==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 22-AUG-03 1Q8W . COMPND 2 MOLECULE: CAMP-DEPENDENT PROTEIN KINASE, ALPHA-CATALYTIC . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR C.BREITENLECHNER,M.GASSEL,H.HIDAKA,V.KINZEL,R.HUBER, . 357 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17482.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 222 62.2 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 . 46 12.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 21 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.4 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 1 2 1 1 1 0 2 0 0 1 0 0 2 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 . 3 1 1 0 1 0 3 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 . 1 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 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 14 A S 0 0 127 0, 0.0 4,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -21.9 3.4 9.3 26.9 2 15 A V > + 0 0 73 2,-0.1 4,-2.0 3,-0.1 5,-0.1 0.715 360.0 54.5 -88.4 -34.0 7.0 10.4 26.2 3 16 A K H > S+ 0 0 143 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.794 107.4 49.6 -69.4 -29.2 7.9 6.7 26.0 4 17 A E H > S+ 0 0 142 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.874 108.5 53.3 -73.6 -39.1 5.2 6.1 23.3 5 18 A F H > S+ 0 0 78 -4,-0.4 4,-1.9 1,-0.2 -2,-0.2 0.919 111.8 45.7 -59.0 -43.9 6.4 9.0 21.3 6 19 A L H X S+ 0 0 12 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.857 110.6 51.3 -69.8 -38.5 9.9 7.5 21.3 7 20 A A H X S+ 0 0 61 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.874 115.5 43.6 -67.6 -35.1 8.7 4.0 20.5 8 21 A K H X S+ 0 0 115 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.775 113.9 50.5 -74.9 -30.7 6.8 5.6 17.5 9 22 A A H X S+ 0 0 11 -4,-1.9 4,-1.7 -5,-0.2 -2,-0.2 0.849 108.9 53.8 -73.9 -31.4 9.8 7.8 16.7 10 23 A K H X S+ 0 0 84 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.895 108.4 46.7 -69.8 -42.0 12.0 4.6 16.8 11 24 A E H X S+ 0 0 94 -4,-1.5 4,-1.6 1,-0.2 -1,-0.2 0.854 112.0 52.3 -71.2 -37.2 9.9 2.7 14.3 12 25 A D H X S+ 0 0 67 -4,-1.3 4,-1.6 1,-0.2 -1,-0.2 0.875 111.0 47.4 -60.6 -41.9 9.8 5.7 11.9 13 26 A F H X S+ 0 0 2 -4,-1.7 4,-0.7 1,-0.2 -2,-0.2 0.860 109.1 53.2 -74.6 -32.2 13.6 6.0 12.0 14 27 A L H X S+ 0 0 70 -4,-1.8 4,-1.0 2,-0.2 -1,-0.2 0.848 107.7 49.9 -75.6 -34.7 14.2 2.3 11.4 15 28 A K H >X S+ 0 0 135 -4,-1.6 4,-2.7 1,-0.2 3,-0.8 0.954 113.2 45.7 -62.6 -51.6 12.0 2.2 8.3 16 29 A K H 3< S+ 0 0 104 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.607 109.0 58.9 -69.5 -11.9 13.8 5.3 6.7 17 30 A W H 3< S+ 0 0 32 -4,-0.7 -1,-0.2 67,-0.1 -2,-0.2 0.760 114.9 32.9 -85.3 -30.0 17.2 3.8 7.7 18 31 A E H << S+ 0 0 160 -4,-1.0 -2,-0.2 -3,-0.8 -3,-0.1 0.817 129.9 34.5 -95.0 -42.1 16.7 0.6 5.6 19 32 A N S < S+ 0 0 137 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.1 -0.808 88.6 145.9-115.1 86.1 14.6 2.1 2.7 20 33 A P - 0 0 66 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 0.355 41.9 -71.2 -94.1-149.3 15.9 5.7 2.2 21 34 A A + 0 0 49 -5,-0.1 2,-0.2 59,-0.0 62,-0.1 -0.996 32.6 175.3-132.8 142.1 16.6 8.4 -0.7 22 35 A Q - 0 0 129 -2,-0.2 75,-0.1 315,-0.1 315,-0.1 -0.924 63.3 -1.0-133.4 148.4 19.2 8.9 -3.8 23 36 A N + 0 0 114 -2,-0.2 74,-0.2 1,-0.2 -1,-0.1 0.688 66.6 155.6 34.1 42.8 19.7 11.7 -7.0 24 37 A T + 0 0 66 72,-1.3 2,-0.2 2,-0.0 73,-0.2 0.486 63.3 10.5 -66.0 -2.2 16.6 13.7 -5.9 25 38 A A - 0 0 8 71,-0.6 2,-0.3 73,-0.1 73,-0.2 -0.885 66.2-127.0-156.9-167.9 18.2 16.9 -7.7 26 39 A H > - 0 0 94 -2,-0.2 3,-1.2 71,-0.1 4,-0.1 -0.985 26.8-116.4-151.5 152.8 20.9 18.3 -10.0 27 40 A L G > S+ 0 0 19 -2,-0.3 3,-1.9 1,-0.2 -1,-0.1 0.857 107.8 58.9 -68.6 -38.0 23.4 21.1 -9.7 28 41 A D G 3 S+ 0 0 120 1,-0.3 -1,-0.2 3,-0.0 22,-0.1 0.591 89.5 76.1 -71.0 -4.0 22.1 23.5 -12.5 29 42 A Q G < S+ 0 0 78 -3,-1.2 21,-1.9 21,-0.1 22,-0.5 0.554 95.1 65.0 -70.4 -7.8 18.8 23.6 -10.7 30 43 A F E < -A 49 0A 6 -3,-1.9 2,-0.6 19,-0.2 19,-0.2 -0.955 69.6-143.8-128.5 135.5 20.6 26.0 -8.2 31 44 A E E -A 48 0A 95 17,-2.7 17,-2.5 -2,-0.4 2,-0.5 -0.835 25.3-138.3 -86.6 121.8 22.1 29.4 -8.2 32 45 A R E +A 47 0A 107 -2,-0.6 15,-0.2 15,-0.2 3,-0.1 -0.745 29.8 169.0 -80.5 121.0 25.2 29.5 -5.9 33 46 A I E - 0 0 73 13,-2.5 2,-0.3 -2,-0.5 14,-0.2 0.869 51.4 -22.4-101.9 -57.9 25.2 32.7 -3.9 34 47 A K E -A 46 0A 57 12,-1.2 12,-2.6 282,-0.0 2,-0.5 -0.994 58.3-103.1-160.7 152.8 27.8 32.7 -1.0 35 48 A T E +A 45 0A 1 -2,-0.3 282,-0.3 10,-0.2 10,-0.3 -0.725 26.8 178.7 -83.3 122.9 29.9 30.4 1.2 36 49 A L E + 0 0 13 8,-2.6 279,-0.3 -2,-0.5 2,-0.3 0.528 67.2 7.4 -96.7 -12.2 28.6 30.1 4.7 37 50 A G E -A 44 0A 16 7,-1.1 7,-2.5 277,-0.1 -1,-0.3 -0.943 55.8-154.8-172.0 143.0 31.3 27.6 5.9 38 51 A T E +A 43 0A 79 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.689 17.5 160.4-119.8 177.3 34.5 25.8 5.2 39 52 A G - 0 0 53 3,-0.8 -2,-0.0 -2,-0.2 5,-0.0 -0.945 52.6 -77.5 172.5 170.2 36.1 22.6 6.3 40 53 A S S S+ 0 0 73 -2,-0.3 -1,-0.1 1,-0.2 3,-0.0 0.846 123.8 16.8 -67.9 -40.7 38.8 20.0 5.3 41 54 A F S S+ 0 0 40 -3,-0.0 21,-2.3 28,-0.0 2,-0.3 0.457 127.5 18.1-111.8 -3.1 36.9 18.1 2.6 42 55 A G E - B 0 61A 13 19,-0.2 -3,-0.8 23,-0.1 2,-0.3 -0.897 52.2-135.4-153.3 178.4 34.1 20.5 1.9 43 56 A R E -AB 38 60A 29 17,-1.7 17,-3.2 -2,-0.3 2,-0.5 -0.962 18.7-136.2-137.5 157.5 32.2 23.8 1.8 44 57 A V E -AB 37 59A 38 -7,-2.5 -8,-2.6 -2,-0.3 -7,-1.1 -0.979 25.0-168.2-115.2 127.3 28.6 24.9 2.6 45 58 A M E -AB 35 58A 5 13,-3.6 13,-4.0 -2,-0.5 2,-0.6 -0.906 26.6-126.6-119.3 141.7 26.9 27.3 0.3 46 59 A L E -AB 34 57A 0 -12,-2.6 -13,-2.5 -2,-0.4 -12,-1.2 -0.780 42.8-177.9 -70.3 116.8 23.7 29.4 0.4 47 60 A V E -AB 32 56A 0 9,-2.8 9,-2.0 -2,-0.6 2,-0.5 -0.806 23.4-138.3-117.6 162.9 22.0 28.4 -2.9 48 61 A K E -AB 31 55A 71 -17,-2.5 -17,-2.7 -2,-0.3 2,-0.6 -0.977 17.7-132.1-124.6 115.3 18.8 29.6 -4.5 49 62 A H E > -A 30 0A 17 5,-3.5 4,-2.7 -2,-0.5 5,-0.4 -0.599 18.4-156.2 -63.7 110.3 16.5 27.0 -6.1 50 63 A M T 4 S+ 0 0 116 -21,-1.9 -1,-0.2 -2,-0.6 -20,-0.1 0.929 87.5 57.7 -59.9 -50.0 15.9 28.7 -9.5 51 64 A E T 4 S+ 0 0 160 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.896 128.9 13.3 -39.5 -50.2 12.5 26.9 -10.2 52 65 A T T 4 S- 0 0 76 -3,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.541 92.1-124.6-112.9 -11.8 11.0 28.2 -6.9 53 66 A G < + 0 0 34 -4,-2.7 2,-0.3 1,-0.2 -3,-0.2 0.609 61.7 143.0 63.7 12.7 13.3 31.0 -5.6 54 67 A N - 0 0 85 -5,-0.4 -5,-3.5 -6,-0.0 2,-0.3 -0.638 44.8-132.6 -81.1 144.7 13.7 29.2 -2.3 55 68 A H E +B 48 0A 46 -2,-0.3 54,-0.7 -7,-0.2 2,-0.3 -0.725 28.2 170.1 -99.4 140.7 17.1 29.3 -0.5 56 69 A Y E -BC 47 108A 31 -9,-2.0 -9,-2.8 -2,-0.3 2,-0.6 -0.923 37.2-111.6-131.4 166.9 18.9 26.3 1.0 57 70 A A E -BC 46 107A 12 50,-2.0 50,-2.8 -2,-0.3 2,-0.5 -0.929 33.4-159.3 -90.5 120.9 22.4 25.5 2.4 58 71 A M E -BC 45 106A 0 -13,-4.0 -13,-3.6 -2,-0.6 2,-0.5 -0.935 3.6-153.5-102.3 124.1 24.2 23.2 0.0 59 72 A K E -BC 44 105A 30 46,-3.1 46,-2.1 -2,-0.5 2,-0.6 -0.847 12.2-161.8 -94.2 127.0 27.1 21.1 1.5 60 73 A I E -BC 43 104A 6 -17,-3.2 -17,-1.7 -2,-0.5 2,-0.5 -0.965 4.9-168.7-119.9 112.9 29.6 20.2 -1.2 61 74 A L E -BC 42 103A 1 42,-2.9 42,-2.4 -2,-0.6 2,-0.7 -0.908 19.7-135.4 -99.8 129.2 32.0 17.4 -0.6 62 75 A D E > - C 0 102A 23 -21,-2.3 4,-2.4 -2,-0.5 40,-0.2 -0.769 13.9-150.9 -77.4 115.3 35.0 16.8 -2.9 63 76 A K H > S+ 0 0 6 38,-2.0 4,-2.3 -2,-0.7 5,-0.2 0.893 92.8 49.8 -56.5 -46.7 35.0 13.0 -3.5 64 77 A Q H > S+ 0 0 97 37,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.950 112.9 46.8 -60.1 -48.7 38.8 12.7 -4.1 65 78 A K H > S+ 0 0 72 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.875 108.3 55.1 -64.4 -38.5 39.5 14.7 -0.9 66 79 A V H <>S+ 0 0 0 -4,-2.4 5,-2.0 -25,-0.2 6,-0.3 0.938 111.2 45.8 -58.7 -47.3 37.0 12.6 1.2 67 80 A V H ><5S+ 0 0 38 -4,-2.3 3,-1.7 3,-0.2 -2,-0.2 0.936 110.7 53.6 -56.0 -50.8 39.0 9.4 0.0 68 81 A K H 3<5S+ 0 0 166 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.919 111.9 44.3 -48.3 -49.6 42.4 11.1 0.8 69 82 A L T 3<5S- 0 0 86 