==== 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 METAL BINDING PROTEIN 20-DEC-06 2OC5 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PROCHLOROCOCCUS MARINUS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 222 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10460.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 193 86.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 5 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 158 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 3.6 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 1 0 0 0 1 0 0 0 0 0 1 1 0 0 0 1 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 20 A E 0 0 150 0, 0.0 2,-0.1 0, 0.0 186,-0.0 0.000 360.0 360.0 360.0 -9.3 30.7 49.6 55.2 2 21 A A - 0 0 71 1,-0.1 120,-0.0 120,-0.0 0, 0.0 -0.478 360.0-103.7 -64.1 141.9 29.3 50.3 58.6 3 22 A L - 0 0 96 -2,-0.1 -1,-0.1 1,-0.1 183,-0.1 -0.389 36.2-111.2 -65.6 145.4 26.3 48.1 59.2 4 23 A P - 0 0 16 0, 0.0 2,-1.2 0, 0.0 -1,-0.1 -0.252 28.7-102.9 -67.8 161.4 22.9 49.6 59.0 5 24 A D > - 0 0 92 1,-0.2 3,-1.6 2,-0.0 6,-0.3 -0.762 35.0-166.3 -82.1 99.6 20.5 50.1 61.9 6 25 A F T 3 S+ 0 0 32 -2,-1.2 -1,-0.2 1,-0.3 118,-0.0 0.611 82.2 56.7 -66.6 -15.0 18.2 47.2 61.1 7 26 A T T 3 S+ 0 0 102 4,-0.1 -1,-0.3 -3,-0.0 2,-0.1 0.483 82.6 108.9 -95.2 -6.3 15.6 48.6 63.6 8 27 A S S <> S- 0 0 28 -3,-1.6 4,-2.6 1,-0.1 5,-0.2 -0.333 73.0-127.7 -75.3 152.7 15.1 52.0 62.0 9 28 A D H > S+ 0 0 135 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.894 112.5 55.6 -59.7 -40.4 12.0 53.2 60.2 10 29 A R H > S+ 0 0 153 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.926 111.0 42.9 -57.5 -49.1 14.2 54.2 57.3 11 30 A Y H > S+ 0 0 0 -6,-0.3 4,-2.9 1,-0.2 5,-0.2 0.947 113.9 50.6 -66.4 -45.7 15.8 50.7 57.0 12 31 A K H X S+ 0 0 68 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.883 108.2 52.8 -61.9 -40.5 12.5 48.9 57.4 13 32 A D H X S+ 0 0 88 -4,-2.4 4,-0.9 2,-0.2 -1,-0.2 0.938 113.0 42.9 -59.6 -49.0 10.8 50.9 54.7 14 33 A A H >X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 3,-0.6 0.912 113.1 53.9 -63.2 -43.9 13.5 50.2 52.2 15 34 A Y H 3X S+ 0 0 8 -4,-2.9 4,-3.2 1,-0.2 5,-0.4 0.877 96.9 65.8 -61.4 -32.2 13.6 46.5 53.3 16 35 A S H 3X S+ 0 0 17 -4,-2.3 57,-1.9 1,-0.2 4,-1.2 0.876 111.1 35.9 -58.7 -37.5 9.8 46.2 52.7 17 36 A R H X S+ 0 0 17 -4,-2.4 3,-1.4 1,-0.2 4,-0.7 0.910 104.4 58.1 -63.9 -42.1 7.3 26.2 32.6 36 55 A I H >X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.3 3,-1.0 0.851 95.3 67.7 -59.0 -29.4 10.7 25.4 31.0 37 56 A G H 3< S+ 0 0 7 -4,-1.4 -1,-0.3 -3,-0.3 