==== 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 TRANSFERASE 14-JUL-05 2BWJ . COMPND 2 MOLECULE: ADENYLATE KINASE 5; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.BUNKOCZI,P.FILIPPAKOPOULOS,O.FEDOROV,A.JANSSON,E.LONGMAN, . 1160 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53529.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 909 78.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 134 11.6 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 . 1 0.1 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 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 575 49.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 1.5 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 2 1 0 1 0 3 14 6 7 0 2 9 1 0 0 0 0 0 0 0 0 0 0 1 1 4 0 RESIDUES PER ALPHA HELIX . 0 0 2 10 8 4 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 6 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 3 A G > 0 0 80 0, 0.0 4,-1.2 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -81.6 68.0 -4.1 9.5 2 4 A F H > + 0 0 121 2,-0.2 4,-4.2 3,-0.2 5,-0.3 0.877 360.0 60.7 -64.7 -41.9 71.6 -3.0 9.4 3 5 A M H > S+ 0 0 90 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.958 112.2 34.0 -50.5 -62.0 70.2 0.6 9.4 4 6 A E H > S+ 0 0 88 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.797 119.2 55.0 -67.2 -29.1 68.3 0.3 12.7 5 7 A D H >X S+ 0 0 85 -4,-1.2 4,-0.6 2,-0.2 3,-0.6 0.941 109.8 45.1 -66.1 -49.9 71.2 -2.0 14.0 6 8 A L H >< S+ 0 0 2 -4,-4.2 3,-0.5 1,-0.2 -2,-0.2 0.834 111.2 54.3 -61.0 -36.8 73.8 0.6 13.2 7 9 A R H 3< S+ 0 0 103 -4,-2.0 105,-0.3 -5,-0.3 -1,-0.2 0.736 113.3 41.8 -70.9 -24.6 71.7 3.4 14.7 8 10 A K H << S+ 0 0 88 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.381 92.8 101.8-106.4 3.1 71.4 1.5 18.0 9 11 A C S << S- 0 0 21 -4,-0.6 2,-0.4 -3,-0.5 81,-0.1 -0.386 84.9 -86.1 -85.4 165.2 75.0 0.1 18.5 10 12 A K - 0 0 76 79,-0.3 81,-2.8 -2,-0.1 2,-0.5 -0.601 47.6-177.9 -74.6 123.2 77.7 1.6 20.8 11 13 A I E +a 91 0A 0 -2,-0.4 103,-1.8 101,-0.2 104,-1.2 -0.988 5.0 175.9-127.2 117.2 79.5 4.4 19.1 12 14 A I E -ab 92 115A 0 79,-2.5 81,-3.2 -2,-0.5 2,-0.4 -0.981 14.5-156.4-120.2 129.2 82.4 6.1 20.8 13 15 A F E -ab 93 116A 0 102,-2.3 104,-3.2 -2,-0.4 2,-0.5 -0.908 9.0-163.2-101.5 137.7 84.5 8.8 19.1 14 16 A I E -ab 94 117A 0 79,-2.3 81,-3.2 -2,-0.4 2,-0.4 -0.986 8.2-177.7-127.6 123.2 88.0 9.3 20.6 15 17 A I E + b 0 118A 8 102,-3.0 104,-3.0 -2,-0.5 2,-0.3 -0.951 14.4 144.1-124.6 135.8 90.0 12.5 19.8 16 18 A G E - b 0 119A 8 -2,-0.4 104,-0.1 102,-0.2 3,-0.1 -0.956 42.3-105.4-171.7 147.0 93.5 13.3 20.9 17 19 A G > - 0 0 3 102,-0.7 3,-2.1 -2,-0.3 5,-0.4 -0.276 52.5 -78.2 -78.8 163.6 96.6 15.0 19.7 18 20 A P T 3 S+ 0 0 21 0, 0.0 112,-0.2 0, 0.0 -1,-0.1 -0.449 123.8 24.9 -62.2 132.8 99.8 13.3 18.5 19 21 A G T 3 S+ 0 0 18 -2,-0.1 110,-0.1 110,-0.1 -2,-0.1 0.392 89.5 110.3 90.3 -2.5 101.7 12.3 21.6 20 22 A S S < S- 0 0 4 -3,-2.1 -3,-0.0 101,-0.1 102,-0.0 0.749 90.1-115.2 -77.6 -23.0 98.5 12.2 23.8 21 23 A G S > S+ 0 0 28 -4,-0.3 4,-1.9 -5,-0.1 5,-0.2 0.536 71.5 138.0 101.4 14.4 98.7 8.4 24.0 22 24 A K H > + 0 0 38 -5,-0.4 4,-1.9 1,-0.2 5,-0.2 0.900 64.6 54.1 -62.5 -44.9 95.5 7.8 22.0 23 25 A G H > S+ 0 0 36 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.913 111.2 42.7 -57.1 -49.5 96.8 4.9 19.9 24 26 A T H > S+ 0 0 76 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.847 112.0 55.3 -71.6 -31.4 98.0 2.7 22.8 25 27 A Q H X S+ 0 0 2 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.867 104.4 54.5 -64.9 -36.0 94.9 3.5 24.8 26 28 A C H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.873 104.1 53.9 -66.3 -38.7 92.7 2.3 21.9 27 29 A E H X S+ 0 0 132 -4,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.863 112.0 45.6 -62.6 -39.5 94.5 -1.1 21.8 28 30 A K H X S+ 0 0 68 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.857 111.1 51.7 -72.1 -42.4 93.8 -1.6 25.5 29 31 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 6,-0.5 0.893 109.7 50.8 -58.6 -42.5 90.1 -0.5 25.2 30 32 A V H X>S+ 0 0 46 -4,-2.3 4,-2.2 1,-0.2 5,-0.5 0.964 112.2 46.8 -58.7 -50.9 89.6 -3.0 22.4 31 33 A E H <5S+ 0 0 108 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.845 118.7 39.8 -60.2 -41.1 91.1 -5.8 24.4 32 34 A K H <5S+ 0 0 113 -4,-2.1 -1,-0.2 1,-0.1 -2,-0.2 0.902 127.9 28.1 -77.4 -46.7 89.1 -5.0 27.6 33 35 A Y H <5S- 0 0 35 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.546 97.7-123.0 -94.8 -13.2 85.7 -4.1 26.1 34 36 A G T <5 + 0 0 32 -4,-2.2 55,-2.4 -5,-0.3 56,-0.4 0.882 56.8 156.6 63.5 38.4 85.7 -6.1 22.9 35 37 A F < - 0 0 10 -5,-0.5 2,-0.6 -6,-0.5 56,-0.2 -0.590 46.9-118.0 -86.1 158.8 85.1 -3.0 20.8 36 38 A T E -c 91 0A 28 54,-3.5 56,-2.8 -2,-0.2 2,-0.6 -0.886 25.6-143.4 -94.2 120.2 86.1 -2.7 17.2 37 39 A H E -c 92 0A 61 -2,-0.6 2,-0.4 54,-0.2 56,-0.2 -0.779 23.1-179.2 -85.9 116.8 88.7 0.0 16.7 38 40 A L E +c 93 0A 15 54,-2.8 56,-2.8 -2,-0.6 2,-0.3 -0.939 6.0 170.2-118.4 134.2 88.2 2.0 13.4 39 41 A S E > -c 94 0A 24 -2,-0.4 4,-2.6 54,-0.2 5,-0.2 -0.990 40.4-124.4-138.1 153.9 90.3 4.8 12.0 40 42 A T H > S+ 0 0 8 54,-0.6 4,-2.6 -2,-0.3 5,-0.2 0.904 111.3 53.8 -57.8 -46.9 90.4 6.6 8.7 41 43 A G H > S+ 0 0 11 218,-0.5 4,-2.8 1,-0.2 -1,-0.2 0.948 112.7 42.6 -54.5 -50.0 94.1 5.9 8.3 42 44 A E H > S+ 0 0 92 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.896 113.6 51.4 -69.0 -40.7 93.6 2.2 8.8 43 45 A L H X S+ 0 0 9 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.888 112.9 46.5 -58.7 -43.0 90.5 2.0 6.6 44 46 A L H X S+ 0 0 3 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.948 111.6 50.5 -65.4 -50.8 92.3 3.8 3.8 45 47 A R H X S+ 0 0 129 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.928 112.9 47.9 -50.6 -47.6 95.4 1.6 4.2 46 48 A E H X S+ 0 0 110 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.881 110.0 49.6 -65.6 -44.1 93.1 -1.5 4.0 47 49 A E H X>S+ 0 0 15 -4,-2.2 5,-0.6 2,-0.2 4,-0.5 0.920 112.3 49.5 -57.5 -46.0 91.1 -0.4 1.0 