==== 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 GLYCOGEN PHOSPHORYLASE 04-JUN-90 5GPB . COMPND 2 MOLECULE: GLYCOGEN PHOSPHORYLASE B; . SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; . AUTHOR J.L.MARTIN,L.N.JOHNSON . 833 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31904.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 626 75.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 58 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 2 0.2 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 . 59 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 108 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 320 38.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.2 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 1 2 4 3 3 3 4 1 0 0 2 0 3 0 0 0 1 0 0 1 1 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 2 3 1 3 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 PARALLEL BRIDGES PER LADDER . 1 2 1 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 1 0 0 1 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 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 10 A R 0 0 162 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -25.2 -3.3 22.1 28.4 2 11 A K + 0 0 180 2,-0.0 2,-0.2 0, 0.0 0, 0.0 -0.806 360.0 176.5 171.4 160.4 -3.5 18.3 29.0 3 12 A Q + 0 0 80 -2,-0.2 486,-0.0 2,-0.1 0, 0.0 -0.816 25.9 157.0 179.5 149.6 -1.5 15.1 29.3 4 13 A I > + 0 0 143 -2,-0.2 3,-0.6 0, 0.0 -1,-0.0 0.332 39.1 151.9-131.7 -59.8 -1.6 11.3 30.1 5 14 A S T 3 - 0 0 25 1,-0.2 2,-0.3 2,-0.1 484,-0.1 0.175 64.2 -72.7 51.1-177.3 1.7 10.1 28.2 6 15 A V T 3 S+ 0 0 66 482,-0.2 -1,-0.2 1,-0.1 3,-0.1 -0.499 70.7 143.2-114.7 75.3 3.7 7.1 29.3 7 16 A R S < S- 0 0 17 -3,-0.6 90,-2.2 1,-0.5 91,-0.3 -0.021 77.5 -91.8 -92.7 38.1 5.2 8.5 32.3 8 17 A G - 0 0 17 88,-0.2 -1,-0.5 89,-0.1 2,-0.2 -0.293 66.9 -33.1 73.7-173.1 4.7 4.9 33.5 9 18 A L - 0 0 149 85,-0.3 2,-0.6 -3,-0.1 89,-0.4 -0.571 31.6-158.6 -83.5 140.8 1.8 3.4 35.4 10 19 A A - 0 0 43 -2,-0.2 2,-0.4 87,-0.2 85,-0.1 -0.718 35.2-177.5-116.0 70.4 -0.5 5.1 37.9 11 20 A G >> - 0 0 36 -2,-0.6 4,-1.4 1,-0.1 3,-1.0 -0.693 34.2-108.7 -86.8 131.1 -1.7 1.7 39.4 12 21 A V H 3> S+ 0 0 113 -2,-0.4 4,-1.3 1,-0.2 5,-0.1 0.494 109.7 39.3 -13.2 -70.7 -4.3 1.4 42.2 13 22 A E H 3> S+ 0 0 149 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.913 116.8 50.2 -57.3 -47.7 -2.2 0.3 45.4 14 23 A N H <> S+ 0 0 68 -3,-1.0 4,-2.4 2,-0.2 -2,-0.2 0.871 106.1 51.7 -67.7 -36.2 0.8 2.6 44.6 15 24 A V H X S+ 0 0 7 -4,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.945 115.5 47.0 -61.9 -39.1 -1.2 5.9 44.1 16 25 A T H X S+ 0 0 76 -4,-1.3 4,-1.8 -5,-0.2 -2,-0.2 0.917 110.0 50.3 -63.7 -49.3 -2.8 5.0 47.5 17 26 A E H X S+ 0 0 77 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.940 111.5 52.1 -54.4 -46.3 0.6 4.2 49.1 18 27 A L H X S+ 0 0 2 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.956 105.8 49.5 -59.3 -55.4 1.9 7.6 47.8 19 28 A K H X S+ 0 0 49 -4,-2.4 4,-2.4 1,-0.3 -1,-0.2 0.870 111.0 51.5 -57.0 -36.8 -0.8 9.9 49.1 20 29 A K H X S+ 0 0 106 -4,-1.8 4,-1.9 1,-0.2 -1,-0.3 0.935 111.2 46.7 -64.8 -45.2 -0.5 8.4 52.5 21 30 A N H X S+ 0 0 21 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.756 109.6 55.5 -71.8 -21.2 3.2 8.9 52.6 22 31 A F H X S+ 0 0 3 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.951 109.9 44.7 -69.5 -54.1 2.8 12.4 51.3 23 32 A N H X S+ 0 0 58 -4,-2.4 4,-0.9 1,-0.2 -2,-0.2 0.788 110.1 57.7 -62.3 -29.8 0.5 13.3 54.2 24 33 A R H X>S+ 0 0 97 -4,-1.9 4,-2.6 2,-0.2 5,-0.6 0.949 109.3 43.1 -63.4 -53.7 2.9 11.5 56.6 25 34 A H H X>S+ 0 0 9 -4,-1.8 5,-2.6 1,-0.2 4,-0.8 0.854 107.5 58.6 -66.6 -35.2 5.9 13.7 55.6 26 35 A L H <5S+ 0 0 5 -4,-2.0 6,-2.3 3,-0.2 -1,-0.2 0.862 119.7 31.3 -62.9 -25.5 3.9 16.9 55.6 27 36 A H H X5S+ 0 0 108 -4,-0.9 4,-0.9 -3,-0.5 -2,-0.2 0.954 131.0 27.7 -96.3 -61.5 3.0 16.2 59.3 28 37 A F H <5S+ 0 0 145 -4,-2.6 -3,-0.2 2,-0.2 -2,-0.1 0.855 134.0 31.0 -73.7 -39.7 5.9 14.3 60.8 29 38 A T T <> - 0 0 74 -2,-0.3 3,-2.7 -3,-0.1 4,-1.3 -0.898 31.9 -98.3-123.0 162.6 -0.8 20.9 58.5 34 43 A R T 34 S+ 0 0 90 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.700 119.7 54.3 -47.8 -35.0 -3.1 21.1 55.6 35 44 A N T 34 S+ 0 0 152 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.611 121.6 29.1 -79.9 -15.6 -4.5 24.6 56.6 36 45 A V T <4 S+ 0 0 87 -3,-2.7 2,-0.5 2,-0.1 -2,-0.2 0.351 88.3 111.0-121.8 -3.6 -1.0 26.1 56.8 37 46 A A < - 0 0 12 -4,-1.3 -11,-0.0 -3,-0.1 -5,-0.0 -0.693 51.4-156.0 -80.2 122.7 1.2 24.2 54.3 38 47 A T >> - 0 0 65 -2,-0.5 4,-2.4 1,-0.1 3,-0.9 -0.437 38.1 -89.0 -83.6 172.3 2.3 26.3 51.3 39 48 A P H 3> S+ 0 0 57 0, 0.0 4,-2.5 0, 0.0 77,-0.1 0.782 129.5 56.5 -55.9 -25.3 3.3 25.0 47.8 40 49 A R H 3> S+ 0 0 87 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.915 106.8 47.6 -73.0 -34.3 6.9 24.8 49.1 41 50 A D H <> S+ 0 0 11 -3,-0.9 4,-2.1 2,-0.2 -1,-0.2 0.925 111.8 50.6 -72.6 -40.4 5.8 22.5 51.9 42 51 A Y H X S+ 0 0 23 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.916 107.9 54.2 -62.5 -40.6 3.9 20.5 49.4 43 52 A Y H X S+ 0 0 6 -4,-2.5 4,-2.9 -5,-0.2 5,-0.2 0.916 109.4 46.5 -55.6 -46.6 7.0 20.3 47.3 44 53 A F H X S+ 0 0 25 -4,-2.2 4,-3.3 2,-0.2 -2,-0.2 0.906 108.3 54.8 -70.5 -34.4 9.1 18.9 50.2 45 54 A A H X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.929 115.5 39.9 -61.4 -45.4 6.5 16.3 51.3 46 55 A L H X S+ 0 0 4 -4,-1.8 4,-2.9 2,-0.2 5,-0.2 0.929 114.8 51.5 -69.3 -47.2 6.5 14.9 47.7 47 56 A A H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.970 114.0 47.2 -48.8 -45.9 10.4 15.3 47.4 48 57 A H H X S+ 0 0 38 -4,-3.3 4,-0.7 -5,-0.2 -1,-0.2 0.822 112.6 47.1 -69.0 -30.4 10.5 13.3 50.6 49 58 A T H X S+ 0 0 0 -4,-1.5 4,-1.0 2,-0.2 -1,-0.2 0.805 111.6 50.5 -79.1 -33.4 8.1 10.7 49.4 50 59 A V H >< S+ 0 0 0 -4,-2.9 3,-0.6 1,-0.2 -2,-0.2 0.927 109.4 51.0 -74.0 -39.2 9.9 10.2 46.1 51 60 A R H >X S+ 0 0 39 -4,-2.7 3,-1.3 -5,-0.2 4,-1.1 0.773 98.8 67.2 -72.0 -16.3 13.3 9.8 47.9 