7,-0.2 0.800 92.8 58.0 -59.7 -29.5 9.7 21.7 31.7 38 57 A T H << S+ 0 0 100 -3,-1.4 -1,-0.3 -4,-0.7 -2,-0.2 0.806 111.3 41.9 -68.3 -29.0 6.9 22.1 29.2 39 58 A L H << S+ 0 0 40 -3,-1.0 -2,-0.2 -4,-0.7 -1,-0.2 0.733 125.8 34.1 -85.2 -29.8 9.6 23.0 26.6 40 59 A L >< + 0 0 15 -4,-1.9 3,-2.0 1,-0.1 4,-0.2 -0.709 67.7 172.7-126.1 75.3 12.1 20.3 27.7 41 60 A P G > S+ 0 0 93 0, 0.0 3,-1.3 0, 0.0 4,-0.2 0.827 78.6 58.6 -58.4 -32.7 9.9 17.3 28.8 42 61 A D G 3 S+ 0 0 133 1,-0.2 3,-0.2 2,-0.1 4,-0.2 0.618 104.3 52.9 -71.7 -13.1 13.0 15.1 29.3 43 62 A H G <> S+ 0 0 44 -3,-2.0 4,-2.7 -6,-0.2 5,-0.3 0.305 75.8 110.3 -96.5 2.7 14.4 17.7 31.8 44 63 A V H <> S+ 0 0 51 -3,-1.3 4,-2.5 -4,-0.2 5,-0.2 0.839 75.1 49.6 -55.9 -41.0 11.2 17.7 34.0 45 64 A E H > S+ 0 0 132 -3,-0.2 4,-1.6 -4,-0.2 -1,-0.2 0.931 114.9 43.7 -71.6 -36.1 12.8 15.9 37.1 46 65 A E H > S+ 0 0 90 -3,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.924 114.4 50.1 -66.4 -45.8 15.8 18.2 37.2 47 66 A L H X S+ 0 0 1 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.888 108.1 53.8 -62.3 -36.8 13.7 21.3 36.6 48 67 A K H X S+ 0 0 92 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.2 0.882 107.9 50.7 -61.1 -39.4 11.4 20.2 39.4 49 68 A R H X S+ 0 0 151 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.926 111.6 46.3 -63.2 -46.5 14.4 19.9 41.7 50 69 A L H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.942 112.0 52.4 -61.3 -44.3 15.5 23.5 40.8 51 70 A A H X S+ 0 0 1 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.871 107.0 52.2 -59.4 -41.4 11.9 24.7 41.3 52 71 A K H X S+ 0 0 92 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.871 105.9 54.3 -64.9 -37.1 11.8 23.2 44.7 53 72 A X H X S+ 0 0 15 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.890 104.9 54.9 -59.7 -43.3 15.1 25.0 45.6 54 73 A E H X S+ 0 0 2 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.889 105.4 52.1 -60.9 -38.5 13.5 28.3 44.6 55 74 A X H X S+ 0 0 55 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.871 108.6 50.3 -66.8 -35.9 10.6 27.7 47.0 56 75 A R H X S+ 0 0 152 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.923 110.4 50.0 -62.5 -44.4 13.0 27.0 49.8 57 76 A H H X S+ 0 0 5 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.934 110.2 51.2 -57.0 -46.9 14.8 30.3 48.9 58 77 A K H X S+ 0 0 52 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.906 109.7 49.2 -59.2 -43.0 11.3 32.0 49.0 59 78 A K H X S+ 0 0 154 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.907 111.6 49.5 -64.6 -41.5 10.5 30.6 52.4 60 79 A G H X S+ 0 0 18 -4,-2.3 4,-1.3 2,-0.2 -2,-0.2 0.914 113.0 44.9 -62.5 -47.2 13.9 31.7 53.8 61 80 A F H X S+ 0 0 5 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.855 109.1 56.7 -70.4 -30.8 13.7 35.3 52.5 62 81 A T H X S+ 0 0 49 -4,-2.2 4,-2.1 -5,-0.3 3,-0.3 0.935 106.3 51.2 -60.1 -44.9 10.1 35.6 53.7 63 82 A A H X S+ 0 0 36 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.807 102.3 60.9 -65.5 -27.9 11.4 34.7 57.2 64 83 A C H X S+ 0 0 0 -4,-1.3 4,-1.2 2,-0.2 -1,-0.2 0.921 107.0 45.4 -63.1 -42.3 14.0 37.5 56.8 65 84 A G H ><>S+ 0 0 0 -4,-1.5 5,-2.5 -3,-0.3 3,-0.6 0.946 113.3 48.6 -63.4 -50.0 11.2 40.1 56.5 66 85 A K H ><5S+ 0 0 159 -4,-2.1 3,-1.4 1,-0.3 -2,-0.2 0.901 106.6 58.0 -60.5 -41.4 9.3 38.6 59.4 67 86 A N H 3<5S+ 0 0 79 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.835 110.2 42.8 -59.5 -33.4 12.4 38.6 61.5 68 87 A L T <<5S- 0 0 24 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.366 116.6-111.9 -92.1 1.6 12.8 42.4 61.1 69 88 A G T < 5 + 0 0 60 -3,-1.4 2,-0.4 -4,-0.5 -3,-0.2 0.850 69.4 144.2 69.2 35.5 9.1 43.1 61.6 70 89 A V < - 0 0 14 -5,-2.5 2,-0.6 -6,-0.1 -1,-0.2 -0.874 45.8-143.5-111.1 137.7 8.7 44.2 58.0 71 90 A E - 0 0 107 -2,-0.4 2,-0.2 -59,-0.1 -51,-0.1 -0.898 29.4-122.1 -97.5 120.4 5.7 43.6 55.7 72 91 A A - 0 0 29 -2,-0.6 2,-1.5 1,-0.1 -55,-0.2 -0.417 10.1-134.5 -65.8 129.1 6.7 42.9 52.2 73 92 A D > + 0 0 63 -57,-1.9 4,-1.6 -2,-0.2 -1,-0.1 -0.637 32.7 172.5 -81.9 81.4 5.3 45.3 49.5 74 93 A X H > S+ 0 0 43 -2,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.805 71.2 57.6 -70.5 -29.5 4.3 42.5 47.0 75 94 A D H > S+ 0 0 120 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.936 106.3 49.8 -65.5 -44.0 2.5 44.9 44.6 76 95 A F H > S+ 0 0 74 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.920 112.1 49.9 -51.7 -46.7 5.6 46.9 44.2 77 96 A A H X S+ 0 0 0 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.866 107.6 51.3 -64.7 -41.8 7.5 43.6 43.5 78 97 A R H X S+ 0 0 109 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.927 112.4 46.9 -66.0 -40.2 5.1 42.3 40.9 79 98 A E H >< S+ 0 0 88 -4,-2.1 3,-0.6 1,-0.2 -2,-0.2 0.892 107.1 58.3 -64.1 -41.4 5.3 45.6 39.0 80 99 A F H 3< S+ 0 0 9 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.878 113.4 37.8 -56.4 -40.4 9.1 45.5 39.2 81 100 A F H 3X S+ 0 0 13 -4,-1.7 4,-3.0 1,-0.2 5,-0.3 0.589 91.1 97.2 -87.2 -8.5 9.3 42.1 37.5 82 101 A A H S+ 0 0 42 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.951 118.9 38.9 -58.6 -41.4 8.5 43.8 31.9 84 103 A L H > S+ 0 0 3 -4,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.897 114.5 53.8 -74.6 -38.7 10.8 40.9 