49.1-113.5 9.4 -27.5 -0.6 10.4 32 32 A D X - 0 0 39 -3,-1.2 3,-2.0 -5,-0.1 4,-0.3 -0.656 50.2-176.1-154.5 94.5 -24.4 -0.6 8.1 33 33 A K T 3 S+ 0 0 157 1,-0.3 4,-0.2 -2,-0.2 3,-0.2 0.609 89.8 55.2 -63.4 -14.7 -23.1 -3.8 6.4 34 34 A E T 3> S+ 0 0 92 1,-0.1 4,-2.4 2,-0.1 -1,-0.3 0.304 74.2 107.1-101.8 8.1 -20.2 -1.8 5.0 35 35 A R H <> S+ 0 0 4 -3,-2.0 4,-2.4 1,-0.2 -1,-0.1 0.925 80.0 46.6 -52.9 -53.5 -19.0 -0.5 8.4 36 36 A F H 4 S+ 0 0 26 -4,-0.3 -1,-0.2 1,-0.2 18,-0.2 0.942 112.9 51.3 -53.8 -49.9 -15.9 -2.7 8.6 37 37 A N H >4 S+ 0 0 88 -4,-0.2 3,-0.5 1,-0.2 -1,-0.2 0.872 115.4 41.4 -54.4 -42.3 -15.0 -1.9 5.0 38 38 A H H 3< S+ 0 0 101 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.743 117.2 45.4 -81.6 -25.8 -15.3 1.8 5.6 39 39 A F T 3< S+ 0 0 5 -4,-2.4 15,-1.2 -5,-0.2 2,-0.3 -0.314 102.5 67.5-116.4 50.9 -13.6 2.0 9.0 40 40 A S E < -A 53 0A 21 -3,-0.5 2,-0.4 13,-0.2 13,-0.2 -0.977 57.3-155.2-159.1 153.5 -10.5 -0.2 8.5 41 41 A L E -A 52 0A 16 11,-2.4 11,-2.9 -2,-0.3 2,-0.4 -0.999 5.9-150.4-140.4 135.9 -7.3 -0.1 6.5 42 42 A T E -A 51 0A 77 -2,-0.4 2,-0.5 9,-0.2 9,-0.2 -0.867 11.0-159.0-104.3 137.1 -5.0 -2.8 5.3 43 43 A L E -A 50 0A 17 7,-2.6 7,-2.4 -2,-0.4 2,-0.8 -0.964 6.1-163.6-121.2 120.3 -1.3 -2.2 4.8 44 44 A N E +A 49 0A 81 -2,-0.5 5,-0.2 5,-0.2 -2,-0.0 -0.897 11.8 174.2-102.4 109.6 0.9 -4.3 2.6 45 45 A T - 0 0 1 3,-2.1 -1,-0.1 -2,-0.8 4,-0.1 0.409 50.3-116.7 -92.1 -1.2 4.5 -3.6 3.5 46 46 A N S S+ 0 0 126 2,-0.2 3,-0.1 1,-0.1 -2,-0.1 0.324 112.5 66.7 79.3 -6.8 5.8 -6.3 1.1 47 47 A H S S- 0 0 103 1,-0.6 438,-0.2 251,-0.0 2,-0.1 -0.092 122.9 -36.4-131.3 30.2 7.1 -8.1 4.3 48 48 A G - 0 0 14 431,-0.1 -3,-2.1 436,-0.1 -1,-0.6 -0.392 67.2 -95.3 127.4 155.0 3.7 -8.8 5.8 49 49 A H E -A 44 0A 45 -5,-0.2 430,-1.9 -2,-0.1 2,-0.5 -0.764 23.6-158.7-104.2 150.3 0.3 -7.2 6.0 50 50 A I E -AB 43 478A 1 -7,-2.4 -7,-2.6 -2,-0.3 2,-0.6 -0.986 4.1-162.2-128.3 120.2 -1.1 -5.1 8.8 51 51 A L E -AB 42 477A 1 426,-3.6 426,-2.5 -2,-0.5 2,-0.8 -0.913 1.6-167.9-105.2 118.7 -4.8 -4.7 9.2 52 52 A L E -AB 41 476A 2 -11,-2.9 -11,-2.4 -2,-0.6 2,-0.8 -0.908 7.7-172.9-104.2 104.1 -5.9 -1.8 11.4 53 53 A D E +AB 40 475A 1 422,-3.0 422,-2.0 -2,-0.8 3,-0.3 -0.864 17.7 162.3-102.8 104.7 -9.6 -2.3 12.1 54 54 A Y > + 0 0 16 -15,-1.2 3,-0.7 -2,-0.8 -14,-0.2 -0.032 42.8 108.4-108.7 29.7 -11.0 0.7 13.9 55 55 A S T 3 + 0 0 0 1,-0.2 4,-0.2 420,-0.1 -1,-0.2 0.781 64.8 68.2 -77.6 -27.4 -14.6 -0.1 13.1 56 56 A K T 3 S+ 0 0 2 417,-0.4 417,-1.5 -3,-0.3 2,-0.3 0.047 82.7 