52 61 A D H 3X S+ 0 0 53 -4,-0.7 4,-0.7 1,-0.2 3,-0.5 0.937 96.7 54.1 -60.5 -36.4 11.6 7.2 50.1 53 62 A H H << S+ 0 0 41 -4,-1.0 4,-0.3 -3,-0.6 -1,-0.2 0.517 109.5 51.3 -77.1 8.5 11.4 4.9 46.9 54 63 A L H <> S+ 0 0 2 -3,-1.3 4,-2.5 -4,-0.2 -1,-0.2 0.654 88.4 69.9-119.7 -32.6 15.1 5.3 46.4 55 64 A V H X S+ 0 0 48 -4,-1.1 4,-2.5 -3,-0.5 5,-0.3 0.924 97.0 56.8 -64.6 -34.9 16.9 4.5 49.6 56 65 A G H X S+ 0 0 34 -4,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.960 112.5 39.9 -56.4 -54.6 16.0 0.7 49.3 57 66 A R H > S+ 0 0 31 -4,-0.3 4,-3.4 1,-0.2 172,-0.3 0.912 114.6 54.4 -59.9 -43.9 17.6 0.5 45.9 58 67 A W H X S+ 0 0 14 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.892 110.5 45.0 -57.5 -44.4 20.6 2.7 47.0 59 68 A I H X S+ 0 0 118 -4,-2.5 4,-2.3 2,-0.2 5,-0.3 0.932 117.1 44.3 -70.9 -43.1 21.5 0.6 50.0 60 69 A R H X S+ 0 0 53 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.899 110.7 53.8 -72.8 -35.1 21.1 -2.6 48.1 61 70 A T H X S+ 0 0 0 -4,-3.4 4,-1.7 1,-0.2 -2,-0.2 0.962 113.8 44.8 -59.4 -48.8 23.1 -1.3 45.0 62 71 A Q H X S+ 0 0 48 -4,-2.5 4,-1.1 -5,-0.2 -2,-0.2 0.846 114.1 45.3 -69.2 -35.0 26.0 -0.3 47.5 63 72 A Q H X S+ 0 0 97 -4,-2.3 4,-2.3 2,-0.2 3,-0.3 0.915 110.0 59.9 -71.3 -33.3 26.0 -3.6 49.5 64 73 A H H X S+ 0 0 58 -4,-2.4 4,-2.7 1,-0.3 5,-0.4 0.891 102.6 48.7 -53.6 -50.5 25.8 -5.4 46.1 65 74 A Y H X S+ 0 0 12 -4,-1.7 4,-2.3 2,-0.2 -1,-0.3 0.856 108.1 55.9 -64.4 -32.4 29.1 -3.8 44.9 66 75 A Y H < S+ 0 0 128 -4,-1.1 -2,-0.2 -3,-0.3 -1,-0.2 0.947 111.6 43.8 -62.2 -46.6 30.7 -4.8 48.2 67 76 A E H < S+ 0 0 116 -4,-2.3 -2,-0.2 1,-0.1 -1,-0.2 0.937 128.9 25.4 -62.6 -53.6 29.7 -8.4 47.6 68 77 A K H < S- 0 0 137 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.934 90.6-161.7 -79.8 -40.4 30.7 -8.6 43.9 69 78 A D < - 0 0 7 -4,-2.3 -3,-0.1 -5,-0.4 -4,-0.1 0.999 12.2-173.1 51.4 78.6 33.3 -5.8 44.1 70 79 A P - 0 0 47 0, 0.0 2,-0.3 0, 0.0 748,-0.0 -0.042 42.1 -71.4 -74.9 179.7 33.9 -4.7 40.5 71 80 A K - 0 0 43 746,-0.1 73,-0.4 253,-0.1 2,-0.4 -0.656 60.7-136.3 -70.0 141.0 36.4 -2.3 39.3 72 81 A R E -a 324 0A 17 251,-2.1 253,-2.3 -2,-0.3 2,-0.5 -0.933 7.0-143.1-116.3 134.9 35.1 1.0 40.6 73 82 A I E -ab 325 145A 1 71,-2.5 73,-2.8 -2,-0.4 2,-0.6 -0.899 11.5-165.9-100.9 123.4 35.0 4.2 38.5 74 83 A Y E -ab 326 146A 5 251,-2.8 253,-2.8 -2,-0.5 2,-0.9 -0.939 3.0-162.7-112.7 114.1 35.7 7.4 40.4 75 84 A Y E -ab 327 147A 0 71,-2.8 73,-3.0 -2,-0.6 2,-0.6 -0.846 7.7-166.2-103.7 104.5 34.8 10.5 38.4 76 85 A L E +ab 328 148A 0 251,-1.7 253,-2.4 -2,-0.9 2,-0.3 -0.765 21.5 151.3 -90.5 120.2 36.5 13.4 39.9 77 86 A S - 0 0 1 71,-2.1 73,-0.2 -2,-0.6 253,-0.1 -0.996 44.5-144.6-147.6 145.8 35.2 16.8 38.8 78 87 A L S S+ 0 0 2 251,-0.4 2,-0.3 -2,-0.3 72,-0.3 0.628 90.5 48.4 -87.5 -3.6 35.1 20.1 40.4 79 88 A E + 0 0 11 250,-0.1 44,-0.3 70,-0.1 2,-0.2 -0.944 53.1 175.0-133.3 146.1 31.7 20.9 38.8 80 89 A F - 0 0 4 42,-2.6 2,-1.2 -2,-0.3 42,-0.4 -0.823 14.2-162.1-147.9 102.4 28.6 18.8 38.6 81 90 A Y + 0 0 12 