32.1 85 104 A R H X S+ 0 0 74 -4,-3.0 4,-2.8 2,-0.2 5,-0.2 0.923 107.2 52.3 -58.3 -45.5 8.0 38.5 33.1 86 105 A D H X S+ 0 0 93 -4,-2.9 4,-2.4 -5,-0.3 -1,-0.2 0.916 109.9 49.0 -59.1 -44.9 6.1 39.6 30.0 87 106 A N H X S+ 0 0 55 -4,-1.7 4,-2.2 -5,-0.2 -1,-0.2 0.893 110.6 49.8 -62.3 -39.5 9.1 38.8 27.8 88 107 A F H X S+ 0 0 1 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.953 112.0 48.7 -63.8 -45.1 9.6 35.4 29.4 89 108 A Q H X S+ 0 0 92 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.889 109.3 52.5 -60.3 -39.5 5.9 34.6 28.8 90 109 A T H X S+ 0 0 78 -4,-2.4 4,-1.2 -5,-0.2 -1,-0.2 0.947 112.4 44.7 -63.4 -47.5 6.1 35.7 25.2 91 110 A A H <>S+ 0 0 5 -4,-2.2 5,-2.4 2,-0.2 3,-0.4 0.910 111.3 53.4 -63.2 -42.8 9.1 33.4 24.6 92 111 A L H ><5S+ 0 0 33 -4,-2.8 3,-1.7 1,-0.2 -1,-0.2 0.926 107.6 51.4 -57.0 -48.3 7.4 30.5 26.4 93 112 A G H 3<5S+ 0 0 70 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.769 111.2 47.8 -61.0 -30.5 4.3 30.9 24.2 94 113 A Q T 3<5S- 0 0 116 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.359 114.4-115.7 -89.8 2.3 6.5 30.8 21.1 95 114 A G T < 5 + 0 0 42 -3,-1.7 2,-1.9 -4,-0.3 -3,-0.2 0.687 59.5 156.4 69.9 21.5 8.5 27.7 22.3 96 115 A K >< + 0 0 88 -5,-2.4 4,-2.4 1,-0.2 3,-0.3 -0.516 9.7 169.4 -86.4 69.6 11.7 29.7 22.5 97 116 A T H > S+ 0 0 15 -2,-1.9 4,-2.6 1,-0.2 5,-0.2 0.874 72.8 56.1 -47.8 -47.5 13.7 27.6 25.0 98 117 A P H > S+ 0 0 14 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.928 110.1 45.6 -58.5 -40.1 17.0 29.5 24.4 99 118 A T H > S+ 0 0 16 -3,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.920 111.4 51.5 -68.5 -47.1 15.4 32.8 25.2 100 119 A C H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.4 0.923 113.5 46.3 -52.1 -43.9 13.6 31.4 28.3 101 120 A L H X>S+ 0 0 0 -4,-2.6 4,-1.2 -5,-0.2 5,-1.1 0.911 110.4 51.3 -70.1 -42.1 16.9 30.0 29.6 102 121 A L H X>S+ 0 0 0 -4,-2.7 5,-2.8 -5,-0.2 4,-0.7 0.934 114.3 45.7 -57.3 -45.3 18.8 33.2 28.8 103 122 A I H <>S+ 0 0 1 -4,-2.7 5,-2.2 3,-0.2 -2,-0.2 0.962 128.1 22.0 -62.1 -56.3 16.2 35.2 30.8 104 123 A Q H <>S+ 0 0 2 -4,-2.7 5,-1.3 -5,-0.2 -3,-0.2 0.967 129.1 37.8 -80.5 -54.6 15.9 32.9 33.9 105 124 A A H <5S+ 0 0 0 -4,-1.2 40,-0.2 -5,-0.4 41,-0.2 0.722 130.8 22.0 -80.5 -23.5 19.1 30.8 34.1 106 125 A L T X< S+ 0 0 14 -4,-2.5 3,-2.2 -5,-0.2 4,-0.5 0.888 93.6 75.8 -69.7 -39.4 24.0 42.0 50.7 120 139 A I G >< S+ 0 0 25 -4,-2.2 3,-1.6 1,-0.3 -1,-0.2 0.852 92.8 48.8 -46.0 -54.1 25.9 39.5 52.8 121 140 A P G 3 S+ 0 0 75 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.610 119.6 39.2 -65.1 -14.9 28.5 41.8 54.3 122 