107.4 -82.6 31.3 -15.5 -1.1 16.7 57 57 A N S < S- 0 0 2 -3,-0.7 2,-2.4 415,-0.2 414,-0.1 -0.780 86.0-107.1-106.0 152.2 -15.0 2.6 17.7 58 58 A L S S+ 0 0 2 -2,-0.3 2,-0.3 412,-0.1 -35,-0.1 -0.444 81.9 109.0 -77.9 71.4 -17.7 5.1 18.6 59 59 A V - 0 0 0 -2,-2.4 2,-0.3 -4,-0.2 -2,-0.1 -0.947 46.8-164.3-144.4 162.6 -17.4 7.0 15.4 60 60 A T > - 0 0 24 -2,-0.3 4,-3.0 1,-0.0 5,-0.3 -0.856 47.9 -91.4-137.6 169.0 -19.2 7.7 12.1 61 61 A E H > S+ 0 0 87 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.908 128.4 53.0 -50.7 -44.9 -17.9 9.3 8.8 62 62 A E H > S+ 0 0 99 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.939 110.8 45.0 -56.3 -50.6 -19.0 12.7 10.1 63 63 A V H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.922 115.5 47.1 -60.5 -45.8 -17.0 12.2 13.4 64 64 A M H X S+ 0 0 12 -4,-3.0 4,-2.2 2,-0.2 -1,-0.2 0.858 110.8 53.3 -64.0 -36.4 -14.0 10.9 11.4 65 65 A H H X S+ 0 0 121 -4,-3.0 4,-1.8 -5,-0.3 -2,-0.2 0.919 111.6 44.5 -64.3 -44.9 -14.4 13.8 9.0 66 66 A M H X S+ 0 0 16 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.888 111.8 53.6 -66.8 -39.3 -14.3 16.3 11.9 67 67 A L H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.892 110.1 47.0 -63.3 -39.8 -11.4 14.5 13.5 68 68 A L H X S+ 0 0 14 -4,-2.2 4,-2.2 2,-0.2 5,-0.3 0.856 107.7 55.7 -71.5 -33.4 -9.4 14.7 10.4 69 69 A D H X S+ 0 0 78 -4,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.904 107.5 50.7 -63.2 -39.7 -10.2 18.4 9.9 70 70 A L H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.909 106.6 55.5 -63.1 -41.9 -8.8 19.0 13.4 71 71 A A H <>S+ 0 0 0 -4,-1.7 5,-1.9 1,-0.2 3,-0.5 0.958 116.4 34.1 -56.1 -55.1 -5.7 17.1 12.4 72 72 A K H ><5S+ 0 0 96 -4,-2.2 3,-1.4 1,-0.2 -1,-0.2 0.828 113.6 61.7 -71.0 -29.3 -4.9 19.4 9.5 73 73 A S H 3<5S+ 0 0 41 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.775 104.9 48.4 -66.0 -26.2 -6.4 22.3 11.3 74 74 A R T 3<5S- 0 0 43 -4,-1.7 -1,-0.3 -3,-0.5 -2,-0.2 0.296 119.3-110.0 -97.3 8.5 -3.7 21.9 14.0 75 75 A G T <>5 + 0 0 30 -3,-1.4 4,-2.8 -5,-0.1 5,-0.2 0.789 60.2 156.1 70.9 31.5 -0.9 21.6 11.4 76 76 A V H > S+ 0 0 74 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.922 111.8 45.4 -62.0 -48.1 1.4 17.8 8.3 78 78 A A H > S+ 0 0 66 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.935 114.4 51.1 -61.8 -43.0 3.6 20.8 8.6 79 79 A A H X S+ 0 0 25 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.934 108.4 51.6 -57.8 -47.2 4.8 19.6 12.0 80 80 A R H X S+ 0 0 21 -4,-2.9 4,-2.2 -5,-0.2 5,-0.2 0.941 109.4 49.8 -54.7 -50.9 5.5 16.2 10.5 81 81 A E H X S+ 0 0 55 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.892 106.7 55.4 -57.5 -42.4 7.7 17.8 7.8 82 82 A S H <>S+ 0 0 25 -4,-2.4 5,-2.4 2,-0.2 4,-0.4 0.916 108.3 48.6 -58.8 -43.3 9.6 19.8 10.3 83 83 A M H ><5S+ 0 0 0 -4,-2.0 3,-2.0 1,-0.2 14,-0.2 0.990 115.9 41.5 -59.8 -60.3 10.6 16.7 12.2 84 84 A F H 3<5S+ 0 0 15 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.846 109.8 59.7 -56.1 -37.2 11.7 14.7 9.2 85 85 A N T 3<5S- 0 0 83 -4,-2.9 26,-0.3 -5,-0.2 -1,-0.3 0.550 117.6-111.7 -70.4 -7.5 13.4 17.8 7.7 86 86 A G T < 5 + 0 0 6 -3,-2.0 27,-0.3 -4,-0.4 -3,-0.2 0.641 60.7 157.0 87.5 14.8 15.6 18.0 10.8 87 87 A E < - 0 0 95 -5,-2.4 2,-2.4 -6,-0.2 10,-0.7 -0.406 55.9-105.2 -72.0 149.9 14.2 21.3 12.3 88 88 A K + 0 0 68 1,-0.2 8,-0.3 8,-0.2 7,-0.2 -0.336 56.2 156.2 -74.9 64.1 14.7 21.8 16.0 89 89 A I + 0 0 28 -2,-2.4 2,-2.1 1,-0.2 -1,-0.2 0.641 54.0 86.8 -66.1 -13.7 11.1 21.0 17.0 90 90 A N B >>> +F 95 0B 5 5,-2.6 5,-2.4 1,-0.2 4,-0.6 -0.632 64.4 174.4 -84.7 79.3 12.2 20.1 20.5 91 91 A S G >45 + 0 0 39 -2,-2.1 3,-0.6 3,-0.2 -1,-0.2 0.865 64.2 56.7 -58.2 -47.2 11.9 23.8 21.4 92 92 A T G 345S+ 0 0 3 1,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.787 123.5 27.9 -61.3 -26.2 12.6 23.8 25.2 93 93 A E G <45S- 0 0 38 -3,-0.6 -1,-0.3 2,-0.1 -2,-0.2 0.362 105.5-126.8-112.6 1.5 15.9 22.1 24.5 94 94 A D T <<5 + 0 0 100 -4,-0.6 2,-0.3 -3,-0.6 -3,-0.2 0.948 61.6 140.2 49.8 56.5 16.4 23.6 21.0 95 95 A R B < -F 90 0B 67 -5,-2.4 -5,-2.6 -7,-0.2 -1,-0.2 -0.913 54.3-118.3-129.2 156.0 17.0 20.2 19.5 96 96 A A - 0 0 2 -2,-0.3 2,-0.5 -8,-0.3 -8,-0.2 -0.464 22.4-135.7 -83.6 162.2 16.1 18.3 16.4 97 97 A V + 0 0 5 -10,-0.7 3,-0.3 -14,-0.2 -11,-0.2 -0.851 39.4 154.8-122.5 92.2 14.0 15.1 16.7 98 98 A L >> + 0 0 0 170,-2.0 4,-0.9 -2,-0.5 3,-0.8 -0.287 22.3 126.7-120.9 52.9 15.5 12.6 14.4 99 99 A H H 3> S+ 0 0 2 1,-0.2 4,-0.8 2,-0.2 3,-0.2 0.795 80.0 64.5 -72.0 -22.1 14.8 9.0 15.4 100 100 A V H 34 S+ 0 0 5 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.730 95.6 57.8 -69.6 -19.6 13.6 8.7 11.8 101 101 A A H X4 S+ 0 0 0 -3,-0.8 3,-1.6 1,-0.2 -1,-0.2 0.863 94.8 64.3 -75.3 -37.6 17.2 9.4 10.7 102 102 A L H 3< S+ 0 0 6 -4,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.809 115.2 30.2 -54.3 -35.6 18.4 6.4 12.7 103 103 A R T 3< S+ 0 0 0 -4,-0.8 2,-2.4 -3,-0.1 -1,-0.3 0.112 79.7 134.3-112.9 18.6 16.4 4.1 10.5 104 104 A N X + 0 0 11 -3,-1.6 3,-1.7 1,-0.2 193,-0.1 -0.461 26.4 173.7 -70.6 78.0 16.5 6.2 