47,-2.3 40,-0.1 -2,-0.2 42,-0.1 -0.673 24.0 160.6 -99.1 84.2 25.6 20.8 37.0 82 91 A M - 0 0 27 -2,-1.2 -1,-0.2 38,-0.6 2,-0.2 0.685 22.1-164.2 -80.2 -26.0 22.6 18.7 38.2 83 92 A G B -J 120 0B 0 37,-1.3 37,-2.8 2,-0.0 2,-0.3 -0.526 56.7 -18.2 69.0-143.1 19.7 21.1 37.7 84 93 A R - 0 0 24 35,-0.2 4,-0.2 -2,-0.2 35,-0.1 -0.729 54.3-158.3-101.3 162.7 16.7 19.8 39.7 85 94 A T > + 0 0 24 -2,-0.3 4,-1.8 3,-0.1 5,-0.2 0.594 67.3 78.4-113.1 -17.2 16.1 16.2 40.9 86 95 A L H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 3,-0.4 0.991 101.5 35.9 -65.7 -58.2 12.4 15.4 41.6 87 96 A Q H > S+ 0 0 31 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.932 116.5 55.4 -62.6 -42.3 11.1 14.8 38.0 88 97 A N H > S+ 0 0 17 1,-0.2 4,-2.1 -4,-0.2 -1,-0.2 0.883 110.1 45.8 -56.1 -37.9 14.4 13.1 37.0 89 98 A T H X S+ 0 0 1 -4,-1.8 4,-1.3 -3,-0.4 -1,-0.2 0.873 111.6 52.4 -73.7 -35.6 14.1 10.7 39.9 90 99 A M H X>S+ 0 0 0 -4,-2.4 5,-2.3 -5,-0.2 6,-1.1 0.891 110.0 49.8 -64.0 -39.1 10.4 10.1 39.0 91 100 A V H ><5S+ 0 0 2 -4,-2.5 3,-0.7 1,-0.2 -2,-0.2 0.956 112.3 45.8 -63.0 -52.4 11.4 9.3 35.4 92 101 A N H 3<5S+ 0 0 3 -4,-2.1 133,-1.5 1,-0.3 135,-0.3 0.695 119.0 40.8 -71.4 -17.6 14.1 6.8 36.4 93 102 A L H 3<5S- 0 0 18 -4,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.562 109.1-119.7-100.8 -10.2 11.9 5.1 38.9 94 103 A A T <<5S+ 0 0 33 -4,-1.1 -85,-0.3 -3,-0.7 4,-0.2 0.748 78.8 120.7 73.0 32.6 8.7 5.1 36.7 95 104 A L >< + 0 0 14 -5,-2.3 4,-2.6 -6,-0.2 5,-0.3 0.426 33.3 103.7-102.7 -6.5 6.8 7.1 39.3 96 105 A E H > S+ 0 0 4 -6,-1.1 4,-0.7 1,-0.2 -88,-0.2 0.887 89.6 34.4 -44.3 -49.0 6.0 10.1 37.1 97 106 A N H > S+ 0 0 26 -90,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.778 114.4 53.8 -86.4 -27.9 2.4 9.2 36.6 98 107 A A H > S+ 0 0 4 -89,-0.4 4,-3.1 -91,-0.3 5,-0.2 0.974 114.2 44.5 -71.9 -44.8 1.5 7.5 39.9 99 108 A C H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.701 111.7 54.4 -69.8 -20.3 2.7 10.7 41.7 100 109 A D H X S+ 0 0 38 -4,-0.7 4,-1.7 -5,-0.3 -1,-0.2 0.906 114.6 39.6 -75.0 -41.5 0.8 12.8 39.0 101 110 A E H >X S+ 0 0 68 -4,-2.3 4,-2.9 2,-0.2 3,-0.8 0.996 115.6 52.1 -64.7 -60.8 -2.4 10.9 39.8 102 111 A A H 3< S+ 0 0 3 -4,-3.1 -2,-0.2 1,-0.3 -3,-0.2 0.825 114.4 43.0 -37.2 -48.2 -1.6 10.9 43.6 103 112 A T H ><>S+ 0 0 2 -4,-1.5 5,-3.0 -5,-0.2 3,-0.6 0.794 111.6 54.3 -73.7 -32.7 -1.1 14.7 43.5 104 113 A Y H X<5S+ 0 0 168 -4,-1.7 3,-2.7 -3,-0.8 2,-2.1 0.988 107.8 50.3 -64.7 -56.6 -4.2 15.2 41.3 105 114 A Q T 3<5S+ 0 0 81 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.1 -0.316 109.8 50.3 -81.3 59.7 -6.3 13.3 43.9 106 115 A L T < 5S- 0 0 39 -2,-2.1 -1,-0.3 -3,-0.6 -2,-0.2 0.037 121.0-110.9-175.5 -8.5 -5.0 15.4 46.7 107 116 A G T < 5S+ 0 0 67 -3,-2.7 2,-0.2 1,-0.2 -3,-0.2 0.622 77.1 114.8 83.2 21.1 -5.8 18.5 44.7 108 117 A L < - 0 0 27 -5,-3.0 2,-0.6 -6,-0.1 -1,-0.2 -0.709 62.0-121.4-113.7 166.3 -2.3 19.8 43.8 109 118 A D > - 0 0 68 -2,-0.2 4,-1.6 1,-0.2 3,-0.4 -0.942 9.5-151.7-111.5 126.7 -0.5 20.2 40.5 