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.208 112.3-118.8 -93.0 14.8 41.3 11.9 4.4 70 83 A K T < 5S+ 0 0 171 -3,-1.7 -3,-0.2 -5,-0.1 288,-0.1 0.904 73.4 128.9 50.5 58.0 39.8 8.5 5.0 71 84 A Q >< + 0 0 8 -5,-2.0 4,-2.5 2,-0.1 5,-0.2 0.081 23.3 113.7-128.9 17.2 36.3 9.9 5.6 72 85 A I H > S+ 0 0 39 -6,-0.3 4,-2.2 1,-0.2 5,-0.2 0.930 81.7 45.3 -58.5 -52.6 34.1 7.7 3.3 73 86 A E H > S+ 0 0 144 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.852 112.3 52.8 -65.1 -37.0 32.3 6.0 6.0 74 87 A H H > S+ 0 0 33 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.942 110.2 46.3 -63.7 -48.5 31.7 9.3 7.9 75 88 A T H X S+ 0 0 4 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.892 114.0 48.4 -63.4 -42.3 30.2 11.1 4.9 76 89 A L H X S+ 0 0 24 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.857 112.2 49.9 -58.8 -40.2 27.9 8.1 4.0 77 90 A N H X S+ 0 0 38 -4,-1.8 4,-2.4 -5,-0.2 5,-0.2 0.848 106.5 54.5 -71.7 -36.3 26.8 7.9 7.6 78 91 A E H X S+ 0 0 7 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.960 110.9 45.6 -62.9 -47.2 26.0 11.6 7.9 79 92 A K H X S+ 0 0 14 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.912 112.5 50.6 -60.5 -48.5 23.7 11.4 4.9 80 93 A R H X S+ 0 0 82 -4,-2.0 4,-0.8 1,-0.2 3,-0.3 0.930 113.1 44.8 -57.1 -51.3 22.0 8.2 6.1 81 94 A I H >X S+ 0 0 0 -4,-2.4 4,-1.2 1,-0.2 3,-0.9 0.911 109.5 56.2 -57.4 -45.7 21.2 9.6 9.5 82 95 A L H 3< S+ 0 0 7 -4,-2.4 11,-0.6 1,-0.3 -1,-0.2 0.780 108.8 45.7 -64.9 -31.3 20.0 13.0 8.2 83 96 A Q H 3< S+ 0 0 33 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.631 115.4 48.6 -86.0 -9.0 17.3 11.4 5.9 84 97 A A H << S+ 0 0 3 -3,-0.9 2,-0.2 -4,-0.8 -2,-0.2 0.553 94.9 84.7-101.7 -13.8 16.2 9.1 8.7 85 98 A V < - 0 0 17 -4,-1.2 2,-0.3 6,-0.1 59,-0.0 -0.580 47.5-177.4 -95.9 154.7 15.8 11.6 11.6 86 99 A N + 0 0 92 -2,-0.2 5,-0.1 6,-0.1 -73,-0.1 -0.890 28.4 121.9-152.1 113.7 12.9 13.8 12.5 87 100 A F > - 0 0 12 3,-0.4 3,-1.6 -2,-0.3 -2,-0.0 -0.886 63.0-114.8-170.8 146.6 13.0 16.2 15.4 88 101 A P T 3 S+ 0 0 32 0, 0.0 4,-0.1 0, 0.0 52,-0.0 0.657 113.7 50.1 -72.1 -15.2 12.5 19.9 15.5 89 102 A F T 3 S+ 0 0 0 47,-0.1 80,-1.9 79,-0.1 2,-0.4 0.165 96.7 82.7-103.1 16.1 16.1 20.7 16.7 90 103 A L B < S-e 169 0B 4 -3,-1.6 -3,-0.4 78,-0.2 80,-0.2 -0.990 86.3-113.6-120.7 127.2 17.6 18.6 13.9 91 104 A V - 0 0 3 78,-2.4 2,-0.5 -2,-0.4 -6,-0.1 -0.081 28.6-115.9 -61.3 151.0 18.1 20.2 10.4 92 105 A K - 0 0 89 -4,-0.1 16,-1.7 -6,-0.0 2,-0.6 -0.803 13.2-146.0 -98.6 130.9 16.1 18.9 7.4 93 106 A L E +D 107 0A 33 -11,-0.6 14,-0.3 -2,-0.5 3,-0.1 -0.852 20.0 175.9 -85.9 113.6 17.7 17.3 4.4 94 107 A E E - 0 0 98 12,-2.5 2,-0.3 -2,-0.6 13,-0.2 0.860 61.9 -0.6 -89.1 -41.4 15.7 18.3 1.3 95 108 A F E -D 106 0A 38 11,-1.5 11,-3.3 2,-0.0 -1,-0.3 -0.989 53.9-170.9-147.5 150.7 17.8 16.7 -1.6 96 109 A S E +D 105 0A 3 -2,-0.3 -72,-1.3 9,-0.2 -71,-0.6 -0.964 20.8 144.3-135.9 148.1 20.9 14.8 -2.1 97 110 A F E -D 104 0A 3 7,-1.5 7,-2.4 -2,-0.3 2,-0.3 -0.956 25.3-144.7-162.6-177.8 22.8 13.9 -5.4 98 111 A K E -D 103 0A 69 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.975 7.6-170.7-152.4 163.4 26.2 13.5 -6.9 99 112 A D - 0 0 37 3,-2.1 230,-0.2 -2,-0.3 -2,-0.0 -0.730 54.0 -66.4-138.9-172.8 28.2 14.0 -10.0 100 113 A N S S+ 0 0 53 -2,-0.2 229,-1.8 225,-0.2 226,-0.1 0.866 130.2 19.5 -43.8 -44.6 31.7 13.1 -11.4 101 114 A S S S+ 0 0 12 227,-0.1 -38,-2.0 224,-0.1 -37,-0.4 0.825 118.2 40.9 -97.8 -36.6 33.4 15.3 -8.9 102 115 A N E -C 62 0A 1 -40,-0.2 -3,-2.1 -39,-0.1 2,-0.4 -0.748 52.2-140.3-130.8 152.0 31.2 16.0 -5.9 103 116 A L E -CD 61 98A 1 -42,-2.4 -42,-2.9 -2,-0.3 2,-0.4 -0.930 30.1-160.6-104.6 143.6 28.7 14.8 -3.3 104 117 A Y E -CD 60 97A 0 -7,-2.4 -7,-1.5 -2,-0.4 2,-0.4 -0.977 15.2-172.9-128.0 137.4 26.0 17.3 -2.5 105 118 A M E -CD 59 96A 1 -46,-2.1 -46,-3.1 -2,-0.4 2,-0.6 -0.974 11.6-157.1-130.9 121.9 23.6 17.6 0.4 106 119 A V E +CD 58 95A 0 -11,-3.3 -12,-2.5 -2,-0.4 -11,-1.5 -0.879 22.1 167.0-103.1 117.1 20.8 20.2 0.3 107 120 A M E -CD 57 93A 15 -50,-2.8 -50,-2.0 -2,-0.6 -14,-0.2 -0.720 43.0 -76.6-122.7 169.8 19.4 21.4 3.6 108 121 A E E -C 56 0A 87 -16,-1.7 2,-0.4 -52,-0.2 -52,-0.2 -0.512 50.4-114.9 -68.2 132.9 17.2 24.1 5.0 109 122 A Y - 0 0 26 -54,-0.7 -1,-0.1 -2,-0.2 -54,-0.1 -0.626 25.6-161.3 -70.7 126.6 19.0 27.4 5.3 110 123 A V > - 0 0 12 -2,-0.4 3,-0.7 1,-0.1 51,-0.2 -0.957 7.8-172.5-113.9 102.7 19.3 28.4 9.0 111 124 A P T 3 + 0 0 9 0, 0.0 202,-0.3 0, 0.0 51,-0.2 0.416 61.6 82.0 -84.9 -2.9 20.0 32.1 8.9 112 125 A G T 3 S- 0 0 1 49,-1.6 50,-0.2 1,-0.2 192,-0.1 0.574 88.0-131.6 -80.9 -11.1 20.7 32.9 12.6 113 126 A G < - 0 0 0 -3,-0.7 48,-2.2 48,-0.3 2,-0.2 -0.124 40.1 -38.4 86.8 174.1 24.4 31.8 12.5 114 127 A E B >> -F 160 0B 38 199,-0.5 4,-1.4 46,-0.2 3,-0.7 -0.550 47.0-128.6 -73.1 140.8 26.4 29.6 14.9 115 128 A M H 3> S+ 0 0 0 44,-3.4 4,-2.9 41,-0.5 5,-0.2 0.884 107.8 69.2 -49.1 -43.6 25.7 30.0 18.6 116 129 A F H 3> S+ 0 0 10 40,-1.6 4,-2.0 43,-0.4 5,-0.3 0.838 95.8 47.3 -41.7 -51.4 29.5 30.5 18.8 117 130 A S H <> S+ 0 0 21 -3,-0.7 4,-1.8 39,-0.2 3,-0.3 0.990 115.2 48.6 -60.3 -51.7 29.6 33.9 17.1 118 131 A H H X S+ 0 0 3 -4,-1.4 4,-2.6 1,-0.2 5,-0.4 0.900 112.1 47.1 -52.9 -45.6 26.7 35.0 19.4 119 132 A L H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.829 112.3 48.2 -73.6 -33.2 28.4 33.8 22.6 120 133 A R H < S+ 0 0 59 -4,-2.0 -1,-0.2 -3,-0.3 -2,-0.2 0.795 113.4 50.8 -72.1 -27.2 31.8 35.3 21.8 121 134 A R H < S+ 0 0 157 -4,-1.8 -2,-0.2 -5,-0.3 -3,-0.2 0.961 120.0 31.3 -77.7 -46.8 30.1 38.6 20.9 122 135 A I H < S- 0 0 95 -4,-2.6 2,-0.4 -5,-0.2 -3,-0.2 0.851 100.8-137.3 -77.6 -36.9 28.0 38.9 24.1 123 136 A G S < S+ 0 0 34 -4,-1.8 2,-0.3 -5,-0.4 -1,-0.1 -0.445 70.4 4.7 117.1 -59.1 30.6 37.2 26.2 124 137 A R S S- 0 0 136 -2,-0.4 2,-0.4 97,-0.1 95,-0.2 -0.963 70.0-123.2-145.5 160.5 28.4 34.9 28.3 125 138 A F - 0 0 4 93,-2.9 2,-0.0 -2,-0.3 96,-0.0 -0.843 33.5-111.0 -96.9 143.7 24.7 34.1 28.4 126 139 A X > - 0 0 141 -2,-0.4 4,-2.7 1,-0.1 5,-0.3 -0.334 39.6 -97.6 -59.8 156.7 22.7 34.6 31.6 127 140 A E H > S+ 0 0 32 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.823 122.9 46.9 -50.2 -45.0 21.5 31.5 33.3 128 141 A P H > S+ 0 0 60 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.926 113.1 48.5 -66.5 -42.3 18.0 31.5 31.9 129 142 A H H > S+ 0 0 12 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.955 115.2 46.2 -55.1 -46.8 19.2 32.2 28.3 130 143 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.878 110.4 53.7 -67.1 -35.1 21.7 29.3 28.8 131 144 A R H X S+ 0 0 41 -4,-2.2 4,-2.2 -5,-0.3 -1,-0.2 0.820 101.2 59.1 -68.0 -37.9 19.0 27.1 30.2 132 145 A F H X S+ 0 0 14 -4,-2.0 4,-1.0 2,-0.2 -1,-0.2 0.871 111.7 40.5 -57.7 -43.5 16.7 27.6 27.2 133 146 A Y H X S+ 0 0 0 -4,-1.3 4,-1.9 2,-0.2 3,-0.5 0.927 112.0 55.9 -71.0 -47.6 19.4 26.2 24.9 134 147 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.3 -2,-0.2 0.871 104.7 54.2 -49.7 -45.6 20.4 23.4 27.4 135 148 A A H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.3 -1,-0.3 0.839 106.2 51.2 -65.4 -38.6 16.8 22.2 27.5 136 149 A Q H X S+ 0 0 0 -4,-1.0 4,-1.9 -3,-0.5 -1,-0.3 0.863 111.9 47.7 -63.5 -37.4 16.7 21.9 23.7 137 150 A I H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 5,-0.2 0.885 106.5 57.1 -74.6 -33.4 19.9 19.9 23.8 138 151 A V H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.931 110.7 43.5 -65.9 -38.4 18.6 17.7 26.6 139 152 A L H X S+ 0 0 13 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.912 110.9 54.4 -73.5 -39.0 15.5 16.6 24.5 140 153 A T H X S+ 0 0 2 -4,-1.9 4,-3.0 2,-0.2 5,-0.2 0.942 110.0 47.0 -56.8 -51.2 17.6 16.2 21.3 141 154 A F H X S+ 0 0 4 -4,-2.4 4,-3.5 1,-0.2 5,-0.3 0.904 108.6 54.6 -57.7 -44.7 19.9 13.7 23.1 142 155 A E H X S+ 0 0 30 -4,-1.8 4,-1.2 -5,-0.2 -1,-0.2 0.916 111.7 46.4 -53.2 -42.7 17.0 11.9 24.6 143 156 A Y H >X S+ 0 0 4 -4,-2.5 4,-1.2 2,-0.2 3,-0.6 0.993 117.1 41.0 -62.3 -60.7 15.7 11.5 21.0 144 157 A L H 3<>S+ 0 0 2 -4,-3.0 5,-2.8 1,-0.2 3,-0.3 0.869 112.7 54.1 -57.9 -44.4 19.1 10.4 19.5 145 158 A H H ><5S+ 