==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-NOV-03 1REJ . COMPND 2 MOLECULE: CAMP-DEPENDENT PROTEIN KINASE, ALPHA-CATALYTIC . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR P.AKAMINE,MADHUSUDAN,L.L.BRUNTON,H.D.OU,J.M.CANAVES, . 335 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14494.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 222 66.3 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 . 44 13.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 29 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 27.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 1 0 1 0 2 0 0 1 0 1 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 . 2 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 16 A K > 0 0 104 0, 0.0 4,-0.7 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 171.6 19.7 63.0 38.6 2 17 A E H > + 0 0 89 2,-0.2 4,-1.3 1,-0.1 5,-0.1 0.859 360.0 50.5 -74.4 -36.4 23.0 63.5 36.8 3 18 A F H > S+ 0 0 94 2,-0.2 4,-2.8 1,-0.2 3,-0.2 0.915 107.1 51.8 -69.2 -41.2 22.3 60.3 34.9 4 19 A L H > S+ 0 0 56 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.744 110.6 50.3 -66.3 -22.5 18.8 61.3 33.8 5 20 A A H X S+ 0 0 62 -4,-0.7 4,-1.7 2,-0.2 -1,-0.2 0.756 111.0 47.9 -79.6 -36.3 20.2 64.5 32.5 6 21 A K H X S+ 0 0 54 -4,-1.3 4,-1.9 2,-0.2 5,-0.3 0.854 109.6 53.5 -72.1 -38.7 22.8 62.6 30.6 7 22 A A H X S+ 0 0 7 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.888 108.6 50.5 -63.4 -38.1 20.0 60.2 29.3 8 23 A K H X S+ 0 0 70 -4,-1.2 4,-2.9 2,-0.2 -2,-0.2 0.948 110.5 47.5 -64.9 -47.4 18.1 63.3 28.0 9 24 A E H X S+ 0 0 65 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.841 115.6 43.8 -64.2 -37.2 21.1 64.8 26.1 10 25 A D H X S+ 0 0 61 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.877 114.7 49.3 -77.3 -39.4 22.1 61.6 24.4 11 26 A F H X S+ 0 0 1 -4,-2.0 4,-2.7 -5,-0.3 -2,-0.2 0.970 113.2 48.0 -59.0 -50.7 18.5 60.7 23.6 12 27 A L H X S+ 0 0 60 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.858 106.8 52.8 -61.7 -45.4 17.9 64.2 22.1 13 28 A K H X S+ 0 0 44 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.945 117.6 40.1 -53.3 -49.5 21.0 64.5 19.9 14 29 A K H < S+ 0 0 65 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.846 114.2 52.3 -70.5 -36.6 20.1 61.1 18.3 15 30 A W H < S+ 0 0 30 -4,-2.7 -1,-0.2 67,-0.2 -2,-0.2 0.837 111.9 47.4 -68.6 -35.5 16.4 61.9 18.2 16 31 A E H < S+ 0 0 129 