110 119 A M H >> S+ 0 0 1 -2,-0.6 4,-2.8 1,-0.2 3,-0.8 0.961 96.4 57.7 -53.5 -50.0 2.8 18.4 40.1 111 120 A E H 3> S+ 0 0 72 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.763 105.1 51.0 -60.2 -31.2 4.1 20.9 37.7 112 121 A E H 34 S+ 0 0 97 -3,-0.4 4,-0.3 2,-0.2 -1,-0.3 0.854 114.8 43.6 -62.1 -46.3 3.6 23.8 40.3 113 122 A L H XX S+ 0 0 0 -4,-1.6 3,-1.6 -3,-0.8 4,-0.7 0.917 109.7 56.3 -67.8 -43.2 5.5 21.8 42.9 114 123 A E H >< S+ 0 0 18 -4,-2.8 3,-0.5 1,-0.3 -2,-0.2 0.816 103.8 54.7 -59.3 -38.6 8.2 20.8 40.4 115 124 A E T 3< S+ 0 0 62 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.619 96.8 67.8 -65.6 -14.7 8.9 24.4 39.6 116 125 A I T <4 S+ 0 0 47 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.2 0.833 76.4 98.7 -74.9 -32.8 9.5 25.1 43.4 117 126 A 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32.3 23.1 11.2 684 693 A D >> - 0 0 1 -2,-2.0 3,-1.1 -24,-0.2 4,-1.0 -0.921 61.9 -12.5-138.0 161.9 33.5 23.2 14.8 685 694 A G T >4 S- 0 0 0 -22,-0.9 3,-0.7 -2,-0.3 -236,-0.4 0.092 125.3 -25.2 46.8-141.2 33.2 20.9 17.8 686 695 A A T >> S+ 0 0 0 -21,-2.3 4,-2.4 1,-0.2 3,-0.5 0.611 118.8 91.6 -81.5 -4.8 30.8 18.0 17.5 687 696 A N H <> S+ 0 0 4 -3,-1.1 4,-2.6 -22,-0.5 5,-0.3 0.871 85.5 56.1 -50.2 -37.3 28.7 20.1 14.8 688 697 A V H S+ 0 0 3 -3,-0.5 4,-1.4 -4,-0.4 -2,-0.2 0.757 114.0 52.9 -76.9 -25.2 29.9 14.8 13.7 690 699 A M H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.955 110.8 44.1 -71.3 -51.1 26.3 15.9 13.8 691 700 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 7,-0.2 0.898 113.6 54.1 -56.9 -38.4 26.2 17.2 10.2 692 701 A E H < S+ 0 0 99 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.878 109.8 46.8 -66.9 -35.5 28.0 14.0 9.3 693 702 A E H < S+ 0 0 55 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.892 123.7 30.5 -75.4 -41.0 25.3 12.0 11.1 694 703 A A H < S- 0 0 13 -4,-2.6 -2,-0.2 -5,-0.1 -3,-0.2 0.739 120.5-100.6 -88.1 -20.8 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29.2 7.5 705 714 A R > - 0 0 88 -23,-0.1 4,-1.1 -46,-0.1 3,-0.1 -0.410 38.5 -95.6 -83.2 176.4 36.6 25.6 8.2 706 715 A V H >> S+ 0 0 46 -23,-0.2 4,-2.3 2,-0.2 3,-1.0 0.967 124.2 58.4 -69.8 -41.6 39.7 25.4 10.5 707 716 A E H 3> S+ 0 0 109 1,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.878 106.6 49.8 -46.2 -43.6 42.3 25.3 7.6 708 717 A D H 3> S+ 0 0 51 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.812 107.1 55.8 -67.8 -29.3 40.9 28.7 6.4 709 718 A V H > - 0 0 78 -2,-0.4 3,-0.7 1,-0.1 4,-0.6 -0.916 9.5-171.8-128.4 106.4 42.6 42.5 8.8 719 728 A A H 3> S+ 0 0 4 -2,-0.5 4,-1.1 38,-0.3 -1,-0.1 0.579 81.5 71.3 -68.9 -17.2 39.1 43.4 9.8 720 729 A Q H 3> S+ 0 0 76 37,-0.2 4,-2.8 1,-0.2 3,-0.3 0.905 92.2 62.3 -67.3 -33.2 39.3 46.8 8.0 721 730 A E H <> S+ 0 0 40 -3,-0.7 4,-2.2 1,-0.2 -2,-0.2 0.873 104.8 44.1 -54.5 -41.5 39.1 44.7 4.8 722 731 A Y H X S+ 0 0 42 -4,-0.6 4,-1.0 1,-0.2 -1,-0.2 0.810 113.6 51.3 -79.4 -24.2 35.7 43.3 5.7 723 732 A Y H < S+ 0 0 41 -4,-1.1 7,-0.3 -3,-0.3 -2,-0.2 