==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 20-SEP-10 3OWJ . COMPND 2 MOLECULE: CSNK2A1 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.-B.REISER,R.PRUDENT,C.COCHET . 328 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15692.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.9 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 . 1 0.3 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 . 32 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 26.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 3 1 0 0 0 0 2 0 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 1 2 0 1 1 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 . 1 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 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 0 105 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-120.1 -0.8 -22.4 29.8 2 4 A P - 0 0 74 0, 0.0 258,-0.2 0, 0.0 259,-0.1 -0.412 360.0-107.6 -71.8 148.0 -1.1 -19.6 27.2 3 5 A V - 0 0 52 256,-2.2 255,-0.0 -2,-0.1 256,-0.0 -0.567 42.9-114.3 -67.3 133.5 -2.7 -20.2 23.8 4 6 A P - 0 0 82 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.234 30.3-157.7 -68.2 160.7 0.1 -20.3 21.0 5 7 A S - 0 0 3 202,-0.1 178,-0.6 201,-0.0 2,-0.3 -0.995 9.4-169.1-143.3 147.8 0.3 -17.6 18.3 6 8 A R - 0 0 113 -2,-0.3 202,-0.1 176,-0.1 5,-0.1 -0.979 35.6-100.7-132.7 145.6 1.9 -17.4 14.8 7 9 A A - 0 0 3 -2,-0.3 4,-0.1 200,-0.1 301,-0.1 -0.352 25.8-139.8 -57.8 143.1 2.4 -14.5 12.5 8 10 A R S S+ 0 0 159 2,-0.1 2,-0.3 3,-0.1 -1,-0.1 0.582 85.5 40.0 -85.2 -9.0 -0.3 -14.4 9.9 9 11 A V S S+ 0 0 54 1,-0.1 200,-0.2 2,-0.1 -2,-0.1 -0.947 119.6 10.0-136.0 154.6 2.3 -13.4 7.2 10 12 A Y S > S+ 0 0 67 -2,-0.3 3,-0.6 1,-0.1 4,-0.3 0.841 77.1 155.1 45.8 43.4 5.9 -14.5 6.4 11 13 A T T 3 S+ 0 0 33 1,-0.2 3,-0.2 -4,-0.1 -4,-0.1 0.910 70.0 26.1 -69.4 -43.2 5.4 -17.3 9.0 12 14 A D T 3> S+ 0 0 75 1,-0.2 4,-1.7 2,-0.1 -1,-0.2 0.075 79.5 122.4-112.5 20.9 8.0 -19.7 7.7 13 15 A V T <4 S+ 0 0 31 -3,-0.6 -1,-0.2 1,-0.2 3,-0.1 0.905 84.3 38.7 -50.5 -46.8 10.4 -17.4 6.0 14 16 A N T >4 S+ 0 0 0 166,-0.5 3,-1.5 -4,-0.3 -1,-0.2 0.785 107.3 61.8 -77.3 -29.5 13.3 -18.6 8.1 15 17 A T T 34 S+ 0 0 74 1,-0.3 -1,-0.2 -4,-0.1 -2,-0.2 0.857 108.8 45.0 -65.9 -33.2 12.4 -22.3 8.2 16 18 A H T 3< S+ 0 0 154 -4,-1.7 -1,-0.3 -3,-0.1 -2,-0.2 0.042 100.7 90.7 -97.1 22.2 12.8 -22.4 4.4 17 19 A R S < S- 0 0 82 -3,-1.5 5,-0.1 -5,-0.1 -3,-0.0 -0.882 88.9 -92.5-116.9 148.3 16.1 -20.4 4.5 18 20 A P >> - 0 0 74 0, 0.0 3,-2.4 0, 0.0 4,-0.7 -0.284 37.8-110.3 -58.5 146.9 19.6 -21.9 4.8 19 21 A R H >> S+ 0 0 157 1,-0.3 4,-2.4 2,-0.2 3,-0.9 0.855 116.0 60.9 -37.6 -51.2 21.0 -22.3 8.3 20 22 A E H 34 S+ 0 0 124 1,-0.2 -1,-0.3 2,-0.2 6,-0.0 0.624 94.2 65.3 -61.9 -15.9 23.6 -19.6 7.7 21 23 A Y H <4 S+ 0 0 20 -3,-2.4 -1,-0.2 1,-0.1 -2,-0.2 0.909 120.9 14.0 -72.2 -44.5 20.8 -17.0 7.1 22 24 A W H << S+ 0 0 59 -3,-0.9 2,-2.0 -4,-0.7 3,-0.2 0.533 101.5 92.8-111.4 -13.6 19.4 -17.0 10.6 23 25 A D >< + 0 0 30 -4,-2.4 3,-1.4 -5,-0.2 4,-0.3 -0.510 46.3 163.8 -81.8 70.6 22.1 -18.8 12.6 24 26 A Y G > + 0 0 23 -2,-2.0 3,-1.1 1,-0.3 -1,-0.2 0.749 64.0 71.1 -62.8 -26.9 23.8 -15.5 13.6 25 27 A E G 3 S+ 0 0 113 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.800 102.5 44.1 -58.0 -30.4 25.8 -17.3 16.4 26 28 A S G < S+ 0 0 78 -3,-1.4 -1,-0.2 2,-0.1 -2,-0.2 0.451 86.0 120.9 -96.1 -3.8 27.8 -19.0 13.6 27 29 A H < - 0 0 26 -3,-1.1 2,-0.6 -4,-0.3 54,-0.1 -0.368 56.6-141.4 -63.1 135.1 28.4 -16.0 11.5 28 30 A V - 0 0 121 -2,-0.1 2,-0.1 49,-0.0 -1,-0.1 -0.909 18.9-127.4-102.5 119.9 32.0 -15.0 10.9 29 31 A V - 0 0 21 -2,-0.6 2,-0.6 1,-0.1 48,-0.0 -0.417 11.8-141.7 -66.4 133.3 32.6 -11.3 10.9 30 32 A E - 0 0 165 -2,-0.1 2,-0.4 69,-0.0 68,-0.2 -0.895 22.6-143.5 -96.5 118.2 34.5 -9.8 7.9 31 33 A W - 0 0 111 -2,-0.6 68,-0.2 66,-0.1 2,-0.1 -0.674 13.9-164.7 -91.7 132.4 36.8 -7.1 9.2 32 34 A G - 0 0 21 66,-3.5 2,-0.7 -2,-0.4 68,-0.4 -0.213 40.0 -75.1 -92.7-167.0 37.6 -3.9 7.3 33 35 A N > - 0 0 91 1,-0.1 3,-2.1 66,-0.1 4,-0.3 -0.829 29.4-161.2-101.5 110.0 40.4 -1.4 7.9 34 36 A Q G > S+ 0 0 82 -2,-0.7 3,-1.5 1,-0.3 -1,-0.1 0.773 89.6 67.2 -61.3 -24.7 40.0 0.8 11.0 35 37 A D G 3 S+ 0 0 98 1,-0.3 -1,-0.3 -3,-0.1 22,-0.1 0.625 83.2 74.5 -72.5 -13.0 42.5 3.3 9.6 36 38 A D G < S+ 0 0 41 -3,-2.1 21,-2.6 20,-0.1 22,-0.5 0.741 93.2 67.1 -62.3 -23.3 40.1 4.1 6.8 37 39 A Y E < -A 56 0A 29 -3,-1.5 2,-0.5 -4,-0.3 19,-0.2 -0.862 58.6-168.5-118.0 134.3 38.1 6.1 9.4 38 40 A Q E -A 55 0A 115 17,-2.4 17,-1.9 -2,-0.4 2,-0.1 -0.962 25.3-131.0-119.2 112.9 38.8 9.3 11.4 39 41 A L E +A 54 0A 76 -2,-0.5 15,-0.3 15,-0.2 3,-0.1 -0.371 27.8 175.0 -60.3 134.0 36.4 10.1 14.2 40 42 A V E - 0 0 84 13,-3.1 2,-0.3 1,-0.4 14,-0.2 0.796 58.5 -9.5-110.2 -55.7 35.2 13.8 14.1 41 43 A R E -A 53 0A 147 12,-1.6 12,-3.5 0, 0.0 2,-0.4 -0.995 63.2-111.1-150.7 147.7 32.6 14.2 16.8 42 44 A K E -A 52 0A 123 -2,-0.3 10,-0.3 10,-0.3 3,-0.1 -0.640 29.5-180.0 -74.8 124.3 30.6 12.2 19.3 43 45 A L E - 0 0 78 8,-2.7 2,-0.3 -2,-0.4 9,-0.2 0.753 56.6 -34.0 -96.7 -31.4 26.9 12.3 18.4 44 46 A G E -A 51 0A 31 7,-1.8 7,-3.3 2,-0.0 2,-0.4 -0.991 43.4-127.7-177.8 170.4 25.5 10.1 21.2 45 47 A R E -A 50 0A 174 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.984 21.2-177.7-135.1 142.3 25.7 7.3 23.6 46 48 A G - 0 0 36 3,-3.4 -2,-0.0 -2,-0.4 5,-0.0 -0.594 47.5 -90.0-120.9-170.2 23.3 4.5 24.2 47 49 A K S S+ 0 0 157 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.739 126.6 26.5 -75.1 -23.0 23.2 1.6 26.7 48 50 A Y S S+ 0 0 96 1,-0.2 21,-2.1 22,-0.1 2,-0.3 0.395 124.6 24.0-122.1 2.0 25.1 -0.6 24.3 49 51 A S E - B 0 68A 11 19,-0.2 -3,-3.4 20,-0.1 2,-0.4 -0.998 55.1-131.7-159.9 160.0 27.1 1.8 22.1 50 52 A E E -AB 45 67A 43 17,-2.1 17,-3.0 -2,-0.3 2,-0.4 -0.977 30.0-149.8-112.2 136.9 28.8 5.1 21.6 51 53 A V E -AB 44 66A 36 -7,-3.3 -8,-2.7 -2,-0.4 -7,-1.8 -0.909 15.5-177.2-116.4 130.2 28.0 6.8 18.2 52 54 A F E -AB 42 65A 28 13,-2.8 13,-3.1 -2,-0.4 2,-0.4 -0.934 27.8-129.4-125.0 144.1 30.4 9.1 16.4 53 55 A E E +AB 41 64A 16 -12,-3.5 -13,-3.1 -2,-0.4 -12,-1.6 -0.778 45.3 168.0 -79.6 136.5 30.3 11.2 13.2 54 56 A A E -AB 39 63A 1 9,-3.0 9,-3.0 -2,-0.4 2,-0.4 -0.860 33.0-119.6-142.2 176.1 33.4 10.3 11.2 55 57 A I E -AB 38 62A 28 -17,-1.9 -17,-2.4 -2,-0.3 2,-0.9 -0.979 16.8-135.2-122.9 134.8 35.1 10.7 7.8 56 58 A N E >>> -AB 37 61A 18 5,-3.1 4,-2.1 -2,-0.4 3,-1.4 -0.836 18.6-162.5 -86.0 106.4 36.1 7.9 5.5 57 59 A I T 345S+ 0 0 88 -21,-2.6 -1,-0.1 -2,-0.9 -20,-0.1 0.553 81.8 66.6 -71.5 -9.0 39.5 9.1 4.5 58 60 A T T 345S+ 0 0 102 -22,-0.5 -1,-0.3 1,-0.1 -21,-0.1 0.655 