48 50 A L H ><5S+ 0 0 46 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.915 109.4 50.5 -61.8 -44.6 94.3 0.4 -0.9 49 51 A A H 3<5S+ 0 0 63 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.733 97.6 70.0 -64.3 -26.4 95.8 -3.1 -0.0 50 52 A S H 3<5S- 0 0 64 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.730 90.5-147.5 -64.1 -25.3 92.6 -4.7 -1.3 51 53 A E T <<5 + 0 0 135 -3,-1.2 280,-0.2 -4,-0.5 -3,-0.1 0.605 39.2 159.5 62.3 13.6 93.6 -3.7 -4.9 52 54 A S >< - 0 0 39 -5,-0.6 4,-0.6 1,-0.1 -1,-0.2 -0.185 55.0-116.0 -57.8 157.7 89.9 -3.4 -5.7 53 55 A E H >> S+ 0 0 16 1,-0.2 3,-0.9 2,-0.2 4,-0.5 0.868 119.0 56.6 -64.0 -37.0 89.0 -1.2 -8.7 54 56 A R H >> S+ 0 0 70 1,-0.2 3,-1.1 2,-0.2 4,-0.7 0.874 99.0 61.0 -59.7 -41.3 87.2 1.1 -6.3 55 57 A S H 3> S+ 0 0 6 1,-0.2 4,-2.0 -8,-0.2 -1,-0.2 0.742 90.2 69.8 -57.1 -27.4 90.5 1.5 -4.4 56 58 A K H <>S+ 0 0 13 -4,-1.8 5,-2.4 1,-0.2 3,-0.9 0.937 113.8 46.3 -62.9 -50.0 93.8 11.1 -5.0 62 64 A M H ><5S+ 0 0 31 -4,-2.8 3,-0.5 1,-0.3 -1,-0.2 0.751 103.2 62.5 -71.9 -25.8 96.4 10.2 -2.5 63 65 A E H 3<5S+ 0 0 94 -4,-1.9 -1,-0.3 1,-0.2 177,-0.2 0.700 107.4 45.2 -68.7 -23.9 99.3 10.1 -5.0 64 66 A R T <<5S- 0 0 39 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.451 115.6-118.1 -90.4 -5.4 98.6 13.8 -5.6 65 67 A G T < 5 + 0 0 1 -3,-0.5 199,-2.6 -4,-0.3 -3,-0.2 0.720 65.2 154.0 71.6 18.9 98.4 14.4 -1.9 66 68 A D < - 0 0 33 -5,-2.4 2,-0.3 197,-0.2 -1,-0.2 -0.291 51.2 -88.1 -78.6 166.4 94.8 15.5 -2.6 67 69 A L - 0 0 78 -3,-0.1 195,-0.2 196,-0.1 -1,-0.1 -0.543 33.3-130.5 -75.5 134.7 91.9 15.3 -0.1 68 70 A V - 0 0 2 193,-2.3 5,-0.1 -2,-0.3 195,-0.1 -0.768 34.8-111.8 -84.4 120.3 89.9 12.1 0.1 69 71 A P >> - 0 0 59 0, 0.0 4,-1.5 0, 0.0 3,-0.7 -0.177 17.7-123.6 -53.3 146.9 86.2 13.0 -0.1 70 72 A S H 3> S+ 0 0 34 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.802 108.3 61.4 -62.3 -34.8 84.2 12.5 3.0 71 73 A G H 3> S+ 0 0 46 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.828 103.2 50.6 -61.2 -34.4 81.7 10.2 1.2 72 74 A I H <> S+ 0 0 42 -3,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.935 112.3 45.6 -72.2 -45.1 84.5 7.8 0.4 73 75 A V H X S+ 0 0 0 -4,-1.5 4,-2.3 1,-0.2 -2,-0.2 0.915 113.6 49.9 -63.2 -44.9 85.7 7.6 4.0 74 76 A L H X S+ 0 0 16 -4,-2.8 4,-3.0 2,-0.2 5,-0.2 0.898 107.9 53.8 -59.6 -41.6 82.2 7.3 5.3 75 77 A E H X S+ 0 0 82 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.962 110.9 46.1 -58.3 -49.9 81.4 4.5 2.8 76 78 A L H X S+ 0 0 11 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.863 113.0 50.6 -62.2 -38.5 84.5 2.6 4.1 77 79 A L H X S+ 0 0 2 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.934 109.5 49.4 -61.9 -49.7 83.5 3.3 7.7 78 80 A K H X S+ 0 0 87 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.881 111.3 50.4 -59.2 -41.4 79.9 2.0 7.2 79 81 A E H X S+ 0 0 88 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.876 109.3 50.1 -64.9 -39.6 81.2 -1.1 5.5 80 82 A A H X S+ 0 0 18 