0.911 111.5 46.1 -76.0 -47.8 34.5 46.7 6.7 724 733 A D H < S+ 0 0 82 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.964 116.9 43.2 -58.1 -55.5 35.6 48.4 3.5 725 734 A R H < S+ 0 0 175 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.634 108.5 60.9 -68.0 -18.9 34.2 45.7 1.2 726 735 A I X - 0 0 11 -4,-1.0 4,-2.3 1,-0.2 3,-0.2 -0.807 56.8-172.7-121.9 101.6 30.8 45.2 2.9 727 736 A P H > S+ 0 0 72 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.831 87.3 54.5 -56.0 -42.1 28.4 48.2 3.2 728 737 A E H > S+ 0 0 58 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.939 113.0 45.6 -61.7 -41.0 25.8 46.5 5.5 729 738 A L H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.918 112.3 50.5 -65.0 -44.1 28.7 45.7 7.9 730 739 A R H X S+ 0 0 91 -4,-2.3 4,-2.5 -7,-0.3 5,-0.2 0.942 110.1 50.4 -57.8 -46.5 30.0 49.3 7.6 731 740 A Q H X S+ 0 0 94 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.920 109.5 50.7 -59.2 -44.7 26.6 50.6 8.3 732 741 A I H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.969 110.4 49.2 -61.6 -48.9 26.3 48.4 11.4 733 742 A I H X S+ 0 0 2 -4,-2.5 4,-2.9 1,-0.2 3,-0.5 0.971 111.4 49.3 -55.5 -57.6 29.7 49.5 12.8 734 743 A E H X S+ 0 0 80 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.896 107.4 54.5 -49.3 -41.8 28.9 53.2 12.3 735 744 A Q H <>S+ 0 0 23 -4,-2.4 5,-2.4 1,-0.2 6,-0.8 0.900 112.8 44.1 -60.4 -39.7 25.5 52.7 14.1 736 745 A L H ><5S+ 0 0 1 -4,-2.1 3,-1.3 -3,-0.5 13,-0.4 0.964 113.7 50.0 -66.5 -51.3 27.4 51.3 17.0 737 746 A S H 3<5S+ 0 0 56 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.609 112.5 48.3 -59.6 -20.2 30.1 54.1 16.8 738 747 A S T 3<5S- 0 0 79 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.451 113.4-107.1-106.7 0.5 27.5 56.9 16.7 739 748 A G T < 5S+ 0 0 7 -3,-1.3 -3,-0.2 7,-0.5 6,-0.2 0.758 72.7 137.3 81.0 28.0 25.2 55.9 19.5 740 749 A F S S+ 0 0 7 -6,-0.1 3,-1.5 1,-0.1 6,-0.3 -0.447 71.4 169.2-140.0 73.1 23.1 53.9 22.9 743 752 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.898 73.5 44.8 -61.8 -56.0 21.5 57.4 22.6 744 753 A K T 3 S+ 0 0 212 1,-0.3 -5,-0.0 2,-0.1 -2,-0.0 0.492 129.7 29.1 -69.2 -3.7 22.0 59.1 25.9 745 754 A Q S X S+ 0 0 96 -3,-1.5 3,-1.6 -6,-0.2 -1,-0.3 -0.552 73.1 178.8-156.2 83.6 25.7 57.8 25.9 746 755 A P G > S+ 0 0 61 0, 0.0 3,-0.6 0, 0.0 -7,-0.5 0.824 77.0 53.0 -66.7 -38.0 26.9 57.5 22.4 747 756 A D G > S+ 0 0 85 1,-0.2 3,-2.5 -9,-0.2 4,-0.2 0.513 78.8 110.6 -76.1 -2.0 30.5 56.3 22.9 748 757 A L G X S+ 0 0 26 -3,-1.6 3,-0.6 -6,-0.3 -1,-0.2 0.840 78.3 42.7 -41.8 -48.1 29.1 53.5 25.1 749 758 A F G <> S+ 0 0 1 -3,-0.6 4,-1.7 -13,-0.4 -1,-0.3 0.168 78.0 109.6 -92.4 26.3 29.9 50.7 22.7 750 759 A K H <> S+ 0 0 118 -3,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.742 71.1 62.4 -79.3 -13.5 33.4 51.8 21.6 751 760 A D H <> S+ 0 0 73 -3,-0.6 4,-1.6 -4,-0.2 -1,-0.2 0.921 109.3 41.5 -66.0 -42.3 35.2 48.9 23.5 752 761 A I H > S+ 0 0 0 -3,-0.3 4,-2.4 2,-0.2 5,-0.2 0.845 115.7 48.6 -72.6 -41.4 33.4 46.4 21.2 