125.9 6.8 -85.7 -17.3 39.6 6.8 1.5 59 61 A N T <45S- 0 0 78 -3,-1.4 -2,-0.2 2,-0.1 -1,-0.1 0.364 96.7-117.7-141.0 -3.7 36.8 8.6 -0.3 60 62 A N T <5 + 0 0 118 -4,-2.1 2,-0.3 1,-0.2 -3,-0.2 0.663 62.1 150.0 61.8 22.8 36.2 11.7 1.9 61 63 A E E < -B 56 0A 124 -5,-0.7 -5,-3.1 1,-0.0 -1,-0.2 -0.664 50.5-118.1 -85.4 137.3 32.6 10.6 2.6 62 64 A K E +B 55 0A 124 -2,-0.3 51,-0.8 -7,-0.2 2,-0.3 -0.527 43.6 176.9 -69.7 140.6 31.0 11.5 5.9 63 65 A V E -BC 54 112A 9 -9,-3.0 -9,-3.0 -2,-0.2 2,-0.5 -0.885 29.1-122.2-144.7 165.0 30.1 8.4 7.9 64 66 A V E -BC 53 111A 24 47,-2.3 47,-2.7 -2,-0.3 2,-0.6 -0.976 19.9-158.3-119.9 130.0 28.7 7.2 11.2 65 67 A V E -BC 52 110A 5 -13,-3.1 -13,-2.8 -2,-0.5 2,-0.8 -0.927 3.5-167.1-113.8 117.3 30.6 5.0 13.6 66 68 A K E -BC 51 109A 13 43,-3.3 43,-2.8 -2,-0.6 2,-0.8 -0.889 7.9-160.0-104.9 105.0 28.8 2.9 16.2 67 69 A I E -BC 50 108A 15 -17,-3.0 -17,-2.1 -2,-0.8 41,-0.2 -0.792 17.3-143.4 -90.0 111.4 31.2 1.5 18.7 68 70 A L E +B 49 0A 6 39,-2.0 -19,-0.2 -2,-0.8 38,-0.1 -0.252 30.5 166.3 -77.2 159.0 29.6 -1.5 20.5 69 71 A K + 0 0 95 -21,-2.1 -20,-0.1 37,-0.1 -1,-0.1 0.093 18.7 161.0-157.7 33.2 29.9 -2.5 24.1 70 72 A P - 0 0 13 0, 0.0 -22,-0.1 0, 0.0 6,-0.1 -0.243 38.8-143.7 -77.4 153.6 27.2 -5.1 25.1 71 73 A V S S+ 0 0 127 1,-0.1 2,-0.7 2,-0.0 -23,-0.0 0.874 95.9 61.7 -75.9 -40.8 27.2 -7.5 28.1 72 74 A K S > S- 0 0 141 1,-0.1 3,-0.7 2,-0.0 4,-0.3 -0.816 77.0-164.2 -83.4 113.4 25.5 -10.3 26.0 73 75 A K T >> S+ 0 0 147 -2,-0.7 3,-1.8 1,-0.2 4,-0.7 0.827 77.7 66.0 -74.8 -34.0 28.1 -10.9 23.3 74 76 A K H 3> S+ 0 0 113 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.679 87.9 74.4 -62.8 -17.3 26.0 -12.9 20.8 75 77 A K H <> S+ 0 0 27 -3,-0.7 4,-2.5 2,-0.2 -1,-0.3 0.801 87.8 60.1 -63.2 -33.9 24.0 -9.7 20.3 76 78 A I H <> S+ 0 0 24 -3,-1.8 4,-2.3 -4,-0.3 -1,-0.2 0.951 108.9 41.9 -56.8 -51.2 26.9 -8.2 18.3 77 79 A K H X S+ 0 0 66 -4,-0.7 4,-2.4 1,-0.2 -2,-0.2 0.796 111.0 57.9 -70.6 -29.5 26.7 -11.0 15.8 78 80 A R H X S+ 0 0 27 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.958 110.0 42.3 -62.6 -52.1 22.9 -10.7 15.8 79 81 A E H X S+ 0 0 11 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.923 115.5 50.1 -62.8 -44.0 22.9 -7.1 14.8 80 82 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.925 112.6 46.1 -59.3 -46.2 25.7 -7.6 12.2 81 83 A K H X S+ 0 0 27 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.931 113.3 49.3 -66.2 -44.7 23.9 -10.6 10.6 82 84 A I H X S+ 0 0 0 -4,-2.5 4,-1.8 -5,-0.2 -2,-0.2 0.943 111.8 48.8 -56.7 -50.0 20.6 -8.7 10.5 83 85 A L H X S+ 0 0 0 -4,-2.7 4,-0.8 1,-0.2 12,-0.3 0.883 113.0 47.4 -59.5 -41.2 22.2 -5.6 8.9 84 86 A E H >< S+ 0 0 46 -4,-2.3 3,-0.5 1,-0.2 -1,-0.2 0.914 111.1 51.6 -67.5 -42.3 24.0 -7.7 6.3 85 87 A N H 3< S+ 0 0 24 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.822 116.5 39.9 -58.5 -35.0 20.8 -9.6 5.5 86 88 A L H >< S+ 0 0 0 -4,-1.8 3,-2.2 -5,-0.2 -1,-0.2 0.454 82.1 131.9 -99.8 -4.9 18.8 -6.4 5.0 87 89 A R T << S+ 0 0 111 -4,-0.8 7,-0.1 -3,-0.5 6,-0.1 -0.210 75.4 18.3 -52.8 133.6 21.5 -4.3 3.2 88 90 A G T 3 S+ 0 0 69 4,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.350 92.5 133.9 81.7 -7.0 20.1 -2.6 0.0 89 91 A G S X S- 0 0 7 -3,-2.2 3,-1.7 1,-0.1 -1,-0.3 -0.393 72.2 -76.8 -68.3 152.4 16.5 -3.0 1.2 90 92 A P T 3 S- 0 0 59 0, 0.0 54,-0.2 0, 0.0 -1,-0.1 -0.333 108.9 -10.9 -60.9 125.1 14.3 0.0 0.9 91 93 A N T 3 S+ 0 0 18 1,-0.2 80,-2.9 -2,-0.1 2,-0.5 0.656 97.4 134.4 62.9 21.1 14.9 2.7 3.6 92 94 A I B < -e 171 0B 1 -3,-1.7 -4,-0.3 78,-0.2 -1,-0.2 -0.873 65.8-106.5 -97.4 130.3 17.1 0.3 5.7 93 95 A I - 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0 0 2 -4,-1.7 4,-0.7 -5,-0.4 27,-0.2 0.147 11.7-100.2 91.7 151.9 -11.0 0.5 26.8 249 251 A T H > S+ 0 0 4 25,-2.4 4,-2.5 2,-0.2 5,-0.2 0.762 112.1 65.7 -77.3 -26.3 -10.7 -2.3 29.3 250 252 A E H > S+ 0 0 154 24,-0.7 4,-2.2 1,-0.2 -1,-0.2 0.940 103.9 44.6 -66.2 -43.2 -13.3 -4.6 27.7 251 253 A D H > S+ 0 0 68 -4,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.802 111.4 56.4 -67.4 -28.2 -11.2 -5.2 24.5 252 254 A L H X S+ 0 0 0 -4,-0.7 4,-2.5 2,-0.2 5,-0.3 0.952 109.0 44.4 -66.4 -48.8 -8.2 -5.7 26.8 253 255 A Y H X S+ 0 0 92 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.891 111.6 53.6 -63.5 -39.0 -9.9 -8.5 28.7 254 256 A D H X S+ 0 0 105 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.910 110.2 49.2 -57.9 -42.5 -11.1 -10.0 25.4 255 257 A Y H X S+ 0 0 7 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.949 113.9 41.9 -61.9 -54.9 -7.5 -10.0 24.2 256 258 A I H <>S+ 0 0 5 -4,-2.5 5,-3.4 1,-0.2 4,-0.2 0.857 114.0 54.1 -67.2 -32.4 -5.9 -11.6 27.2 257 259 A D H ><5S+ 0 0 93 -4,-2.4 3,-1.1 -5,-0.3 -1,-0.2 0.898 102.6 57.5 -64.6 -42.9 -8.8 -14.1 27.4 258 260 A K H 3<5S+ 0 0 94 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.871 116.5 34.7 -53.5 -40.8 -8.2 -15.1 23.8 259 261 A Y T 3<5S- 0 0 1 -4,-1.4 -256,-2.2 -5,-0.1 -1,-0.3 0.333 110.6-120.1 -99.0 8.1 -4.7 -16.1 24.6 260 262 A N T < 5 + 0 0 107 -3,-1.1 2,-0.4 -4,-0.2 -3,-0.2 0.897 57.9 160.1 51.3 42.1 -5.5 -17.3 28.1 261 263 A I < - 0 0 18 -5,-3.4 2,-0.5 -6,-0.1 -1,-0.2 -0.771 33.0-143.9 -90.7 139.2 -3.1 -14.7 29.5 262 264 A E - 0 0 173 -2,-0.4 2,-0.1 -60,-0.1 -5,-0.0 -0.927 17.4-125.9-105.0 124.8 -3.5 -13.7 33.1 263 265 A L - 0 0 19 -2,-0.5 -61,-0.1 1,-0.1 5,-0.1 -0.384 35.2 -94.3 -62.7 144.5 -2.8 -10.1 34.0 264 266 A D > - 0 0 56 1,-0.1 3,-2.3 -2,-0.1 4,-0.2 -0.439 34.7-127.3 -50.9 126.1 -0.3 -9.3 36.7 265 267 A P G > S+ 0 0 83 0, 0.0 3,-1.7 0, 0.0 4,-0.3 0.675 103.7 81.1 -58.7 -18.1 -2.5 -9.0 39.9 266 268 A R G > S+ 0 0 127 1,-0.3 3,-0.8 2,-0.2 4,-0.3 0.773 82.9 63.6 -54.0 -29.0 -0.8 -5.6 40.4 267 269 A F G X> S+ 0 0 3 -3,-2.3 4,-2.8 1,-0.2 3,-0.8 0.674 79.2 82.6 -71.5 -18.4 -3.3 -4.3 37.8 268 270 A N G <4 S+ 0 0 121 -3,-1.7 4,-0.3 1,-0.2 -1,-0.2 0.835 99.6 37.6 -54.7 -35.2 -6.3 -5.1 40.1 269 271 A D G <4 S+ 0 0 156 -3,-0.8 -1,-0.2 -4,-0.3 -2,-0.2 0.540 127.6 31.4 -94.5 -11.1 -5.7 -1.8 42.0 270 272 A I T <4 S+ 0 0 80 -3,-0.8 -2,-0.2 -4,-0.3 -3,-0.1 0.635 102.1 67.6-123.0 -22.6 -4.7 0.4 39.1 271 273 A L < + 0 0 2 -4,-2.8 -3,-0.1 1,-0.1 -2,-0.1 0.936 67.3 169.1 -72.5 -48.7 -6.5 -0.7 35.8 272 274 A G - 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0 0 82 -2,-0.3 4,-2.0 -59,-0.0 3,-1.3 -0.892 57.8 -82.7-148.7 179.6 -8.8 19.8 18.3 285 287 A S T 34 S+ 0 0 78 -2,-0.3 4,-0.2 1,-0.3 -2,-0.0 0.768 123.7 52.3 -62.5 -24.4 -8.3 23.1 16.5 286 288 A E T 34 S+ 0 0 126 1,-0.1 -1,-0.3 2,-0.1 -3,-0.0 0.647 121.1 28.0 -87.3 -17.4 -4.5 22.7 16.5 287 289 A N T X> S+ 0 0 0 -3,-1.3 3,-2.5 