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.840 127.7 25.6 -70.6 -39.9 17.2 65.3 16.4 17 32 A T S < S- 0 0 92 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.1 -0.814 86.0-157.0-131.5 88.8 19.6 63.5 13.9 18 33 A P - 0 0 46 0, 0.0 2,-0.4 0, 0.0 -3,-0.1 -0.256 22.7-114.0 -59.2 145.4 18.7 59.8 13.4 19 34 A S - 0 0 66 59,-0.1 2,-0.4 -5,-0.1 3,-0.1 -0.689 44.2-173.6 -75.6 130.7 21.2 57.3 12.2 20 35 A Q + 0 0 52 -2,-0.4 75,-0.1 1,-0.2 315,-0.1 -0.986 52.0 3.1-133.3 147.8 19.8 56.2 8.8 21 36 A N + 0 0 105 -2,-0.4 74,-0.3 314,-0.3 -1,-0.2 0.901 67.4 158.6 46.2 61.5 20.9 53.5 6.3 22 37 A T + 0 0 56 72,-2.8 2,-0.3 -3,-0.1 73,-0.2 0.414 63.6 4.6 -94.0 0.7 23.7 52.0 8.5 23 38 A A - 0 0 8 71,-0.7 2,-0.3 70,-0.0 3,-0.1 -0.908 66.6-134.2-160.7-178.9 23.9 48.6 6.8 24 39 A Q > - 0 0 99 -2,-0.3 3,-1.6 71,-0.1 4,-0.2 -0.972 30.7-103.1-144.4 157.5 22.3 46.7 3.8 25 40 A L G > S+ 0 0 46 -2,-0.3 3,-2.2 1,-0.3 -1,-0.1 0.845 110.9 61.7 -46.7 -48.8 20.8 43.2 3.3 26 41 A D G 3 S+ 0 0 104 1,-0.3 -1,-0.3 -3,-0.1 3,-0.0 0.345 91.6 68.3 -69.0 5.5 23.7 41.4 1.5 27 42 A Q G < S+ 0 0 66 -3,-1.6 21,-2.7 21,-0.1 22,-0.5 0.394 98.5 65.6 -93.5 -6.9 26.0 42.0 4.5 28 43 A F E < S-A 47 0A 9 -3,-2.2 2,-0.5 19,-0.3 19,-0.2 -0.925 75.2-138.8-120.0 139.2 23.8 39.5 6.4 29 44 A D E -A 46 0A 75 17,-3.4 17,-2.3 -2,-0.3 2,-0.4 -0.871 24.6-129.1 -97.8 132.9 23.2 35.8 6.0 30 45 A R E +A 45 0A 84 -2,-0.5 15,-0.2 15,-0.2 3,-0.1 -0.656 38.3 158.6 -81.7 128.7 19.5 34.7 6.5 31 46 A I E - 0 0 77 13,-2.1 2,-0.3 -2,-0.4 14,-0.2 0.811 49.8 -25.9-117.5 -54.6 19.1 31.8 8.9 32 47 A K E -A 44 0A 48 12,-1.1 12,-2.9 282,-0.0 2,-0.6 -0.988 56.4 -96.7-166.0 152.6 15.7 31.3 10.5 33 48 A T E +A 43 0A 0 -2,-0.3 282,-0.4 282,-0.3 10,-0.2 -0.756 29.1 177.6 -88.4 119.3 12.4 33.0 11.6 34 49 A L E - 0 0 5 8,-2.2 279,-0.5 -2,-0.6 2,-0.3 0.550 68.4 -22.4 -85.3 -25.3 12.4 34.0 15.2 35 50 A G E -A 42 0A 12 7,-1.5 7,-2.8 277,-0.1 2,-0.3 -0.949 55.8-139.7-178.6 160.6 8.9 35.7 15.2 36 51 A T E +A 41 0A 75 5,-0.3 5,-0.3 -2,-0.3 2,-0.2 -0.914 21.9 176.6-128.1 163.9 6.4 37.3 12.8 37 52 A G - 0 0 53 3,-2.1 3,-0.4 -2,-0.3 -2,-0.0 -0.793 47.8 -62.7-147.5-165.5 4.2 40.4 13.3 38 53 A S S S+ 0 0 106 -2,-0.2 3,-0.0 1,-0.2 21,-0.0 0.832 129.7 23.8 -55.0 -42.4 1.7 42.7 11.8 39 54 A F S S- 0 0 30 20,-0.0 21,-2.7 25,-0.0 2,-0.2 0.334 131.0 -51.0-113.5 8.6 4.0 44.0 9.0 40 55 A G E - B 0 59A 27 -3,-0.4 -3,-2.1 19,-0.2 2,-0.3 -0.780 66.1 -69.7 169.9-124.0 6.6 41.2 8.7 41 