753 762 A V H X S+ 0 0 14 -4,-1.7 4,-2.6 2,-0.2 5,-0.3 0.968 112.0 50.3 -62.7 -50.4 33.8 48.4 18.0 754 763 A N H X S+ 0 0 76 -4,-1.9 4,-2.2 1,-0.2 5,-0.2 0.862 112.8 47.1 -58.4 -38.2 37.5 48.9 18.8 755 764 A M H X S+ 0 0 9 -4,-1.6 4,-4.3 2,-0.2 5,-0.5 0.989 110.8 47.9 -67.8 -57.7 37.9 45.2 19.4 756 765 A L H < S+ 0 0 0 -4,-2.4 4,-0.4 1,-0.3 9,-0.2 0.902 119.9 43.3 -50.4 -44.4 36.1 43.9 16.3 757 766 A M H < S+ 0 0 20 -4,-2.6 -38,-0.3 -5,-0.2 -1,-0.3 0.858 135.5 7.5 -68.7 -38.5 38.1 46.4 14.3 758 767 A H H < S+ 0 0 119 -4,-2.2 -3,-0.2 -5,-0.3 -2,-0.2 0.544 130.4 32.5-129.4 -1.4 41.5 45.9 15.9 759 768 A H < + 0 0 121 -4,-4.3 2,-1.5 -5,-0.2 -3,-0.2 -0.005 63.8 152.7-151.0 32.4 41.8 43.0 18.4 760 769 A D > + 0 0 16 -5,-0.5 3,-1.0 -4,-0.4 -4,-0.1 -0.504 14.3 176.5 -80.5 95.7 39.5 40.3 17.1 761 770 A R T 3 S+ 0 0 115 -2,-1.5 -1,-0.2 1,-0.2 -5,-0.0 0.752 82.7 44.2 -63.6 -22.6 40.9 37.1 18.4 762 771 A F T 3 S- 0 0 6 -3,-0.1 -1,-0.2 -199,-0.0 -2,-0.1 0.273 102.1-124.8-117.2 13.2 37.9 35.2 16.9 763 772 A K <> + 0 0 8 -3,-1.0 4,-0.8 1,-0.1 -2,-0.1 0.914 37.1 172.5 55.8 60.6 37.4 36.8 13.4 764 773 A V T 4 S+ 0 0 4 1,-0.2 4,-0.5 2,-0.2 3,-0.4 0.892 76.6 49.7 -73.0 -32.5 33.8 37.9 13.6 765 774 A F T >> S+ 0 0 1 1,-0.2 3,-1.0 -9,-0.2 4,-0.5 0.855 98.6 68.1 -72.7 -30.2 33.9 39.8 10.3 766 775 A A T 34 S+ 0 0 19 1,-0.3 4,-0.3 2,-0.1 -1,-0.2 0.853 107.5 37.0 -61.8 -30.7 35.4 36.9 8.4 767 776 A D T 3X S+ 0 0 2 -4,-0.8 4,-1.7 -3,-0.4 -1,-0.3 0.470 90.4 94.7-100.2 1.5 32.3 34.8 8.7 768 777 A Y H <> S+ 0 0 0 -3,-1.0 4,-2.6 -4,-0.5 5,-0.3 0.844 81.9 50.4 -66.0 -40.8 29.7 37.5 8.3 769 778 A E H X S+ 0 0 95 -4,-0.5 4,-2.3 2,-0.2 -1,-0.2 0.975 116.7 40.1 -58.0 -58.6 29.0 37.2 4.5 770 779 A E H > S+ 0 0 91 -4,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.743 115.2 55.7 -64.2 -27.0 28.5 33.4 4.6 771 780 A Y H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.977 109.0 41.7 -73.9 -57.0 26.6 33.7 7.8 772 781 A V H X S+ 0 0 3 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.896 116.8 53.6 -61.0 -30.8 23.9 36.3 6.7 773 782 A K H >X S+ 0 0 87 -4,-2.3 4,-1.8 -5,-0.3 3,-1.1 0.976 109.3 45.4 -57.3 -57.5 23.7 34.1 3.4 774 783 A C H 3X S+ 0 0 1 -4,-2.3 4,-1.0 1,-0.3 -1,-0.2 0.859 110.1 56.6 -54.0 -37.1 23.1 30.9 5.4 775 784 A Q H 3X S+ 0 0 2 -4,-2.2 4,-1.5 1,-0.2 -1,-0.3 0.773 101.6 55.0 -67.8 -32.1 20.5 32.7 7.4 776 785 A E H < S+ 0 0 32 -4,-1.4 3,-1.9 1,-0.2 7,-0.4 0.733 105.3 67.9 -74.4 -26.6 12.9 26.8 4.3 782 791 A Y H 3< S+ 0 0 41 -4,-2.2 -1,-0.2 1,-0.3 6,-0.2 0.943 97.6 52.8 -64.2 -39.8 11.0 28.0 7.3 783 792 A K T 3< S+ 0 0 124 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.239 98.5 65.6 -85.5 19.5 8.1 29.2 5.2 784 793 A N S X> S+ 0 0 81 -3,-1.9 4,-1.7 1,-0.1 3,-1.4 -0.671 74.5 179.0-125.0 73.2 7.9 25.8 3.6 785 794 A P H 3> S+ 0 0 87 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.836 70.5 54.5 -48.7 -42.0 6.8 24.2 6.9 786 795 A R H 3> S+ 0 0 92 1,-0.3 4,-1.5 2,-0.2 5,-0.1 0.855 110.9 47.7 -68.3 -24.8 6.4 