0 0 17 -4,-3.5 3,-1.1 3,-0.2 -1,-0.2 0.800 104.1 55.4 -61.3 -30.6 20.0 8.1 22.5 146 159 A S H <<5S+ 0 0 28 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.826 107.3 50.4 -71.4 -28.4 16.7 6.2 22.2 147 160 A L T 3<5S- 0 0 0 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.349 124.4-111.0 -79.5 4.4 17.6 5.6 18.5 148 161 A D T < 5S+ 0 0 30 -3,-1.1 30,-1.7 1,-0.2 2,-0.5 0.590 71.1 144.3 59.6 21.1 21.0 4.3 19.9 149 162 A L E < -H 177 0C 1 -5,-2.8 2,-0.4 28,-0.2 -1,-0.2 -0.725 37.1-160.9 -89.6 134.1 22.8 7.3 18.4 150 163 A I E -H 176 0C 3 26,-1.6 26,-1.7 -2,-0.5 54,-0.1 -0.937 5.0-161.1-104.6 132.7 25.8 8.9 20.2 151 164 A Y + 0 0 4 -2,-0.4 23,-0.2 24,-0.2 -1,-0.2 0.967 12.6 178.6 -88.1 -59.1 26.4 12.4 18.8 152 165 A R + 0 0 22 52,-0.1 36,-0.2 1,-0.1 -1,-0.1 0.353 59.2 75.8 85.6 -3.6 30.0 13.1 19.9 153 166 A D + 0 0 13 18,-0.1 2,-0.3 34,-0.1 5,-0.1 0.021 54.2 150.0-134.8 32.7 30.5 16.5 18.4 154 167 A L + 0 0 5 37,-0.1 34,-0.2 3,-0.1 5,-0.1 -0.519 18.4 121.9 -78.4 124.9 28.6 18.9 20.6 155 168 A K S > S- 0 0 10 -2,-0.3 3,-2.3 59,-0.0 -39,-0.1 -0.870 72.5 -99.5-167.4 158.4 30.1 22.4 20.8 156 169 A P G > S+ 0 0 0 0, 0.0 -40,-1.6 0, 0.0 3,-1.1 0.702 117.9 67.6 -56.8 -18.3 28.7 25.9 20.0 157 170 A E G 3 S+ 0 0 10 1,-0.2 -3,-0.1 -42,-0.2 -40,-0.1 0.788 103.2 46.9 -70.7 -24.0 30.5 25.9 16.7 158 171 A N G < S+ 0 0 16 -3,-2.3 12,-0.7 -5,-0.1 2,-0.4 0.050 95.8 84.3-108.5 18.4 28.0 23.1 15.7 159 172 A L E < - G 0 169B 1 -3,-1.1 -44,-3.4 10,-0.1 -43,-0.4 -0.991 59.1-165.7-123.3 122.2 24.7 24.7 16.9 160 173 A L E -FG 114 168B 17 8,-2.6 8,-2.4 -2,-0.4 2,-0.5 -0.750 15.7-129.7-106.2 158.2 22.9 27.2 14.7 161 174 A I E - G 0 167B 0 -48,-2.2 -49,-1.6 -2,-0.3 -48,-0.3 -0.883 22.4-149.6-107.5 123.5 20.1 29.6 15.6 162 175 A D > - 0 0 20 4,-3.0 3,-1.4 -2,-0.5 -52,-0.1 -0.184 36.3 -88.4 -82.4-175.7 16.9 29.7 13.5 163 176 A Q T 3 S+ 0 0 129 1,-0.3 -1,-0.0 2,-0.1 -53,-0.0 0.854 129.8 49.9 -64.5 -38.5 14.5 32.5 12.8 164 177 A Q T 3 S- 0 0 99 138,-0.1 135,-0.4 2,-0.1 -1,-0.3 0.424 121.5-109.9 -74.1 -7.3 12.5 31.8 15.9 165 178 A G S < S+ 0 0 0 -3,-1.4 2,-0.2 1,-0.3 136,-0.2 0.699 77.2 129.3 79.0 20.2 15.8 31.8 17.9 166 179 A Y - 0 0 1 133,-0.1 -4,-3.0 1,-0.1 -1,-0.3 -0.647 60.1 -93.8 -98.8 168.1 15.7 28.0 18.6 167 180 A I E - G 0 161B 0 -2,-0.2 2,-0.4 -6,-0.2 -6,-0.2 -0.502 27.9-166.9 -91.8 141.4 18.6 25.6 17.9 168 181 A Q E - G 0 160B 9 -8,-2.4 -8,-2.6 -2,-0.2 2,-0.5 -0.997 11.9-148.2-125.3 133.2 19.3 23.4 14.9 169 182 A V E +eG 90 159B 5 -80,-1.9 -78,-2.4 -2,-0.4 2,-0.3 -0.860 23.4 165.9-101.1 127.7 21.9 20.6 15.0 170 183 A T + 0 0 26 -12,-0.7 -2,-0.0 -2,-0.5 -78,-0.0 -0.814 40.8 72.8-127.8 164.1 23.8 19.9 11.7 171 184 A D + 0 0 54 -2,-0.3 3,-0.1 1,-0.1 -18,-0.1 0.893 31.3 163.9 85.4 88.7 27.0 17.7 11.6 172 185 A F + 0 0 0 1,-0.1 3,-0.5 2,-0.1 -91,-0.1 0.024 39.3 121.2-113.2 23.6 26.5 14.1 12.0 173 186 A G S S+ 0 0 18 1,-0.2 -95,-0.1 -95,-0.1 -96,-0.1 0.866 86.2 28.2 -50.7 -40.8 29.9 13.3 10.6 174 187 A F S S+ 0 0 22 -23,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.437 89.3 120.1-106.1 -5.5 31.0 11.6 13.9 175 188 A A - 0 0 3 -3,-0.5 2,-0.4 -101,-0.1 -24,-0.2 -0.337 45.7-162.6 -61.5 146.0 27.6 10.3 15.1 176 189 A K E -H 150 0C 54 -26,-1.7 -26,-1.6 2,-0.1 2,-1.2 -0.987 17.6-140.2-140.3 128.5 27.6 6.5 15.5 177 190 A R E +H 149 0C 81 -2,-0.4 2,-0.3 -28,-0.2 -28,-0.2 -0.761 47.6 141.4 -93.2 96.8 24.7 4.2 15.7 178 191 A V - 0 0 34 -30,-1.7 2,-0.5 -2,-1.2 -2,-0.1 -0.997 45.2-149.0-137.4 147.6 25.7 1.6 18.3 179 192 A K S S+ 0 0 192 -2,-0.3 2,-0.5 2,-0.1 -2,-0.0 -0.951 82.8 8.2-106.3 120.9 24.3 -0.5 21.2 180 193 A G S S- 0 0 51 -2,-0.5 2,-0.3 2,-0.0 -2,-0.1 -0.963 111.3 -21.8 118.0-120.3 27.1 -1.2 23.8 181 194 A R - 0 0 156 -2,-0.5 2,-0.3 22,-0.1 22,-0.2 -0.854 43.2-163.1-131.6 159.4 30.5 0.5 23.5 182 195 A T B -I 202 0D 0 20,-2.1 20,-2.3 -2,-0.3 19,-0.1 -0.975 7.5-160.6-142.6 160.3 32.8 2.2 21.0 183 196 A W + 0 0 163 -2,-0.3 2,-0.1 18,-0.2 18,-0.1 0.394 39.0 130.9-126.6 -2.9 36.4 3.0 21.1 184 197 