56 A R E -AB 36 58A 39 17,-1.2 17,-2.9 -5,-0.3 2,-0.5 -0.981 24.2-118.8-166.0 159.6 8.9 39.0 10.7 42 57 A V E -AB 35 57A 35 -7,-2.8 -8,-2.2 -2,-0.3 -7,-1.5 -0.963 34.9-169.3-112.8 128.5 12.1 38.9 12.8 43 58 A M E -AB 33 56A 15 13,-2.6 13,-3.2 -2,-0.5 2,-0.3 -0.945 27.2-117.1-124.5 139.8 14.8 36.7 11.5 44 59 A L E -AB 32 55A 0 -12,-2.9 -13,-2.1 -2,-0.4 -12,-1.1 -0.557 44.0-179.7 -68.6 122.7 18.1 35.4 12.9 45 60 A V E -AB 30 54A 2 9,-3.0 9,-2.1 -2,-0.3 2,-0.5 -0.910 22.4-140.2-124.6 160.4 20.8 36.7 10.7 46 61 A K E -AB 29 53A 82 -17,-2.3 -17,-3.4 -2,-0.3 2,-0.4 -0.979 19.8-127.6-123.0 126.0 24.5 36.4 10.6 47 62 A H E > -A 28 0A 28 5,-3.8 4,-1.9 -2,-0.5 -19,-0.3 -0.580 17.6-152.5 -67.4 121.0 26.7 39.3 9.9 48 63 A K T 4 S+ 0 0 109 -21,-2.7 -1,-0.2 -2,-0.4 -20,-0.1 0.951 90.5 45.4 -64.2 -47.9 29.0 38.0 7.1 49 64 A E T 4 S+ 0 0 93 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.730 130.6 20.0 -71.1 -25.8 31.9 40.3 7.9 50 65 A S T 4 S- 0 0 64 2,-0.2 -2,-0.2 0, 0.0 -1,-0.2 0.701 92.8-128.2-110.9 -32.3 31.9 39.8 11.7 51 66 A G < + 0 0 24 -4,-1.9 2,-0.2 1,-0.3 -3,-0.1 0.455 57.2 147.5 93.9 1.9 30.1 36.6 12.2 52 67 A N - 0 0 83 -6,-0.1 -5,-3.8 1,-0.1 2,-0.4 -0.492 45.6-129.6 -76.8 137.3 27.7 38.2 14.7 53 68 A H E +B 46 0A 30 -7,-0.2 54,-0.9 -2,-0.2 2,-0.3 -0.674 31.1 174.3 -83.5 138.3 24.2 37.1 15.0 54 69 A Y E -BC 45 106A 25 -9,-2.1 -9,-3.0 -2,-0.4 2,-0.7 -0.877 34.2-120.0-133.3 164.0 21.5 39.8 14.9 55 70 A A E -BC 44 105A 9 50,-3.8 50,-3.3 -2,-0.3 2,-0.7 -0.957 30.4-158.0-110.4 110.1 17.8 39.7 14.8 56 71 A M E -BC 43 104A 7 -13,-3.2 -13,-2.6 -2,-0.7 2,-0.5 -0.830 1.9-155.6 -95.7 115.6 16.7 41.4 11.7 57 72 A K E -BC 42 103A 24 46,-3.4 46,-2.2 -2,-0.7 2,-0.5 -0.778 9.6-163.8 -87.2 128.9 13.1 42.7 11.7 58 73 A I E -BC 41 102A 15 -17,-2.9 -17,-1.2 -2,-0.5 2,-0.5 -0.951 6.5-175.1-119.2 110.2 11.7 43.1 8.1 59 74 A L E -BC 40 101A 8 42,-3.2 42,-2.5 -2,-0.5 2,-0.7 -0.934 25.1-129.4-111.8 133.0 8.6 45.2 7.6 60 75 A D E >> - C 0 100A 56 -21,-2.7 4,-1.5 -2,-0.5 3,-0.7 -0.679 11.8-148.6 -78.4 109.7 6.9 45.4 4.2 61 76 A K H 3> S+ 0 0 2 38,-2.1 4,-2.2 -2,-0.7 5,-0.2 0.819 94.4 58.0 -44.4 -45.0 6.4 49.1 3.4 62 77 A Q H 3> S+ 0 0 51 37,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.884 105.5 48.0 -57.9 -47.4 3.3 48.3 1.4 63 78 A K H <> S+ 0 0 37 -3,-0.7 4,-2.5 2,-0.2 6,-0.2 0.828 112.3 47.3 -66.0 -37.4 1.4 46.7 4.3 64 79 A V H < S+ 0 0 0 -4,-1.5 6,-0.4 2,-0.2 5,-0.3 0.891 