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.877 114.0 46.0 -65.5 -37.9 83.7 -1.8 8.4 81 83 A M H X S+ 0 0 0 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.858 112.0 49.6 -74.0 -40.7 80.9 -1.4 10.9 82 84 A V H < S+ 0 0 41 -4,-2.5 3,-0.4 1,-0.2 -2,-0.2 0.925 111.0 51.0 -63.6 -44.4 78.4 -3.5 9.0 83 85 A A H < S+ 0 0 88 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.748 115.6 41.7 -64.5 -25.7 81.1 -6.3 8.6 84 86 A S H >< S+ 0 0 30 -4,-0.9 3,-2.0 -5,-0.1 -1,-0.2 0.595 85.1 115.2 -97.2 -15.6 81.8 -6.3 12.4 85 87 A L T 3< S+ 0 0 37 -4,-1.2 4,-0.1 -3,-0.4 -79,-0.0 -0.323 80.1 23.3 -56.7 131.0 78.2 -6.0 13.6 86 88 A G T 3 S+ 0 0 84 2,-0.4 -1,-0.3 -2,-0.0 -2,-0.1 0.251 120.1 58.8 93.0 -16.1 77.2 -9.1 15.5 87 89 A D S < S+ 0 0 95 -3,-2.0 2,-0.3 0, 0.0 -2,-0.2 -0.136 100.0 68.0-127.3 37.3 80.7 -10.1 16.5 88 90 A T - 0 0 35 1,-0.1 -2,-0.4 -52,-0.0 -53,-0.2 -0.990 62.5-148.4-148.2 154.6 81.5 -6.8 18.3 89 91 A R S S- 0 0 112 -55,-2.4 2,-0.3 1,-0.3 -79,-0.3 0.496 78.1 -35.3 -96.0 -7.0 80.4 -5.0 21.5 90 92 A G - 0 0 2 -56,-0.4 -54,-3.5 -81,-0.1 2,-0.5 -0.923 60.3 -92.4 163.5 168.2 80.9 -1.5 20.1 91 93 A F E -ac 11 36A 1 -81,-2.8 -79,-2.5 -2,-0.3 2,-0.6 -0.934 17.2-164.4-114.1 130.4 82.8 0.8 17.9 92 94 A L E -ac 12 37A 0 -56,-2.8 -54,-2.8 -2,-0.5 2,-0.7 -0.951 13.5-163.8-109.3 105.6 85.8 3.0 18.9 93 95 A I E > -ac 13 38A 1 -81,-3.2 -79,-2.3 -2,-0.6 3,-0.6 -0.838 11.7-150.6-100.8 112.8 86.2 5.5 16.1 94 96 A D E 3 -ac 14 39A 20 -56,-2.8 -54,-0.6 -2,-0.7 -79,-0.2 -0.670 66.6 -8.8-101.0 126.8 89.6 7.0 16.5 95 97 A G T 3 S+ 0 0 31 -81,-3.2 -1,-0.2 -2,-0.4 -80,-0.2 0.757 98.3 170.6 62.8 33.7 90.5 10.6 15.4 96 98 A Y < + 0 0 2 -3,-0.6 -1,-0.2 -82,-0.4 -82,-0.1 -0.965 36.3 25.6-138.8 146.6 87.1 11.0 13.6 97 99 A P - 0 0 6 0, 0.0 3,-0.1 0, 0.0 64,-0.1 0.700 56.7-163.2 -78.8 172.5 85.4 13.1 12.3 98 100 A R S S+ 0 0 22 1,-0.2 2,-0.3 162,-0.1 63,-0.1 0.504 76.7 18.6 -97.5 -12.7 87.9 15.8 11.1 99 101 A E S > S- 0 0 73 1,-0.1 4,-1.3 61,-0.1 -1,-0.2 -0.967 81.8-109.1-151.1 166.7 85.3 18.5 10.6 100 102 A V H > S+ 0 0 25 -2,-0.3 4,-2.7 1,-0.2 3,-0.2 0.895 111.9 53.5 -68.1 -47.6 81.7 19.1 11.8 101 103 A K H > S+ 0 0 70 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.858 107.8 54.4 -56.8 -33.8 79.7 18.6 8.6 102 104 A Q H > S+ 0 0 4 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.876 109.4 47.8 -68.2 -38.2 81.4 15.2 8.3 103 105 A G H X S+ 0 0 1 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.890 110.5 50.8 -65.7 -41.1 80.2 14.4 11.9 104 106 A E H X S+ 0 0 75 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.918 110.4 50.3 -60.4 -43.4 76.7 15.6 11.0 105 107 A E H X S+ 0 0 36 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.890 108.6 51.5 -61.9 -44.6 76.8 13.3 7.9 106 108 A F H X>S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 5,-1.7 0.911 109.2 52.3 -55.9 -41.9 77.9 10.3 10.0 107 109 A G H <5S+ 0 0 8 -4,-1.9 -2,-0.2 3,-0.2 -1,-0.2 0.862 114.6 40.4 -66.2 -39.7 75.0 11.0 12.4 108 110 A