7.3 105 105 A R T 3 S+ 0 0 82 -2,-2.4 -1,-0.2 1,-0.3 192,-0.1 0.730 71.9 61.1 -60.8 -26.7 17.4 3.2 5.0 106 106 A S T 3 S- 0 0 61 -3,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.587 98.5-139.8 -78.8 -7.9 17.1 5.2 1.8 107 107 A N < + 0 0 75 -3,-1.7 -2,-0.1 1,-0.2 3,-0.1 0.662 36.2 169.7 57.8 20.6 19.9 7.4 3.1 108 108 A T - 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0 0 94 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.342 25.3-133.7 -67.9 144.8 16.9 12.5 63.4 534 534 A V + 0 0 14 8,-0.3 12,-0.2 1,-0.1 11,-0.1 -0.817 32.6 161.7-100.9 140.5 16.1 14.7 60.4 535 535 A T + 0 0 111 -2,-0.4 -1,-0.1 11,-0.0 7,-0.1 0.197 47.5 100.3-140.9 11.2 13.8 17.7 60.9 536 536 A S S S+ 0 0 81 5,-0.1 2,-0.2 6,-0.1 3,-0.1 0.502 79.1 52.3 -80.8 -6.2 14.6 19.8 57.8 537 537 A H S S- 0 0 28 1,-0.2 452,-0.0 2,-0.1 0, 0.0 -0.486 104.0 -59.3-116.9-171.2 11.6 18.6 55.7 538 538 A D > - 0 0 19 -2,-0.2 4,-2.5 1,-0.1 -1,-0.2 -0.259 61.9-100.7 -63.1 159.8 7.8 18.4 56.1 539 539 A S H > S+ 0 0 13 1,-0.2 4,-3.2 46,-0.2 5,-0.1 0.814 121.2 54.0 -57.2 -31.0 6.7 16.2 59.0 540 540 A S H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.951 110.7 42.5 -69.0 -50.5 6.0 13.3 56.7 541 541 A T H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.911 119.2 47.1 -61.8 -40.8 9.4 13.2 55.0 542 542 A N H X S+ 0 0 13 -4,-2.5 4,-2.9 2,-0.2 -8,-0.3 0.956 113.3 47.8 -63.1 -52.1 11.0 13.7 58.4 543 543 A G H X S+ 0 0 9 -4,-3.2 4,-1.6 -5,-0.2 -2,-0.2 0.872 112.5 49.0 -57.0 -40.9 8.8 11.0 59.9 544 544 A L H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 -1,-0.2 0.911 112.3 47.9 -66.6 -43.6 9.6 8.6 57.1 545 545 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.908 112.8 48.1 -64.2 -42.6 13.3 9.2 57.4 546 546 A N H X S+ 0 0 47 -4,-2.9 4,-2.0 2,-0.2 -1,-0.2 0.817 109.4 52.6 -70.2 -28.1 13.3 8.8 61.1 547 547 A F H X S+ 0 0 15 -4,-1.6 4,-2.5 -5,-0.2 -1,-0.2 0.908 110.5 49.6 -70.5 -40.0 11.3 5.6 60.9 548 548 A I H X S+ 0 0 1 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.918 110.5 48.4 -63.0 -45.8 13.9 4.3 58.4 549 549 A K H < S+ 0 0 11 -4,-2.4 4,-0.4 1,-0.2 -1,-0.2 0.893 113.1 49.2 -63.3 -39.5 16.8 5.2 60.7 550 550 A Q H < S+ 0 0 110 -4,-2.0 3,-0.5 1,-0.2 -2,-0.2 0.913 118.1 37.5 -65.9 -44.3 15.1 3.5 63.6 551 551 A Q H >< S+ 0 0 9 -4,-2.5 3,-1.4 1,-0.2 -1,-0.2 0.615 90.9 93.6 -84.5 -13.4 14.3 0.3 61.7 552 552 A R T 3< S+ 0 0 97 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.810 101.8 24.1 -47.8 -39.8 17.6 0.2 59.8 553 553 A E T 3 S+ 0 0 130 -3,-0.5 -1,-0.3 -4,-0.4 -2,-0.1 0.239 89.4 130.3-114.6 13.4 19.2 -2.0 62.4 554 554 A A < 0 0 25 -3,-1.4 -3,-0.1 1,-0.1 412,-0.0 -0.448 360.0 360.0 -66.3 139.7 16.2 -3.6 64.0 555 555 A K 0 0 153 -2,-0.1 49,-0.1 49,-0.0 -1,-0.1 -0.791 360.0 360.0 -91.9 360.0 16.6 -7.4 64.1 556 !