2,-0.1 4,-0.6 0.495 88.6 100.8-117.2 -5.2 -4.3 19.2 15.0 288 290 A Q G >< S+ 0 0 116 -4,-2.0 3,-0.8 1,-0.3 -3,-0.1 0.755 75.5 62.7 -56.1 -29.6 -7.5 19.1 12.9 289 291 A H G 34 S+ 0 0 102 1,-0.2 -1,-0.3 -4,-0.2 -161,-0.2 0.659 105.1 48.5 -69.7 -15.6 -5.5 19.8 9.6 290 292 A L G <4 S+ 0 0 0 -3,-2.5 2,-0.3 -66,-0.3 -1,-0.2 0.541 99.7 83.1 -98.5 -11.8 -3.6 16.6 10.2 291 293 A V << + 0 0 27 -3,-0.8 3,-0.1 -4,-0.6 -163,-0.0 -0.723 48.1 154.4-101.2 141.8 -6.7 14.5 10.8 292 294 A S > - 0 0 17 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.943 56.4-100.7-151.8 164.6 -9.0 12.9 8.2 293 295 A P H > S+ 0 0 105 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.877 124.3 51.7 -56.4 -39.0 -11.4 9.9 8.0 294 296 A E H > S+ 0 0 80 2,-0.2 4,-2.4 1,-0.2 27,-0.3 0.904 108.4 51.0 -64.5 -42.6 -8.6 7.9 6.2 295 297 A A H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.912 112.2 46.4 -60.7 -44.8 -6.1 8.8 8.9 296 298 A L H X S+ 0 0 17 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.887 112.2 48.9 -68.9 -38.8 -8.4 7.7 11.7 297 299 A D H X S+ 0 0 63 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.917 113.2 48.6 -66.4 -41.3 -9.4 4.4 10.0 298 300 A F H X S+ 0 0 0 -4,-2.4 4,-0.7 1,-0.2 3,-0.5 0.947 113.4 46.0 -62.0 -50.3 -5.7 3.7 9.4 299 301 A L H >X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 3,-1.1 0.896 108.4 57.2 -58.3 -43.6 -4.7 4.4 12.9 300 302 A D H 3< S+ 0 0 41 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.828 105.5 51.1 -56.4 -34.5 -7.6 2.4 14.3 301 303 A K H 3< S+ 0 0 60 -4,-1.4 10,-1.9 -3,-0.5 -1,-0.2 0.569 113.5 44.8 -84.7 -9.6 -6.4 -0.7 12.4 302 304 A L H << S+ 0 0 0 -3,-1.1 2,-1.7 -4,-0.7 -2,-0.2 0.833 103.5 62.3 -93.6 -45.9 -2.9 -0.4 13.8 303 305 A L S < S+ 0 0 0 -4,-2.6 2,-0.4 -5,-0.1 -1,-0.2 -0.557 72.2 131.4 -88.5 74.1 -3.7 0.3 17.5 304 306 A R - 0 0 71 -2,-1.7 6,-0.1 -3,-0.2 5,-0.1 -0.976 57.9-136.1-123.0 137.4 -5.5 -2.9 18.3 305 307 A Y S S+ 0 0 6 -2,-0.4 2,-0.8 -107,-0.1 -106,-0.2 0.931 90.6 77.6 -54.4 -51.4 -4.7 -5.1 21.4 306 308 A D S >> S- 0 0 22 1,-0.2 3,-1.8 -3,-0.1 4,-0.7 -0.518 70.3-158.3 -69.7 107.1 -4.8 -8.3 19.4 307 309 A H G >4 S+ 0 0 2 -2,-0.8 3,-0.7 1,-0.3 -1,-0.2 0.836 91.8 59.1 -56.4 -32.1 -1.5 -8.4 17.6 308 310 A Q G 34 S+ 0 0 37 1,-0.2 -1,-0.3 -301,-0.1 -2,-0.1 0.734 101.8 54.0 -68.5 -22.0 -3.0 -10.8 15.1 309 311 A S G <4 S+ 0 0 53 -3,-1.8 -1,-0.2 2,-0.1 -2,-0.2 0.582 85.1 105.8 -91.2 -12.5 -5.7 -8.3 14.1 310 312 A R S << S- 0 0 4 -3,-0.7 -8,-0.2 -4,-0.7 -9,-0.1 -0.317 82.5 -96.9 -67.3 148.5 -3.4 -5.4 13.3 311 313 A L - 0 0 23 -10,-1.9 2,-0.1 -13,-0.2 -1,-0.1 -0.391 39.2-127.5 -54.7 138.5 -2.7 -4.4 9.7 312 314 A T > - 0 0 30 1,-0.1 4,-2.5 -3,-0.1 5,-0.2 -0.439 28.4-103.1 -78.3 168.4 0.5 -6.0 8.3 313 315 A A H > S+ 0 0 1 1,-0.2 4,-1.6 2,-0.2 -170,-0.1 0.916 123.5 49.0 -60.7 -42.9 3.0 -3.6 6.7 314 316 A R H > S+ 0 0 144 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.925 111.8 47.7 -63.9 -46.4 1.9 -4.7 3.3 315 317 A E H >4 S+ 0 0 89 1,-0.2 3,-0.8 2,-0.2 4,-0.4 0.870 106.9 58.1 -60.7 -38.2 -1.8 -4.2 4.0 316 318 A A H >< S+ 0 0 0 -4,-2.5 3,-1.6 1,-0.3 -1,-0.2 0.904 100.6 55.8 -61.6 -37.8 -1.0 -0.8 5.5 317 319 A M H 3< S+ 0 0 33 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.717 102.7 58.1 -65.2 -22.2 0.5 0.3 2.2 318 320 A E T << S+ 0 0 132 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.579 84.2 118.9 -78.5 -14.2 -2.8 -0.6 0.5 319 321 A H S X S- 0 0 13 -3,-1.6 3,-2.4 -4,-0.4 4,-0.2 -0.230 74.3-123.3 -66.0 142.9 -4.8 1.8 2.8 320 322 A P G > S+ 0 0 49 0, 0.0 3,-1.9 0, 0.0 4,-0.4 0.760 105.1 77.1 -51.4 -28.7 -6.8 4.7 1.4 321 323 A Y G 3 S+ 0 0 0 -27,-0.3 3,-0.3 1,-0.3 4,-0.1 0.756 95.1 49.4 -50.8 -27.6 -4.7 7.0 3.6 322 324 A F G X S+ 0 0 1 -3,-2.4 3,-0.8 -6,-0.2 -1,-0.3 0.422 80.9 94.5 -98.6 1.3 -1.9 6.7 1.1 323 325 A Y T < S+ 0 0 170 -3,-1.9 -1,-0.2 1,-0.2 -2,-0.1 0.851 83.8 53.3 -60.7 -37.9 -3.9 7.4 -2.1 324 326 A T T 3 S+ 0 0 79 -4,-0.4 2,-0.3 -3,-0.3 -1,-0.2 0.711 89.3 97.2 -70.7 -21.3 -2.9 11.1 -2.0 325 327 A V S < S- 0 0 6 -3,-0.8 2,-0.3 -4,-0.1 -195,-0.0 -0.554 82.7-119.1 -76.9 127.3 0.8 10.3 -1.8 326 328 A V - 0 0 102 -2,-0.3 2,-0.8 1,-0.1 -1,-0.1 -0.512 25.0-136.5 -65.9 121.0 2.7 10.3 -5.2 327 329 A K 0 0 97 -2,-0.3 -1,-0.1 -4,-0.1 -4,-0.0 -0.758 360.0 360.0 -88.3 109.8 4.0 6.8 -5.9 328 330 A D 0 0 173 -2,-0.8 -1,-0.1 0, 0.0 0, 0.0 0.036 360.0 360.0 -42.6 360.0 7.6 7.2 -7.2