R H <5S+ 0 0 168 -4,-1.8 -1,-0.2 1,-0.1 -2,-0.2 0.886 123.8 37.4 -74.3 -42.5 72.4 11.0 9.7 109 111 A R H <5S+ 0 0 81 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.693 137.4 2.8 -88.6 -22.2 73.9 8.1 7.7 110 112 A I T <5S- 0 0 3 -4,-2.6 2,-0.3 -5,-0.3 -3,-0.2 0.609 109.1 -67.2-130.0 -67.0 75.1 5.7 10.4 111 113 A G < - 0 0 0 -5,-1.7 -1,-0.1 -103,-0.1 -2,-0.1 -0.953 40.1 -84.3 175.7 168.7 74.3 6.9 13.9 112 114 A D - 0 0 98 -105,-0.3 -101,-0.2 -2,-0.3 2,-0.1 -0.763 43.0-121.2 -91.3 126.4 74.9 9.3 16.8 113 115 A P - 0 0 5 0, 0.0 57,-0.2 0, 0.0 -101,-0.2 -0.429 12.5-155.0 -63.1 136.0 77.9 8.6 19.1 114 116 A Q S S+ 0 0 58 -103,-1.8 56,-0.6 1,-0.2 2,-0.3 0.682 80.2 26.4 -82.5 -16.0 76.8 8.2 22.7 115 117 A L E -bd 12 170A 0 -104,-1.2 -102,-2.3 54,-0.1 2,-0.5 -0.986 58.7-166.1-150.0 129.5 80.2 9.3 24.0 116 118 A V E -bd 13 171A 0 54,-2.6 56,-2.4 -2,-0.3 2,-0.5 -0.991 15.9-160.0-112.6 120.2 83.0 11.5 22.6 117 119 A I E -bd 14 172A 0 -104,-3.2 -102,-3.0 -2,-0.5 2,-0.5 -0.884 3.6-165.8-100.2 128.0 86.3 11.2 24.5 118 120 A C E -bd 15 173A 2 54,-2.7 56,-3.3 -2,-0.5 2,-1.1 -0.973 12.4-147.9-113.9 119.7 88.9 14.0 24.3 119 121 A M E -bd 16 174A 2 -104,-3.0 -102,-0.7 -2,-0.5 2,-0.4 -0.764 20.5-154.8 -89.4 97.9 92.4 13.2 25.4 120 122 A D E + d 0 175A 78 54,-2.7 56,-3.3 -2,-1.1 2,-0.3 -0.610 25.0 157.5 -78.6 131.1 93.5 16.6 26.7 121 123 A C - 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f 0 315B 9 -2,-0.3 104,-0.1 102,-0.2 3,-0.1 -0.833 43.6-100.0 176.4 150.8 97.2 12.1 -18.5 213 19 B G > - 0 0 7 102,-0.6 3,-2.1 -2,-0.3 5,-0.4 -0.179 55.4 -72.4 -78.7 174.3 94.3 10.1 -17.0 214 20 B P T 3 S+ 0 0 18 0, 0.0 -1,-0.2 0, 0.0 112,-0.1 -0.429 125.7 25.5 -66.5 135.7 94.4 6.5 -15.8 215 21 B G T 3 S+ 0 0 17 110,-0.1 110,-0.2 -2,-0.1 -2,-0.1 0.503 87.8 114.0 85.1 4.4 94.5 4.3 -18.9 216 22 B S S < S- 0 0 2 -3,-2.1 -3,-0.1 101,-0.1 106,-0.0 0.602 87.5-115.0 -79.6 -13.0 96.2 7.0 -21.1 217 23 B G S > S+ 0 0 30 -4,-0.2 4,-2.0 105,-0.1 5,-0.2 0.541 74.7 133.9 87.4 9.6 99.5 5.0 -21.4 218 24 B K H > + 0 0 36 -5,-0.4 4,-2.5 1,-0.2 5,-0.2 0.868 63.5 55.6 -60.0 -45.1 101.4 7.7 -19.5 219 25 B G H > S+ 0 0 40 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.955 112.4 41.2 -54.0 -53.1 103.3 5.2 -17.2 220 26 B T H > S+ 0 0 83 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.876 113.8 52.6 -66.5 -38.6 104.8 3.2 -20.1 221 27 B Q H X S+ 0 0 7 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.894 104.6 56.0 -68.1 -39.2 105.5 6.3 -22.2 222 28 B C H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.936 106.9 50.4 -54.8 -46.6 107.4 7.9 -19.3 223 29 B E H X S+ 0 0 127 -4,-1.7 4,-2.7 1,-0.2 -1,-0.2 0.898 110.4 49.8 -56.5 -39.7 109.7 4.8 -19.1 224 30 B K H X S+ 0 0 76 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.891 111.6 48.4 -68.5 -38.7 110.3 5.0 -22.8 225 31 B L H X>S+ 0 0 0 -4,-2.4 4,-3.3 2,-0.2 6,-0.5 0.870 110.7 50.5 -67.2 -41.8 111.2 8.7 -22.5 226 32 B V H X5S+ 0 0 47 