* 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 0.0 557 1 B A > 0 0 38 0, 0.0 4,-0.7 0, 0.0 504,-0.1 0.000 360.0 360.0 360.0 125.3 -28.1 2.3 44.8 558 2 B A H >> + 0 0 38 1,-0.2 4,-1.3 2,-0.2 3,-1.0 0.914 360.0 56.7 -56.7 -50.7 -27.3 2.4 48.5 559 3 B L H >4 S+ 0 0 0 1,-0.2 3,-1.0 501,-0.2 6,-0.2 0.915 105.0 47.0 -51.5 -57.1 -24.2 4.6 48.4 560 4 B T H 34 S+ 0 0 13 1,-0.3 -1,-0.2 500,-0.1 -2,-0.2 0.670 113.8 51.3 -62.8 -15.8 -25.6 7.7 46.7 561 5 B R H << S+ 0 0 171 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.671 85.2 107.0 -92.3 -21.7 -28.6 7.6 49.0 562 6 B N S+ 0 0 81 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.819 99.9 55.4 -67.8 -32.2 -26.6 10.7 54.2 564 8 B Q H > S+ 0 0 59 2,-0.2 4,-1.8 1,-0.2 62,-0.2 0.884 109.6 48.3 -67.2 -36.9 -22.9 10.3 55.2 565 9 B F H > S+ 0 0 1 -6,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.938 111.3 48.5 -67.6 -48.0 -21.9 10.1 51.6 566 10 B Q H X S+ 0 0 85 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.919 110.6 51.1 -59.2 -44.8 -24.0 13.1 50.5 567 11 B K H X S+ 0 0 119 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.904 110.8 50.0 -58.7 -40.7 -22.5 15.1 53.4 568 12 B L H X S+ 0 0 0 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.928 110.5 51.2 -62.4 -45.0 -19.1 14.0 52.1 569 13 B Q H X S+ 0 0 57 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.911 110.1 45.3 -60.4 -48.6 -20.1 15.1 48.6 570 14 B Q H X S+ 0 0 112 -4,-2.6 4,-1.0 1,-0.2 -1,-0.2 0.859 110.5 54.9 -67.4 -33.9 -21.2 18.6 49.4 571 15 B W H ><>S+ 0 0 32 -4,-1.8 5,-0.8 -5,-0.3 3,-0.7 0.927 108.7 49.8 -62.7 -43.6 -18.2 19.2 51.6 572 16 B H H ><>S+ 0 0 33 -4,-2.0 3,-0.9 1,-0.2 5,-0.7 0.894 108.1 52.0 -62.1 -41.9 -16.0 18.3 48.6 573 17 B R H 3<5S+ 0 0 175 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.678 118.7 37.0 -70.4 -16.3 -17.8 20.6 46.2 574 18 B E T <<5S+ 0 0 130 -4,-1.0 -1,-0.2 -3,-0.7 -2,-0.2 0.247 138.3 6.1-119.5 11.9 -17.4 23.5 48.6 575 19 B H T X>5S+ 0 0 89 -3,-0.9 3,-3.3 -4,-0.4 4,-0.5 0.330 101.6 83.1-152.5 -57.2 -13.9 22.8 50.0 576 20 B G G >4 - 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0 0 12 -4,-1.8 4,-1.4 -5,-0.4 -1,-0.2 0.101 33.1 -85.9 88.2 154.1 9.9 -24.4 52.0 845 289 