20.6 5.7 787 796 A E H <> S+ 0 0 68 -3,-1.4 4,-1.4 2,-0.2 -1,-0.3 0.794 109.1 52.4 -90.2 -26.4 9.9 20.6 4.4 788 797 A W H >X S+ 0 0 11 -4,-1.7 4,-3.0 -7,-0.4 3,-0.5 0.971 110.7 49.1 -62.7 -50.8 11.3 22.1 7.7 789 798 A T H 3X S+ 0 0 18 -4,-2.7 4,-2.9 1,-0.3 -2,-0.2 0.872 109.6 51.4 -60.7 -32.4 9.6 19.3 9.6 790 799 A R H 3X S+ 0 0 26 -4,-1.5 4,-1.0 -5,-0.2 -1,-0.3 0.884 111.6 46.4 -72.0 -32.4 11.0 16.7 7.3 791 800 A M H XX S+ 0 0 32 -4,-1.4 4,-1.2 -3,-0.5 3,-1.0 0.970 113.5 49.9 -67.9 -49.5 14.5 18.2 7.8 792 801 A V H >X S+ 0 0 10 -4,-3.0 4,-2.8 1,-0.2 3,-1.0 0.916 106.4 56.0 -47.5 -47.0 13.8 18.2 11.6 793 802 A I H 3X S+ 0 0 0 -4,-2.9 4,-1.7 1,-0.3 -1,-0.2 0.799 107.5 49.7 -64.9 -24.2 12.7 14.5 11.3 794 803 A R H << S+ 0 0 73 -4,-1.0 4,-0.3 -3,-1.0 -1,-0.3 0.683 111.8 47.1 -87.3 -20.4 16.1 13.7 9.8 795 804 A N H XX S+ 0 0 0 -4,-1.2 3,-1.7 -3,-1.0 4,-0.8 0.937 115.3 45.1 -80.1 -57.0 17.9 15.5 12.6 796 805 A I H >< S+ 0 0 5 -4,-2.8 3,-0.9 1,-0.3 4,-0.2 0.892 112.3 53.4 -51.4 -42.1 15.8 13.8 15.3 797 806 A A T 3< S+ 0 0 0 -4,-1.7 -1,-0.3 -5,-0.3 3,-0.3 0.716 110.9 45.5 -70.9 -14.4 16.2 10.5 13.6 798 807 A T T X4 S+ 0 0 12 -3,-1.7 3,-0.6 -4,-0.3 -1,-0.2 0.471 80.9 98.4-112.5 5.5 20.0 10.7 13.5 799 808 A S G X< + 0 0 2 -3,-0.9 3,-2.6 -4,-0.8 -1,-0.2 0.640 51.8 102.6 -61.4 -17.7 20.7 11.9 17.1 800 809 A G G > S+ 0 0 1 -294,-0.4 3,-1.4 1,-0.3 -293,-0.3 0.819 72.6 58.1 -39.4 -51.4 21.6 8.3 18.4 801 810 A K G < S+ 0 0 36 -3,-0.6 -1,-0.3 1,-0.3 6,-0.1 0.708 96.8 67.1 -56.3 -18.8 25.4 8.8 18.5 802 811 A F G < S+ 0 0 5 -3,-2.6 -325,-1.7 -4,-0.1 2,-0.3 0.078 71.3 116.1-100.1 28.6 25.0 11.8 20.8 803 812 A S B <> -p 477 0G 4 -3,-1.4 4,-1.7 -327,-0.2 3,-0.3 -0.749 67.0-136.1 -88.2 145.9 23.7 9.8 23.8 804 813 A S H > S+ 0 0 0 -327,-2.3 4,-2.8 -2,-0.3 5,-0.2 0.676 105.0 67.6 -73.1 -12.9 25.9 9.8 26.9 805 814 A D H > S+ 0 0 12 -328,-0.4 4,-2.9 2,-0.2 -1,-0.2 0.928 101.9 45.0 -77.0 -37.0 25.2 6.1 27.2 806 815 A R H > S+ 0 0 40 -3,-0.3 4,-1.9 -6,-0.2 -2,-0.2 0.955 114.8 48.7 -65.1 -49.9 27.2 5.6 23.9 807 816 A T H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.938 115.5 44.0 -55.0 -45.4 30.0 8.0 25.3 808 817 A I H X S+ 0 0 0 -4,-2.8 4,-3.3 1,-0.2 -2,-0.2 0.951 108.8 56.0 -71.3 -46.9 30.1 6.1 28.6 809 818 A A H X S+ 0 0 16 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.790 111.0 47.6 -52.4 -29.7 30.0 2.7 27.0 810 819 A Q H X S+ 0 0 53 -4,-1.9 4,-2.5 2,-0.2 5,-0.3 0.874 113.1 44.3 -81.4 -36.2 33.1 3.8 25.1 811 820 A Y H X>S+ 0 0 0 -4,-2.2 5,-3.0 -3,-0.2 4,-2.3 0.935 114.1 54.3 -62.6 -43.2 35.0 5.1 28.2 812 821 A A H <>S+ 0 0 0 -4,-3.3 5,-2.5 3,-0.2 6,-1.6 0.962 118.3 32.1 -49.0 -65.6 33.9 2.0 29.9 813 822 A R H <5S+ 0 0 124 -4,-1.8 -1,-0.2 4,-0.2 -2,-0.2 0.823 130.0 31.2 -60.6 -41.9 35.3 -0.3 27.2 814 823 A E H <5S+ 0 0 97 -4,-2.5 -3,-0.2 -5,-0.1 -1,-0.2 0.560 132.8 18.6-107.1 -8.4 38.4 1.6 26.0 815 824 A I T <5S+ 0 0 9 -4,-2.3 -3,-0.2 -5,-0.3 -4,-0.1 0.587 131.4 31.2-122.7 -48.3 39.6 3.6 29.0 816 825 A W T