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.950 112.0 48.3 -60.7 -47.0 113.5 8.0 -19.6 227 33 B E H <5S+ 0 0 161 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.908 120.1 37.3 -60.4 -44.4 115.2 5.3 -21.7 228 34 B K H <5S+ 0 0 115 -4,-2.5 -2,-0.2 -5,-0.1 -1,-0.2 0.939 130.9 24.3 -73.3 -48.9 115.5 7.6 -24.7 229 35 B Y H <5S- 0 0 45 -4,-3.3 -3,-0.2 -5,-0.2 -2,-0.2 0.652 92.3-126.7 -99.3 -16.6 116.3 11.0 -23.1 230 36 B G << + 0 0 34 -4,-2.2 55,-0.8 -5,-0.5 56,-0.3 0.653 49.1 167.3 76.1 19.1 117.8 10.0 -19.8 231 37 B F - 0 0 13 -6,-0.5 2,-0.7 54,-0.2 56,-0.2 -0.163 43.7-112.3 -64.4 156.5 115.4 12.2 -17.9 232 38 B T E -g 287 0B 29 54,-3.4 56,-3.1 45,-0.0 2,-0.7 -0.846 33.4-147.7 -87.5 114.8 114.9 12.2 -14.1 233 39 B H E +g 288 0B 71 -2,-0.7 2,-0.3 54,-0.2 56,-0.2 -0.787 24.8 172.8 -92.9 112.7 111.4 10.8 -13.7 234 40 B L E +g 289 0B 21 54,-2.6 56,-3.0 -2,-0.7 2,-0.3 -0.886 10.7 174.3-119.4 151.4 109.7 12.3 -10.7 235 41 B S > - 0 0 30 -2,-0.3 4,-2.0 54,-0.2 5,-0.2 -0.982 38.1-123.6-149.9 152.7 106.1 12.1 -9.3 236 42 B T H > S+ 0 0 9 54,-0.5 4,-3.0 -2,-0.3 5,-0.2 0.877 110.0 57.0 -65.6 -33.9 104.5 13.3 -6.1 237 43 B G H > S+ 0 0 19 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.888 110.3 42.7 -65.6 -40.5 103.3 9.8 -5.2 238 44 B E H > S+ 0 0 92 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.844 114.5 51.4 -71.8 -34.9 106.7 8.3 -5.3 239 45 B L H X S+ 0 0 10 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.894 111.8 47.2 -70.5 -40.0 108.1 11.4 -3.5 240 46 B L H X S+ 0 0 6 -4,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.861 111.7 51.1 -64.2 -38.0 105.5 11.0 -0.8 241 47 B R H X S+ 0 0 131 -4,-1.6 4,-1.6 -5,-0.2 -2,-0.2 0.947 111.5 46.7 -69.0 -44.0 106.2 7.3 -0.6 242 48 B E H < S+ 0 0 116 -4,-2.5 4,-0.3 2,-0.2 -1,-0.2 0.879 113.0 49.2 -62.6 -41.4 109.9 7.8 -0.1 243 49 B E H >< S+ 0 0 17 -4,-2.0 3,-1.5 1,-0.2 5,-0.4 0.905 108.2 53.5 -65.4 -44.9 109.4 10.5 2.5 244 50 B L H >< S+ 0 0 40 -4,-2.3 3,-0.7 1,-0.3 -1,-0.2 0.840 106.7 53.3 -59.5 -33.4 107.0 8.3 4.4 245 51 B A T 3< S+ 0 0 73 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.541 95.6 74.1 -75.5 -8.0 109.7 5.6 4.5 246 52 B S T < S- 0 0 53 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.2 0.545 86.6-137.7 -88.8 -12.2 112.2 8.0 6.0 247 53 B E < + 0 0 108 -3,-0.7 -112,-0.5 -4,-0.3 -3,-0.1 0.569 50.2 149.3 64.6 5.4 111.1 8.4 9.6 248 54 B S > - 0 0 27 -5,-0.4 4,-1.0 1,-0.1 3,-0.2 -0.247 63.1-113.8 -61.6 158.1 111.8 12.2 9.5 249 55 B E H > S+ 0 0 3 1,-0.2 4,-1.6 2,-0.2 3,-0.4 0.880 119.6 57.6 -60.0 -36.4 109.6 14.5 11.7 250 56 B R H > S+ 0 0 38 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.839 100.3 55.3 -63.2 -35.9 108.2 15.8 8.4 251 57 B S H > S+ 0 0 0 -3,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.773 105.8 54.0 -66.1 -26.7 107.1 12.4 7.3 252 58 B K H X S+ 0 0 39 -4,-1.0 4,-2.3 -3,-0.4 -2,-0.2 0.853 106.6 50.1 -76.0 -36.9 105.2 12.2 10.6 253 59 B L H X S+ 0 0 9 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.927 