113.1 48.8 -75.9 -32.7 2.2 49.5 6.9 65 80 A V H >< S+ 0 0 41 -4,-2.2 3,-1.3 -5,-0.2 -2,-0.2 0.970 115.5 47.2 -61.4 -47.4 1.1 52.2 4.3 66 81 A K H 3< S+ 0 0 86 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.863 112.9 44.8 -62.4 -42.3 -2.0 50.1 3.8 67 82 A L T 3< S- 0 0 62 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.171 111.9-124.5 -88.7 20.1 -2.8 49.5 7.5 68 83 A K S X S+ 0 0 79 -3,-1.3 2,-1.2 1,-0.1 3,-0.5 0.206 72.5 129.3 56.0 -2.1 -2.1 53.3 7.9 69 84 A Q T 3> + 0 0 48 -5,-0.3 4,-2.0 -6,-0.2 -4,-0.2 -0.070 23.5 119.7 -75.0 36.4 0.6 52.6 10.6 70 85 A I H 3> S+ 0 0 33 -2,-1.2 4,-1.9 -6,-0.4 -1,-0.2 0.880 73.0 50.1 -69.3 -42.5 3.4 54.7 9.0 71 86 A E H <> S+ 0 0 62 -3,-0.5 4,-3.0 2,-0.2 -1,-0.2 0.934 111.7 48.6 -66.8 -41.2 3.8 57.2 11.9 72 87 A H H > S+ 0 0 22 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.927 112.3 49.1 -63.2 -42.7 4.1 54.3 14.5 73 88 A T H X S+ 0 0 4 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.843 113.8 44.7 -60.4 -42.1 6.7 52.5 12.3 74 89 A L H X S+ 0 0 21 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.927 112.9 53.7 -66.9 -43.9 8.8 55.6 11.9 75 90 A N H X S+ 0 0 36 -4,-3.0 4,-2.4 2,-0.2 5,-0.3 0.919 106.2 52.7 -54.4 -50.5 8.3 56.2 15.7 76 91 A E H X S+ 0 0 9 -4,-2.9 4,-2.4 95,-0.2 -1,-0.2 0.915 113.5 41.9 -52.3 -51.7 9.6 52.8 16.5 77 92 A K H X S+ 0 0 0 -4,-1.7 4,-2.1 1,-0.2 5,-0.3 0.935 114.7 49.8 -68.3 -42.3 12.8 53.2 14.6 78 93 A R H X S+ 0 0 64 -4,-2.8 4,-0.9 1,-0.2 -1,-0.2 0.841 113.1 46.5 -67.8 -30.8 13.5 56.8 15.7 79 94 A I H X S+ 0 0 0 -4,-2.4 4,-1.5 -5,-0.2 3,-0.3 0.935 110.8 54.4 -72.7 -45.5 13.0 56.0 19.3 80 95 A L H < S+ 0 0 10 -4,-2.4 11,-0.5 -5,-0.3 3,-0.3 0.863 108.6 44.1 -62.2 -41.2 15.2 52.8 19.0 81 96 A Q H < S+ 0 0 26 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.808 117.1 50.5 -72.9 -21.7 18.3 54.4 17.5 82 97 A A H < S+ 0 0 0 -4,-0.9 -2,-0.2 -3,-0.3 -68,-0.2 0.650 98.9 76.0 -89.0 -18.7 17.9 57.3 20.1 83 98 A V < + 0 0 15 -4,-1.5 2,-0.2 -3,-0.3 8,-0.2 -0.455 48.8 179.9 -93.7 168.6 17.6 55.2 23.3 84 99 A N + 0 0 105 -2,-0.1 -73,-0.1 6,-0.1 -74,-0.1 -0.677 20.3 139.6-166.8 100.8 20.2 53.4 25.3 85 100 A F > - 0 0 15 -2,-0.2 3,-1.2 3,-0.2 53,-0.0 -0.975 55.0-117.0-142.8 154.0 19.3 51.5 28.5 86 101 A P T 3 S+ 0 0 34 0, 0.0 4,-0.1 0, 0.0 -1,-0.0 0.675 113.4 48.7 -68.6 -16.1 20.5 48.0 29.9 87 102 A F T 3 S+ 0 0 0 47,-0.1 80,-3.4 79,-0.1 2,-0.4 0.189 95.7 89.3-109.0 21.4 17.1 46.5 29.8 