B F H > S+ 0 0 13 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.768 123.1 60.2 -69.9 -26.9 6.9 -25.0 54.1 846 290 B D H > S+ 0 0 111 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.915 108.3 44.6 -66.1 -42.6 8.2 -23.0 57.2 847 291 B N H > S+ 0 0 43 -4,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.827 111.3 54.4 -69.6 -31.8 8.4 -19.9 55.1 848 292 B F H X S+ 0 0 0 -4,-1.4 4,-2.4 1,-0.2 -2,-0.2 0.896 106.9 50.5 -68.3 -39.9 5.0 -20.6 53.6 849 293 B E H X S+ 0 0 46 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.798 107.5 54.4 -67.8 -26.9 3.5 -20.9 57.1 850 294 B Q H X S+ 0 0 73 -4,-1.2 4,-2.7 2,-0.2 -1,-0.2 0.904 106.4 52.1 -70.1 -39.8 5.2 -17.5 57.8 851 295 B L H X S+ 0 0 0 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.955 111.7 45.4 -58.3 -51.8 3.3 -16.1 54.8 852 296 B L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.903 111.9 53.1 -58.9 -43.0 0.0 -17.5 56.1 853 297 B S H X S+ 0 0 28 -4,-2.4 4,-3.1 1,-0.2 -1,-0.2 0.904 105.2 53.5 -60.6 -43.6 0.9 -16.1 59.6 854 298 B G H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.907 111.6 45.7 -58.2 -42.3 1.5 -12.6 58.3 855 299 B A H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.905 111.4 53.0 -67.0 -40.4 -1.9 -12.6 56.6 856 300 B H H X S+ 0 0 23 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.911 107.5 52.0 -60.6 -42.4 -3.4 -14.0 59.8 857 301 B W H X S+ 0 0 62 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.954 111.6 46.0 -58.5 -50.1 -1.8 -11.1 61.7 858 302 B M H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.883 108.6 56.3 -60.8 -39.4 -3.3 -8.6 59.3 859 303 B D H X S+ 0 0 2 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.890 108.6 48.0 -59.7 -39.9 -6.7 -10.3 59.5 860 304 B Q H X S+ 0 0 79 -4,-2.1 4,-2.6 2,-0.2 5,-0.3 0.899 110.3 51.3 -67.3 -41.7 -6.6 -9.9 63.3 861 305 B H H X S+ 0 0 17 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.963 112.5 46.2 -58.6 -51.2 -5.7 -6.2 62.9 862 306 B F H < S+ 0 0 0 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.883 116.6 45.7 -58.8 -40.6 -8.6 -5.7 60.5 863 307 B R H < S+ 0 0 67 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.845 122.5 29.6 -75.4 -35.3 -11.0 -7.6 62.7 864 308 B T H < S+ 0 0 104 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.528 94.5 98.9-104.8 -7.3 -10.2 -6.1 66.1 865 309 B T S < S- 0 0 27 -4,-1.9 5,-0.1 -5,-0.3 -4,-0.0 -0.678 77.4-111.6 -90.7 133.3 -9.0 -2.5 65.4 866 310 B P > - 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