A X - 0 0 66 1,-0.1 2,-0.9 18,-0.1 18,-0.1 -0.368 53.6-132.0 -67.3 134.9 37.3 5.8 18.5 185 198 A L + 0 0 79 -2,-0.1 2,-0.3 14,-0.1 -1,-0.1 -0.785 56.5 135.2 -77.0 105.3 39.3 8.8 19.6 186 199 A C + 0 0 3 -2,-0.9 2,-0.3 2,-0.1 171,-0.1 -0.993 18.2 59.5-159.1 157.9 37.3 11.5 18.2 187 200 A G B S-J 356 0E 1 169,-0.9 169,-2.4 -2,-0.3 -34,-0.1 -0.765 81.0 -52.0 118.7-168.4 35.8 14.9 19.0 188 201 A T > - 0 0 4 -2,-0.3 3,-2.0 167,-0.2 4,-0.4 -0.935 49.1-120.0-118.7 133.7 37.2 18.3 20.0 189 202 A P G > S+ 0 0 3 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.766 105.5 50.6 -49.4 -50.3 39.6 18.6 22.9 190 203 A E G 3 S+ 0 0 0 1,-0.3 35,-0.3 -3,-0.0 -3,-0.0 0.635 118.0 42.0 -62.2 -20.3 37.7 21.0 25.4 191 204 A Y G < S+ 0 0 13 -3,-2.0 2,-0.4 2,-0.1 -1,-0.3 0.300 83.7 118.1-115.2 0.3 34.7 18.8 25.1 192 205 A L < - 0 0 5 -3,-1.6 -5,-0.1 -4,-0.4 -39,-0.0 -0.642 62.4-127.3 -77.9 128.0 36.2 15.3 25.2 193 206 A A >> - 0 0 1 -2,-0.4 4,-1.4 1,-0.1 3,-0.9 -0.347 22.6-111.9 -65.3 148.9 35.1 13.2 28.1 194 207 A P H 3> S+ 0 0 1 0, 0.0 4,-1.8 0, 0.0 3,-0.2 0.860 114.6 59.2 -53.5 -44.5 37.8 11.6 30.3 195 208 A E H 34>S+ 0 0 0 1,-0.2 5,-2.1 2,-0.2 6,-0.4 0.851 104.2 53.4 -61.1 -28.2 37.0 8.1 29.2 196 209 A I H X45S+ 0 0 11 -3,-0.9 3,-1.3 1,-0.2 -1,-0.2 0.937 109.4 46.9 -67.6 -43.5 37.7 9.1 25.6 197 210 A I H 3<5S+ 0 0 35 -4,-1.4 -2,-0.2 1,-0.3 -1,-0.2 0.750 110.6 53.0 -66.3 -30.9 41.2 10.5 26.5 198 211 A L T 3<5S- 0 0 95 -4,-1.8 -1,-0.3 40,-0.0 -2,-0.2 0.027 109.6-123.1 -96.0 16.5 42.1 7.4 28.6 199 212 A S T < 5 + 0 0 103 -3,-1.3 -3,-0.2 1,-0.1 -2,-0.1 0.757 60.6 148.4 51.0 41.3 41.2 5.1 25.7 200 213 A K < - 0 0 105 -5,-2.1 -1,-0.1 -6,-0.1 -4,-0.1 0.700 60.2-102.1 -84.8 -30.7 38.7 3.3 27.8 201 214 A G - 0 0 9 -6,-0.4 -18,-0.2 -19,-0.1 2,-0.1 0.736 54.5-168.0 92.2 97.8 35.9 2.0 25.7 202 215 A Y B -I 182 0D 3 -20,-2.3 -20,-2.1 -18,-0.1 2,-0.2 -0.335 19.8-156.5-130.2 177.8 32.9 4.3 26.2 203 216 A N > - 0 0 42 -22,-0.2 3,-2.3 -2,-0.1 4,-0.2 -0.670 54.5 -53.8-145.9-168.8 29.2 5.0 25.6 204 217 A K T >> S+ 0 0 71 1,-0.3 3,-1.6 -2,-0.2 4,-0.6 0.662 110.5 85.7 -56.9 -16.0 26.4 7.7 25.4 205 218 A A H >> S+ 0 0 0 1,-0.3 4,-1.7 2,-0.2 3,-0.6 0.763 76.5 70.7 -55.6 -23.4 27.6 9.1 28.8 206 219 A V H <> S+ 0 0 7 -3,-2.3 4,-2.4 1,-0.2 -1,-0.3 0.883 91.2 57.3 -60.8 -36.2 30.1 11.0 26.7 207 220 A D H <> S+ 0 0 0 -3,-1.6 4,-1.4 -4,-0.2 -1,-0.2 0.809 105.8 48.1 -66.4 -29.4 27.3 13.2 25.4 208 221 A W H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 3,-0.8 0.957 109.0 49.7 -56.0 -50.5 29.7 15.1 29.8 210 223 A A H 3X S+ 0 0 6 -4,-2.4 4,-2.1 1,-0.3 -2,-0.2 0.817 105.2 57.2 -58.5 -34.2 29.7 17.3 26.7 211 224 A L H 3X S+ 0 0 0 -4,-1.4 4,-2.1 2,-0.2 -1,-0.3 0.800 105.4 51.0 -69.0 -31.5 26.4 18.9 27.8 212 225 A G H > S- 0 0 95 1,-0.1 4,-1.4 -3,-0.1 3,-0.6 -0.936 80.5-116.7-130.7 143.8 47.9 22.7 23.8 230 243 A P H >> S+ 0 0 49 0, 0.0 4,-2.4 0, 0.0 3,-1.0 0.897 112.5 58.0 -37.0 -54.7 45.5 19.7 23.5 231 244 A I H 3> S+ 0 0 95 1,-0.3 4,-1.6 2,-0.2 -3,-0.0 0.875 106.3 46.2 -50.0 -48.3 47.8 17.6 25.8 232 245 A Q H <> S+ 0 0 83 -3,-0.6 4,-1.0 1,-0.2 -1,-0.3 0.756 110.7 53.7 -75.1 -22.6 47.6 20.0 28.7 233 246 A I H S+ 0 0 94 -4,-1.0 4,-1.4 2,-0.2 5,-0.6 0.927 109.8 56.6 -66.2 -41.3 43.0 19.0 33.3 237 250 A I H <5S+ 0 0 0 -4,-2.5 3,-0.5 1,-0.2 -2,-0.2 0.923 107.3 44.6 -58.5 -50.6 40.0 16.9 32.0 238 251 A V H <5S+ 0 0 47 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.796 107.1 60.8 -70.8 -26.3 41.0 13.6 33.7 239 252 A S H <5S- 0 0 56 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.877 93.9-146.3 -63.2 -36.4 41.8 15.3 37.0 240 253 A G T <5 + 0 0 27 -4,-1.4 2,-0.5 -3,-0.5 -3,-0.1 0.985 41.3 151.6 61.9 58.0 38.2 16.5 37.3 241 254 A K < + 0 0 175 -5,-0.6 2,-0.4 -17,-0.0 -1,-0.2 -0.791 17.6 176.5-122.5 87.7 39.1 19.8 39.0 242 255 A V - 0 0 37 -2,-0.5 2,-0.4 18,-0.1 -17,-0.1 -0.730 13.5-164.2 -86.7 133.5 36.4 22.3 38.0 243 256 A R - 0 0 180 -2,-0.4 -2,-0.0 -19,-0.3 0, 0.0 -0.972 13.1-150.0-106.8 139.0 36.5 25.8 39.5 244 