111.9 48.3 -58.6 -48.9 103.4 15.4 9.8 254 60 B I H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.875 112.0 49.7 -62.3 -39.1 102.5 14.1 6.4 255 61 B R H X S+ 0 0 93 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.892 106.1 54.8 -69.5 -39.7 101.3 10.9 7.9 256 62 B D H < S+ 0 0 23 -4,-2.3 4,-0.5 1,-0.2 -2,-0.2 0.943 114.9 42.8 -52.0 -46.8 99.1 12.7 10.5 257 63 B I H ><>S+ 0 0 12 -4,-2.1 5,-2.5 1,-0.2 3,-1.1 0.925 113.8 48.1 -66.3 -50.0 97.5 14.6 7.5 258 64 B M H ><5S+ 0 0 25 -4,-2.7 3,-1.3 1,-0.3 -1,-0.2 0.837 105.2 60.0 -66.5 -32.5 97.1 11.6 5.2 259 65 B E T 3<5S+ 0 0 92 -4,-2.2 -218,-0.5 1,-0.3 -1,-0.3 0.648 104.5 49.7 -69.4 -19.6 95.6 9.4 7.9 260 66 B R T < 5S- 0 0 37 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.432 117.7-115.7 -90.1 -3.1 92.8 12.0 8.3 261 67 B G T < 5 + 0 0 2 -3,-1.3 -193,-2.3 -4,-0.3 -3,-0.2 0.692 68.4 150.8 73.3 21.1 92.3 11.8 4.5 262 68 B D < - 0 0 45 -5,-2.5 -1,-0.2 -195,-0.2 2,-0.2 -0.412 53.3 -90.7 -91.6 161.2 93.4 15.5 4.5 263 69 B L - 0 0 80 -2,-0.1 -197,-0.2 -3,-0.1 -1,-0.1 -0.476 32.2-132.4 -68.0 132.1 95.1 17.5 1.8 264 70 B V - 0 0 0 -199,-2.6 5,-0.1 -2,-0.2 -1,-0.1 -0.782 38.6-106.9 -80.8 117.9 98.9 17.5 2.0 265 71 B P >> - 0 0 59 0, 0.0 4,-1.7 0, 0.0 3,-1.1 -0.096 17.9-122.9 -51.7 143.8 99.8 21.2 1.6 266 72 B S H 3> S+ 0 0 23 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.821 109.3 61.9 -50.9 -38.8 101.4 22.3 -1.7 267 73 B G H 3> S+ 0 0 34 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.796 103.1 47.8 -65.1 -31.8 104.4 23.6 0.1 268 74 B I H <> S+ 0 0 18 -3,-1.1 4,-2.1 2,-0.2 -1,-0.2 0.943 111.6 49.5 -74.0 -47.9 105.4 20.2 1.5 269 75 B V H X S+ 0 0 2 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.927 112.2 49.6 -52.5 -46.4 105.0 18.6 -1.8 270 76 B L H X S+ 0 0 15 -4,-2.6 4,-3.0 1,-0.2 -1,-0.2 0.845 106.1 55.4 -62.5 -39.9 107.2 21.3 -3.4 271 77 B E H X S+ 0 0 92 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.897 108.8 48.8 -56.2 -44.2 109.8 20.9 -0.7 272 78 B L H X S+ 0 0 8 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.893 113.2 46.8 -67.0 -38.5 110.0 17.2 -1.7 273 79 B L H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.929 111.1 50.6 -65.0 -49.9 110.3 18.1 -5.4 274 80 B K H X S+ 0 0 72 -4,-3.0 4,-3.4 1,-0.2 5,-0.2 0.937 111.4 49.1 -56.0 -47.5 112.9 20.7 -4.8 275 81 B E H X S+ 0 0 93 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.867 112.7 46.7 -60.3 -38.1 115.0 18.3 -2.8 276 82 B A H X S+ 0 0 16 -4,-1.5 4,-1.0 2,-0.2 -1,-0.2 0.915 115.6 46.5 -72.1 -39.4 114.7 15.5 -5.4 277 83 B M H X S+ 0 0 0 -4,-2.9 4,-1.2 2,-0.2 3,-0.5 0.916 112.6 48.7 -69.0 -45.2 115.6 18.0 -8.1 278 84 B V H < S+ 0 0 65 -4,-3.4 3,-0.5 1,-0.2 -1,-0.2 0.901 109.8 53.3 -60.0 -42.1 118.5 19.4 -6.2 279 85 B A H < S+ 0 0 79 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.750 112.7 45.0 -64.2 -24.3 119.8 15.9 -5.4 280 86 B S H < S+ 0 0 25 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.607 84.3 