141 A V G < S+ 0 0 11 -3,-2.2 -2,-0.2 -4,-0.3 2,-0.2 0.167 95.4 112.1-116.0 12.5 25.8 44.3 55.3 123 142 A S S < S- 0 0 1 -3,-1.6 -120,-0.0 -4,-0.5 -3,-0.0 -0.522 72.0-104.4 -87.2 152.5 23.1 41.9 56.4 124 143 A D > - 0 0 5 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.306 42.0-101.9 -66.0 156.0 21.7 41.2 59.9 125 144 A P H > S+ 0 0 104 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.847 119.5 47.5 -59.4 -32.5 22.9 38.0 61.5 126 145 A F H > S+ 0 0 87 1,-0.2 4,-1.6 2,-0.2 3,-0.2 0.956 116.8 42.1 -68.9 -50.2 19.6 36.0 60.8 127 146 A A H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.809 106.8 63.9 -67.2 -31.3 19.5 37.0 57.1 128 147 A R H X S+ 0 0 73 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.922 104.0 45.5 -61.5 -46.9 23.2 36.6 56.7 129 148 A K H X S+ 0 0 85 -4,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.904 114.1 49.2 -61.9 -42.1 23.0 32.8 57.4 130 149 A I H X S+ 0 0 40 -4,-1.6 4,-1.6 1,-0.2 -2,-0.2 0.959 113.2 46.4 -63.5 -46.6 19.9 32.4 55.1 131 150 A T H X S+ 0 0 0 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.898 108.1 55.6 -63.1 -44.5 21.6 34.3 52.3 132 151 A E H X S+ 0 0 102 -4,-2.8 4,-0.6 -5,-0.2 -1,-0.2 0.907 106.4 53.8 -56.1 -39.0 24.9 32.3 52.6 133 152 A G H X S+ 0 0 50 -4,-2.0 4,-0.6 1,-0.2 3,-0.3 0.928 109.3 48.2 -54.0 -44.6 22.8 29.1 52.2 134 153 A V H X S+ 0 0 8 -4,-1.6 4,-1.3 1,-0.2 3,-0.4 0.754 92.6 72.0 -72.8 -33.2 21.3 30.4 48.9 135 154 A V H X S+ 0 0 33 -4,-1.5 4,-1.4 1,-0.2 3,-0.3 0.895 93.9 55.8 -62.4 -38.7 24.3 31.6 47.0 136 155 A K H X S+ 0 0 63 -4,-0.6 4,-1.5 -3,-0.3 -1,-0.2 0.894 105.3 53.3 -54.3 -41.4 25.7 28.1 46.3 137 156 A D H X S+ 0 0 43 -4,-0.6 4,-2.2 -3,-0.4 -1,-0.2 0.824 100.2 61.0 -65.6 -32.9 22.3 27.2 44.7 138 157 A E H X S+ 0 0 1 -4,-1.3 4,-3.1 -3,-0.3 5,-0.2 0.916 103.2 51.1 -59.2 -44.4 22.5 30.2 42.3 139 158 A Y H X S+ 0 0 116 -4,-1.4 4,-2.8 1,-0.2 -1,-0.2 0.903 107.5 53.4 -61.8 -37.8 25.7 28.7 40.8 140 159 A T H X S+ 0 0 59 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.930 111.7 45.5 -58.9 -43.7 23.9 25.4 40.3 141 160 A H H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.939 113.0 48.3 -68.4 -48.3 21.1 27.3 38.4 142 161 A L H X S+ 0 0 2 -4,-3.1 4,-2.8 1,-0.2 -1,-0.2 0.928 111.2 52.2 -52.6 -47.3 23.6 29.3 36.3 143 162 A N H X S+ 0 0 86 -4,-2.8 4,-2.5 -5,-0.2 -2,-0.2 0.866 106.1 54.0 -59.4 -37.8 25.5 26.0 35.6 144 163 A Y H X S+ 0 0 17 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96 -4,-2.2 4,-0.2 -5,-0.1 -1,-0.2 0.834 126.0 32.5 -80.4 -35.4 15.9 42.9 24.4 167 186 A N H >X S+ 0 0 5 -4,-2.2 4,-1.5 -5,-0.2 