257 A F - 0 0 33 -2,-0.4 9,-0.0 4,-0.0 -28,-0.0 -0.914 17.9-113.2-109.0 136.5 33.2 27.8 39.1 245 258 A P > - 0 0 18 0, 0.0 3,-1.0 0, 0.0 -1,-0.0 -0.158 31.1-114.1 -57.5 160.8 32.9 31.6 38.8 246 259 A S T 3 S+ 0 0 120 1,-0.2 -2,-0.0 0, 0.0 0, 0.0 0.707 110.5 65.3 -74.1 -24.0 31.2 33.3 41.7 247 260 A H T 3 S+ 0 0 81 2,-0.0 -1,-0.2 -27,-0.0 2,-0.2 0.636 76.2 108.9 -75.2 -11.0 28.2 34.4 39.7 248 261 A F S < S- 0 0 7 -3,-1.0 -4,-0.0 1,-0.1 -28,-0.0 -0.442 75.0-121.6 -66.9 133.7 27.1 30.8 39.1 249 262 A S > - 0 0 39 -2,-0.2 4,-1.8 1,-0.1 3,-0.2 -0.341 20.0-117.5 -68.6 159.4 23.9 29.9 41.1 250 263 A S H > S+ 0 0 91 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.769 115.2 59.1 -71.3 -25.1 24.4 27.0 43.5 251 264 A D H > S+ 0 0 63 2,-0.2 4,-1.4 1,-0.2 32,-0.3 0.841 106.8 46.9 -69.4 -35.5 21.7 25.1 41.6 252 265 A L H > S+ 0 0 0 -3,-0.2 4,-2.9 2,-0.2 5,-0.3 0.910 110.1 52.8 -70.9 -43.3 23.9 25.3 38.4 253 266 A K H X S+ 0 0 55 -4,-1.8 4,-2.8 1,-0.2 -2,-0.2 0.934 107.0 53.1 -57.3 -45.1 27.0 24.3 40.3 254 267 A D H X S+ 0 0 71 -4,-2.0 4,-0.9 2,-0.2 -1,-0.2 0.893 112.8 42.2 -58.9 -43.1 25.2 21.2 41.6 255 268 A L H >X S+ 0 0 0 -4,-1.4 4,-1.6 2,-0.2 3,-0.6 0.924 115.2 50.0 -68.6 -47.1 24.1 20.1 38.0 256 269 A L H 3X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.3 3,-0.4 0.897 107.1 55.7 -62.9 -36.2 27.5 20.9 36.6 257 270 A R H 3< S+ 0 0 132 -4,-2.8 -1,-0.3 -5,-0.3 -2,-0.2 0.802 110.0 46.6 -64.3 -30.2 29.0 18.9 39.4 258 271 A N H << S+ 0 0 39 -4,-0.9 10,-2.8 -3,-0.6 3,-0.3 0.722 115.8 42.6 -89.0 -14.2 26.8 16.0 38.3 259 272 A L H < S+ 0 0 0 -4,-1.6 2,-0.6 -3,-0.4 -2,-0.2 0.809 110.7 53.3 -95.2 -42.2 27.6 16.1 34.6 260 273 A L S < S+ 0 0 9 -4,-2.4 2,-0.6 -5,-0.2 -1,-0.2 -0.267 79.1 140.3 -87.7 47.0 31.3 16.8 34.8 261 274 A Q - 0 0 65 -2,-0.6 6,-0.1 -3,-0.3 5,-0.1 -0.824 47.5-150.7 -96.2 120.5 31.7 13.8 37.0 262 275 A V S S+ 0 0 46 -2,-0.6 2,-0.5 -22,-0.1 -67,-0.2 0.912 78.3 77.1 -59.4 -46.9 34.8 11.9 36.1 263 276 A D S >> S- 0 0 71 1,-0.2 3,-1.6 -3,-0.1 4,-0.5 -0.570 72.6-149.7 -72.4 116.3 33.4 8.6 37.2 264 277 A L G >4 S+ 0 0 33 -2,-0.5 3,-1.2 1,-0.2 -1,-0.2 0.854 91.5 61.3 -41.9 -47.4 30.9 7.1 34.6 265 278 A T G 34 S+ 0 0 97 1,-0.3 -1,-0.2 -3,-0.0 -2,-0.1 0.376 110.5 36.4 -85.1 6.6 28.9 5.3 37.2 266 279 A K G <4 S+ 0 0 141 -3,-1.6 2,-0.3 -5,-0.1 -1,-0.3 0.287 88.7 119.5-127.3 10.2 27.8 8.4 39.2 267 280 A R S X< S- 0 0 0 -3,-1.2 3,-2.1 -4,-0.5 4,-0.4 -0.560 71.8-110.0 -74.7 129.8 27.4 10.8 36.1 268 281 A F T 3 S+ 0 0 32 -10,-2.8 -7,-0.1 -2,-0.3 7,-0.1 -0.371 106.7 33.5 -59.9 135.1 24.0 12.3 35.6 269 282 A G T 3 S+ 0 0 13 5,-0.5 -1,-0.3 -2,-0.1 6,-0.2 0.181 112.5 65.1 97.0 -12.8 22.4 10.8 32.5 270 283 A N S < S+ 0 0 51 -3,-2.1 -2,-0.2 4,-0.2 -3,-0.1 0.337 80.9 94.7-117.8 0.4 24.1 7.4 33.1 271 284 A L S > S- 0 0 60 -4,-0.4 3,-1.1 3,-0.2 6,-0.1 -0.142 94.8 -88.8 -82.8-175.0 22.4 6.5 36.3 272 285 A K T 3 S+ 0 0 201 1,-0.3 3,-0.1 2,-0.1 -1,-0.1 0.892 124.9 54.5 -69.8 -42.0 19.2 4.3 36.5 273 286 A N T > S- 0 0 93 1,-0.2 3,-1.5 2,-0.1 -1,-0.3 0.407 94.6-165.6 -70.6 4.7 16.6 7.1 36.1 274 287 A G T X> - 0 0 20 -3,-1.1 3,-1.9 1,-0.3 4,-0.5 -0.024 61.5 -2.3 49.9-140.4 18.4 8.1 32.9 275 288 A V H >> S+ 0 0 22 1,-0.3 4,-1.9 -6,-0.2 3,-0.8 0.758 121.7 77.8 -58.5 -22.3 17.7 11.4 31.3 276 289 A N H <> S+ 0 0 80 -3,-1.5 4,-2.5 1,-0.2 -1,-0.3 0.767 82.1 64.0 -59.5 -28.7 15.1 12.1 34.1 277 290 A D H <4 S+ 0 0 34 -3,-1.9 4,-0.3 -4,-0.2 -1,-0.2 0.909 107.9 42.5 -61.0 -37.4 17.9 12.9 36.6 278 291 A I H X< S+ 0 0 0 -3,-0.8 3,-0.7 -4,-0.5 6,-0.3 0.917 115.9 47.4 -73.9 -43.5 18.7 15.9 34.4 279 292 A K H 3< S+ 0 0 24 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.2 0.859 113.5 46.7 -68.8 -37.6 15.1 17.0 33.7 280 293 A N T 3< S+ 0 0 128 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.465 86.7 120.4 -80.8 -2.6 14.0 16.8 37.4 281 294 A H S X S- 0 0 15 -3,-0.7 3,-1.4 -4,-0.3 -3,-0.0 -0.427 74.9-120.2 -62.5 139.4 17.1 18.7 38.5 282 295 A K G > S+ 0 0 154 1,-0.3 3,-1.4 2,-0.2 4,-0.3 0.666 109.1 