114.5 -98.4 -14.3 119.7 15.1 -9.2 281 87 B L S < S+ 0 0 44 -4,-1.2 2,-1.7 -3,-0.5 4,-0.1 -0.087 74.0 27.4 -54.5 157.6 121.3 18.2 -10.7 282 88 B G S S+ 0 0 80 2,-0.2 2,-1.1 1,-0.1 -1,-0.2 -0.568 121.2 54.1 86.3 -72.4 124.7 17.9 -12.4 283 89 B D S S+ 0 0 133 -2,-1.7 2,-0.4 -3,-0.1 -1,-0.1 -0.331 93.7 105.9 -87.0 53.4 124.1 14.2 -13.4 284 90 B T - 0 0 30 -2,-1.1 -2,-0.2 1,-0.1 -53,-0.1 -0.997 51.2-168.7-133.7 141.5 120.7 15.1 -15.1 285 91 B R S S- 0 0 90 -55,-0.8 2,-0.2 1,-0.4 -54,-0.2 0.385 76.6 -57.9 -98.9 0.4 119.6 15.4 -18.7 286 92 B G - 0 0 2 -56,-0.3 -54,-3.4 -81,-0.1 2,-0.5 -0.689 56.4 -84.1 139.0 167.5 116.3 17.0 -17.5 287 93 B F E -eg 207 232B 0 -81,-3.1 -79,-2.9 -56,-0.2 2,-0.6 -0.910 23.1-167.2-114.5 127.3 113.3 16.5 -15.3 288 94 B L E -eg 208 233B 0 -56,-3.1 -54,-2.6 -2,-0.5 2,-0.8 -0.945 11.8-164.0-111.1 104.8 110.1 14.7 -16.3 289 95 B I E > -eg 209 234B 0 -81,-3.3 -79,-2.3 -2,-0.6 3,-0.7 -0.811 9.7-154.6-101.0 110.3 107.5 15.5 -13.7 290 96 B D E 3 +e 210 0B 18 -56,-3.0 -54,-0.5 -2,-0.8 -79,-0.2 -0.679 68.2 0.7 -96.5 119.4 104.7 13.0 -14.0 291 97 B G T 3 S+ 0 0 28 -81,-3.5 -1,-0.2 -2,-0.5 -80,-0.2 0.680 96.5 173.2 84.9 21.5 101.1 13.8 -12.9 292 98 B Y < + 0 0 2 -3,-0.7 -1,-0.3 -82,-0.5 2,-0.1 -0.922 36.9 24.5-130.0 144.5 101.9 17.3 -11.8 293 99 B P - 0 0 7 0, 0.0 3,-0.1 0, 0.0 64,-0.1 0.643 52.4-164.5 -87.1 167.2 100.5 19.7 -10.9 294 100 B R S S+ 0 0 14 -230,-0.2 2,-0.3 1,-0.1 63,-0.2 0.668 79.3 14.5 -78.6 -20.9 97.2 18.7 -9.3 295 101 B E S > S- 0 0 61 1,-0.1 4,-1.7 61,-0.1 3,-0.4 -0.971 79.3-109.0-155.0 158.5 95.9 22.3 -9.4 296 102 B V H > S+ 0 0 39 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.879 114.1 53.8 -61.8 -44.6 96.7 25.6 -11.0 297 103 B K H > S+ 0 0 99 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.803 107.0 51.9 -63.5 -31.3 97.9 27.4 -7.9 298 104 B Q H > S+ 0 0 1 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.902 110.7 48.8 -70.5 -41.4 100.4 24.6 -7.2 299 105 B G H X S+ 0 0 3 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.899 110.3 50.9 -61.3 -43.1 101.7 25.0 -10.7 300 106 B E H X S+ 0 0 65 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.924 110.1 48.8 -60.1 -47.4 102.0 28.7 -10.3 301 107 B E H X S+ 0 0 50 -4,-2.0 4,-2.6 1,-0.2 5,-0.3 0.880 109.9 52.8 -61.4 -38.8 104.0 28.3 -7.0 302 108 B F H X>S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 5,-1.9 0.928 108.2 51.7 -58.4 -46.8 106.3 25.8 -8.8 303 109 B G H <5S+ 0 0 5 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.955 115.1 40.6 -54.0 -55.7 106.9 28.3 -11.5 304 110 B R H <5S+ 0 0 130 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.829 123.9 35.3 -60.8 -41.8 107.8 31.0 -8.9 305 111 B R H <5S+ 0 0 146 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.610 136.5 7.7 -97.8 -14.6 109.9 28.9 -6.5 306 112 B I T <5S- 0 0 2 -4,-2.1 2,-0.3 -5,-0.3 -3,-0.2 0.552 111.6 -68.0-129.3 -65.5 111.6 26.4 -8.8 307 113 B G < - 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