3,-0.7 0.764 99.9 70.7-105.4 -29.3 16.4 41.7 28.1 168 187 A L H 3X S+ 0 0 4 -4,-2.4 4,-2.1 -5,-0.4 3,-0.3 0.908 98.7 54.4 -55.3 -43.5 19.8 43.0 29.2 169 188 A P H 3> S+ 0 0 36 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.794 103.1 58.1 -57.2 -31.3 18.4 46.6 29.3 170 189 A L H <> S+ 0 0 18 -3,-0.7 4,-2.1 -4,-0.2 -2,-0.2 0.868 104.2 49.4 -68.2 -37.5 15.6 45.5 31.5 171 190 A I H X S+ 0 0 0 -4,-1.5 4,-2.6 -3,-0.3 5,-0.2 0.941 110.7 51.7 -61.9 -47.6 18.1 44.2 34.1 172 191 A R H X S+ 0 0 67 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.930 110.1 48.8 -52.6 -45.8 19.8 47.6 33.8 173 192 A R H X S+ 0 0 107 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.888 109.7 51.3 -64.2 -37.4 16.5 49.3 34.4 174 193 A X H X S+ 0 0 6 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.911 109.4 50.5 -64.9 -43.4 15.8 47.1 37.4 175 194 A L H X S+ 0 0 9 -4,-2.6 4,-1.3 1,-0.2 -2,-0.2 0.933 111.0 49.3 -60.0 -47.2 19.2 48.0 38.9 176 195 A D H < S+ 0 0 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0 82 -3,-1.8 2,-0.5 1,-0.3 -3,-0.2 0.734 73.5 141.0 67.4 31.4 24.4 49.9 52.6 187 206 A X < - 0 0 16 -5,-2.5 2,-0.5 -8,-0.1 -1,-0.3 -0.902 48.9-135.0-103.4 126.9 24.8 48.3 49.2 188 207 A D >> - 0 0 79 -2,-0.5 4,-1.8 1,-0.1 3,-0.7 -0.744 4.5-145.2 -81.1 122.8 26.8 50.1 46.5 189 208 A K H 3> S+ 0 0 73 -2,-0.5 4,-2.6 1,-0.2 5,-0.2 0.847 101.1 59.6 -54.5 -37.8 25.2 50.1 43.1 190 209 A E H 3> S+ 0 0 147 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.871 104.3 49.6 -63.9 -33.9 28.7 49.9 41.5 191 210 A D H <> S+ 0 0 75 -3,-0.7 4,-2.4 2,-0.2 5,-0.2 0.917 110.1 50.9 -65.6 -41.4 29.3 46.6 43.4 192 211 A L H X S+ 0 0 5 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.923 112.5 46.2 -62.0 -44.6 26.0 45.3 42.1 193 212 A I H X S+ 0 0 61 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.934 113.2 48.6 -66.3 -46.6 26.8 46.2 38.6 194 213 A E H X S+ 0 0 118 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.934 113.6 45.4 -57.1 -50.0 30.3 44.8 38.7 195 214 A D H X S+ 0 0 36 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.887 113.3 50.8 -66.4 -37.7 29.3 41.4 40.2 196 215 A F H X S+ 0 0 6 -4,-2.0 4,-2.9 -5,-0.2 5,-0.2 0.946 112.3 45.8 -63.0 -50.8 26.4 41.1 37.8 197 216 A L H X S+ 0 0 66 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.868 112.3 50.9 -65.0 -39.7 28.5 41.7 34.7 198 217 A I H X S+ 0 0 89 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.953 113.2 45.3 -61.8 -48.8 31.3 39.4 35.9 199 218 A A H X S+ 0 0 4 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.939 116.2 45.6 -58.5 -46.3 