67.9 -46.8 -33.5 16.3 22.0 40.4 283 296 A W G 3 S+ 0 0 4 -32,-0.3 3,-0.3 1,-0.3 -1,-0.3 0.869 107.1 41.5 -60.5 -33.6 18.2 24.1 37.8 284 297 A F G X S+ 0 0 3 -3,-1.4 3,-1.2 -6,-0.3 -1,-0.3 -0.005 80.0 115.0 -99.6 26.8 15.5 23.2 35.4 285 298 A A T < S+ 0 0 83 -3,-1.4 -1,-0.2 1,-0.3 -2,-0.1 0.864 78.7 47.5 -65.3 -38.7 12.5 23.6 37.8 286 299 A T T 3 S+ 0 0 118 -3,-0.3 2,-0.5 -4,-0.3 -1,-0.3 0.393 92.1 111.7 -79.1 4.6 11.0 26.5 35.9 287 300 A T < - 0 0 26 -3,-1.2 2,-1.0 -8,-0.1 -3,-0.1 -0.700 56.4-154.2 -99.8 120.8 11.3 24.6 32.6 288 301 A D > - 0 0 102 -2,-0.5 4,-1.7 1,-0.2 3,-0.2 -0.752 10.4-170.1 -89.3 98.0 8.4 23.5 30.7 289 302 A W H > S+ 0 0 39 -2,-1.0 4,-2.0 1,-0.3 -1,-0.2 0.802 82.8 47.5 -62.5 -37.0 9.7 20.5 28.7 290 303 A I H > S+ 0 0 106 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.872 109.9 52.1 -69.0 -43.4 6.7 20.0 26.4 291 304 A A H 4>S+ 0 0 10 2,-0.2 5,-2.6 1,-0.2 6,-0.3 0.843 108.9 51.7 -68.4 -31.3 6.4 23.7 25.6 292 305 A I H ><5S+ 0 0 6 -4,-1.7 3,-1.8 3,-0.2 -2,-0.2 0.963 108.7 50.7 -65.1 -54.4 10.1 23.6 24.5 293 306 A Y H 3<5S+ 0 0 81 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.870 112.9 46.6 -47.1 -40.4 9.4 20.6 22.3 294 307 A Q T 3<5S- 0 0 86 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.465 108.5-125.0 -87.6 -2.2 6.4 22.5 20.7 295 308 A R T < 5 + 0 0 44 -3,-1.8 -3,-0.2 -4,-0.3 -2,-0.1 0.852 68.4 134.2 59.5 44.8 8.4 25.7 20.2 296 309 A K < + 0 0 140 -5,-2.6 2,-0.4 -6,-0.1 -4,-0.1 0.141 38.3 95.4-111.7 15.5 5.8 27.7 22.2 297 310 A V S S- 0 0 53 -6,-0.3 2,-0.3 -5,-0.1 0, 0.0 -0.919 82.1-113.2-114.3 130.5 8.2 29.6 24.4 298 311 A E - 0 0 180 -2,-0.4 -2,-0.1 1,-0.1 -133,-0.1 -0.504 36.3-125.7 -65.0 122.7 9.3 33.2 23.5 299 312 A A - 0 0 8 -135,-0.4 3,-0.1 -2,-0.3 -133,-0.1 -0.492 6.5-137.8 -67.3 144.2 13.0 32.9 22.8 300 313 A P S S+ 0 0 70 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.618 89.7 35.8 -83.1 -10.5 15.1 35.3 24.8 301 314 A F - 0 0 50 -136,-0.2 -2,-0.0 -137,-0.1 0, 0.0 -0.975 64.2-175.5-142.4 130.1 17.4 36.2 21.8 302 315 A I - 0 0 92 -2,-0.4 -139,-0.1 -3,-0.1 -138,-0.1 -0.985 26.3-126.3-126.8 123.0 16.3 36.4 18.2 303 316 A P - 0 0 9 0, 0.0 -190,-0.1 0, 0.0 2,-0.1 -0.321 30.9-100.7 -73.0 147.3 18.9 37.1 15.5 304 317 A K - 0 0 176 -192,-0.1 2,-0.3 8,-0.1 9,-0.1 -0.363 41.9-179.3 -67.9 142.7 18.6 40.0 13.1 305 318 A F - 0 0 65 -2,-0.1 -193,-0.0 7,-0.1 6,-0.0 -0.901 17.5-171.4-154.3 117.3 17.2 39.0 9.6 306 319 A K - 0 0 197 1,-0.3 -2,-0.0 -2,-0.3 -1,-0.0 0.188 65.7 -47.2-102.4 13.6 16.7 41.4 6.7 307 320 A G S > S- 0 0 28 3,-0.1 3,-0.6 0, 0.0 -1,-0.3 -0.590 84.9 -42.9 133.3 164.1 14.9 39.2 4.2 308 321 A P T 3 S+ 0 0 110 0, 0.0 -3,-0.0 0, 0.0 -254,-0.0 -0.363 123.4 24.7 -67.6 133.7 15.2 35.7 2.7 309 322 A G T 3 S+ 0 0 26 1,-0.3 2,-0.5 -2,-0.1 -263,-0.0 0.845 80.5 150.3 77.6 36.9 18.8 34.9 1.7 310 323 A D < - 0 0 29 -3,-0.6 -1,-0.3 1,-0.1 3,-0.2 -0.903 25.0-174.8 -98.4 128.5 20.6 37.2 4.1 311 324 A T > + 0 0 25 -2,-0.5 3,-1.8 1,-0.1 -1,-0.1 0.116 44.6 120.5-109.5 18.8 24.1 36.0 5.3 312 325 A S T 3 S+ 0 0 74 1,-0.3 -1,-0.1 -199,-0.0 -200,-0.1 0.571 72.0 55.9 -63.1 -13.1 24.8 38.8 7.9 313 326 A N T 3 S+ 0 0 27 -202,-0.3 -199,-0.5 -3,-0.2 2,-0.3 0.243 99.6 75.8-102.2 9.8 25.2 36.2 10.8 314 327 A F S < S- 0 0 33 -3,-1.8 -277,-0.1 -201,-0.2 -3,-0.0 -0.882 83.7-107.9-117.6 151.5 27.8 34.2 9.0 315 328 A D - 0 0 60 -279,-0.3 2,-0.4 -2,-0.3 -2,-0.1 -0.208 34.0-106.2 -65.7 164.6 31.5 34.9 8.4 316 329 A D - 0 0 125 -282,-0.0 2,-0.3 3,-0.0 -280,-0.1 -0.812 39.5-176.3 -92.6 135.5 33.1 35.8 5.0 317 330 A Y - 0 0 61 -2,-0.4 2,-0.7 -282,-0.3 -282,-0.2 -0.813 36.9 -89.2-124.4 165.5 35.0 33.1 3.4 318 331 A E - 0 0 169 -2,-0.3 2,-0.2 1,-0.0 -2,-0.0 -0.703 44.0-128.4 -79.7 114.1 37.1 33.0 0.1 319 332 A E - 0 0 99 -2,-0.7 2,-0.3 -284,-0.1 -1,-0.0 -0.456 28.4-171.6 -63.5 126.6 34.8 32.1 -2.8 320 333 A E - 0 0 95 -2,-0.2 2,-0.2 3,-0.0 -1,-0.0 -0.811 25.8-105.9-111.6 161.3 36.2 29.2 -5.0 321 334 A E - 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