28.8 36.5 36.5 200 219 A Y H X S+ 0 0 2 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.933 113.1 48.8 -66.6 -47.2 27.0 37.1 33.2 201 220 A Q H X S+ 0 0 32 -4,-2.8 4,-2.6 -5,-0.2 -1,-0.2 0.927 110.5 52.0 -58.0 -41.6 30.3 37.4 31.2 202 221 A E H X S+ 0 0 111 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.892 109.7 49.1 -63.1 -37.3 31.6 34.2 32.8 203 222 A S H X S+ 0 0 1 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.928 111.3 49.2 -65.3 -47.3 28.4 32.4 31.9 204 223 A L H X>S+ 0 0 2 -4,-2.6 5,-2.2 2,-0.2 4,-1.5 0.905 110.7 51.1 -59.0 -41.0 28.6 33.6 28.2 205 224 A T H <5S+ 0 0 86 -4,-2.6 3,-0.5 1,-0.2 -2,-0.2 0.946 109.9 49.4 -59.6 -50.9 32.3 32.5 28.1 206 225 A E H <5S+ 0 0 85 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.885 107.5 54.9 -55.5 -40.4 31.3 29.0 29.4 207 226 A I H <5S- 0 0 3 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.801 127.0 -98.5 -67.2 -31.9 28.6 28.8 26.8 208 227 A G T <5S+ 0 0 41 -4,-1.5 2,-0.2 -3,-0.5 -3,-0.2 0.507 72.3 141.0 127.6 7.4 31.1 29.5 24.0 209 228 A F < - 0 0 8 -5,-2.2 -1,-0.3 1,-0.1 2,-0.1 -0.573 44.3-130.9 -74.8 141.4 30.9 33.2 23.1 210 229 A N > - 0 0 90 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.288 28.2 -94.4 -85.3 175.0 34.3 34.9 22.4 211 230 A T H > S+ 0 0 112 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.904 124.5 48.4 -57.9 -45.1 35.6 38.2 23.8 212 231 A R H > S+ 0 0 212 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.921 112.2 49.3 -62.3 -45.1 34.3 40.3 20.9 213 232 A E H > S+ 0 0 52 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.911 112.8 47.0 -60.0 -44.9 30.9 38.7 21.0 214 233 A I H X S+ 0 0 17 -4,-2.7 4,-3.4 2,-0.2 5,-0.3 0.869 110.9 51.8 -66.7 -38.5 30.5 39.3 24.8 215 234 A T H X S+ 0 0 92 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.936 110.1 48.6 -64.2 -44.9 31.7 42.9 24.5 216 235 A R H < S+ 0 0 215 -4,-2.5 4,-0.4 1,-0.2 -2,-0.2 0.916 115.5 45.8 -60.4 -42.3 29.2 43.6 21.8 217 236 A X H >< S+ 0 0 7 -4,-2.3 3,-1.9 1,-0.2 4,-0.5 0.927 109.4 51.3 -65.8 -49.6 26.5 41.9 24.0 218 237 A A H >< S+ 0 0 37 -4,-3.4 3,-1.1 1,-0.3 -1,-0.2 0.879 104.6 61.2 -59.4 -30.0 27.4 43.6 27.3 219 238 A A G >< S+ 0 0 63 -4,-1.8 3,-2.2 -5,-0.3 -1,-0.3 0.696 83.1 79.0 -63.7 -20.8 27.2 46.9 25.4 220 239 A A G < + 0 0 32 -3,-1.9 -1,-0.2 -4,-0.4 -2,-0.2 0.815 69.4 83.5 -63.3 -28.7 23.5 46.3 24.6 221 240 A A G < 0 0 24 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.1 0.622 360.0 360.0 -44.0 -18.5 22.8 47.5 28.1 222 241 A L < 0 0 123 -3,-2.2 -1,-0.3 -4,-0.1 -2,-0.1 0.517 360.0 360.0 -40.0 360.0 23.0 50.9 26.3