88 103 A L B < S-e 167 0B 7 -3,-1.2 2,-0.3 78,-0.3 80,-0.2 -0.909 83.4-112.1-112.6 140.3 16.3 47.5 26.2 89 104 A V - 0 0 5 78,-2.7 2,-0.4 -2,-0.4 -2,-0.1 -0.599 41.1-125.3 -67.2 124.9 17.1 45.5 22.9 90 105 A K - 0 0 38 -2,-0.3 16,-1.7 -4,-0.1 2,-0.9 -0.611 8.9-137.8 -76.1 125.2 19.8 47.6 21.2 91 106 A L E +D 105 0A 25 -11,-0.5 14,-0.2 -2,-0.4 3,-0.1 -0.774 27.2 174.6 -81.6 110.4 19.1 48.6 17.5 92 107 A E E + 0 0 82 12,-1.6 2,-0.3 -2,-0.9 13,-0.2 0.921 59.0 11.6 -83.4 -48.1 22.5 48.0 15.8 93 108 A F E -D 104 0A 54 11,-1.9 11,-2.0 2,-0.0 2,-0.3 -0.887 56.4-174.1-132.7 161.6 21.6 48.7 12.2 94 109 A S E +D 103 0A 4 -2,-0.3 -72,-2.8 9,-0.2 -71,-0.7 -0.980 18.5 135.5-155.8 144.8 18.8 50.2 10.0 95 110 A F E -D 102 0A 3 7,-1.7 7,-2.7 -2,-0.3 2,-0.3 -0.953 32.9-130.1-170.9 171.7 18.2 50.5 6.3 96 111 A K E -D 101 0A 55 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.957 9.5-164.2-139.5 153.1 15.4 50.0 3.7 97 112 A D - 0 0 41 3,-1.5 5,-0.0 -2,-0.3 225,-0.0 -0.183 51.4 -77.4-109.5-154.5 15.2 48.2 0.4 98 113 A N S S+ 0 0 42 225,-0.2 229,-1.9 -2,-0.1 224,-0.1 0.858 128.9 21.3 -79.9 -39.0 12.5 48.8 -2.3 99 114 A S S S+ 0 0 17 227,-0.1 -38,-2.1 224,-0.1 -37,-0.5 0.650 120.0 59.5 -99.4 -23.6 9.8 46.8 -0.6 100 115 A N E -C 60 0A 7 -40,-0.2 -3,-1.5 -39,-0.1 2,-0.4 -0.654 54.0-145.2-126.9 169.9 11.0 46.8 3.0 101 116 A L E -CD 59 96A 0 -42,-2.5 -42,-3.2 -2,-0.2 2,-0.5 -0.989 29.3-160.4-123.0 125.3 12.1 48.4 6.3 102 117 A Y E +CD 58 95A 0 -7,-2.7 -7,-1.7 -2,-0.4 2,-0.4 -0.953 18.7 175.6-121.2 131.0 14.8 46.7 8.3 103 118 A M E -CD 57 94A 0 -46,-2.2 -46,-3.4 -2,-0.5 2,-0.7 -0.983 14.1-160.8-124.3 112.0 15.9 47.0 11.9 104 119 A V E -CD 56 93A 0 -11,-2.0 -11,-1.9 -2,-0.4 -12,-1.6 -0.885 17.6-179.4-101.7 121.4 18.7 44.6 13.0 105 120 A M E -CD 55 91A 8 -50,-3.3 -50,-3.8 -2,-0.7 -14,-0.2 -0.744 37.4 -79.4-108.9 161.1 18.7 44.3 16.6 106 121 A E E -C 54 0A 51 -16,-1.7 2,-0.5 -2,-0.3 -52,-0.2 -0.344 49.8-111.1 -63.6 140.1 20.9 42.3 18.9 107 122 A Y - 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0 0 22 0, 0.0 3,-0.1 0, 0.0 -9,-0.1 -0.127 26.9-125.3 -64.2 151.5 -3.5 37.8 33.5 222 237 A P S S+ 0 0 19 0, 0.0 2,-0.6 0, 0.0 19,-0.2 0.827 101.9 42.8 -61.9 -32.5 -5.8 39.5 36.0 223 238 A F S S+ 0 0 3 -35,-0.3 2,-0.3 17,-0.1 8,-0.1 -0.928 75.6 146.8-126.7 105.0 -8.4 40.3 33.3 224 239 A F + 0 0 53 -2,-0.6 2,-0.3 -3,-0.1 3,-0.1 -0.938 3.3 138.1-134.3 156.4 -9.1 37.5 30.9 225 240 A A - 0 0 40 -2,-0.3 6,-0.1 1,-0.1 -37,-0.0 -0.932 58.0 -96.7-174.9-178.1 -12.2 36.3 28.9 226 241 A D S S+ 0 0 165 -2,-0.3 -1,-0.1 1,-0.1 3,-0.0 0.909 104.7 52.7 -84.1 -44.7 -13.0 35.0 25.5 227 242 A Q S >> S- 0 0 31 1,-0.1 4,-1.6 -3,-0.1 3,-0.6 -0.757 77.1-135.3 -89.7 134.2 -14.2 38.3 24.0 228 243 A P H 3> S+ 0 0 56 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.836 109.0 60.6 -36.2 -39.9 -12.1 41.5 24.1 229 244 A I H 3> S+ 0 0 107 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.880 105.4 45.9 -67.5 -36.4 -15.4 43.2 25.1 230 245 A Q H <> S+ 0 0 85 -3,-0.6 4,-1.1 2,-0.2 -1,-0.2 0.776 109.7 52.9 -78.5 -29.4 -15.6 41.0 28.2 231 246 A I H X S+ 0 0 17 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.904 110.2 50.5 -64.1 -44.5 -11.9 41.6 29.1 232 247 A Y H X S+ 0 0 64 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.869 105.0 55.1 -61.4 -41.7 -12.6 45.3 28.9 233 248 A E H X S+ 0 0 117 -4,-1.6 4,-1.1 1,-0.2 -1,-0.2 0.851 109.5 48.6 -60.6 -38.2 -15.7 45.1 31.1 234 249 A K H X S+ 0 0 82 -4,-1.1 4,-1.6 1,-0.2 -2,-0.2 0.856 110.8 50.5 -70.6 -35.9 -13.4 43.5 33.7 235 250 A I H < S+ 0 0 0 -4,-1.6 -2,-0.2 2,-0.2 -1,-0.2 0.866 108.5 48.5 -72.7 -40.8 -10.7 46.1 33.4 236 251 A V H < S+ 0 0 49 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.828 115.8 43.2 -74.4 -30.6 -12.8 49.3 33.8 237 252 A S H < S- 0 0 82 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.901 94.3-170.9 -68.7 -38.4 -14.6 47.8 36.9 238 253 A G < + 0 0 7 -4,-1.6 2,-0.4 1,-0.2 -3,-0.1 0.411 22.3 154.9 64.7 7.4 -11.0 46.9 37.7 239 254 A K - 0 0 85 -5,-0.2 2,-0.3 1,-0.0 -1,-0.2 -0.527 29.5-156.8 -69.2 117.4 -12.0 44.7 40.7 240 255 A V - 0 0 36 -2,-0.4 2,-0.5 -3,-0.1 -17,-0.1 -0.779 12.6-152.2 -97.7 143.6 -9.1 42.2 40.9 241 256 A R - 0 0 77 -2,-0.3 -2,-0.0 -19,-0.2 0, 0.0 -0.978 21.7-148.2-110.3 126.7 -9.3 38.8 42.5 242 257 A F - 0 0 40 -2,-0.5 2,-0.1 4,-0.0 -28,-0.0 -0.740 15.6-110.8 -97.8 145.1 -5.9 37.7 43.8 243 258 A P > - 0 0 13 0, 0.0 3,-1.4 0, 0.0 8,-0.1 -0.491 28.4-123.6 -60.5 140.9 -4.5 34.2 44.1 244 259 A S T 3 S+ 0 0 116 1,-0.3 -2,-0.0 -2,-0.1 0, 0.0 0.810 109.0 62.1 -59.2 -33.1 -4.1 33.0 47.7 245 260 A H T 3 S+ 0 0 71 2,-0.0 -1,-0.3 -27,-0.0 2,-0.1 0.683 80.8 106.1 -67.1 -18.2 -0.3 32.3 47.3 246 261 A F S < S- 0 0 5 -3,-1.4 -4,-0.0 1,-0.1 -32,-0.0 -0.441 75.7-122.7 -64.0 132.3 0.1 36.0 46.6 247 262 A S > - 0 0 38 -2,-0.1 4,-2.4 1,-0.1 5,-0.1 -0.239 19.4-110.6 -70.4 165.5 1.7 37.8 49.5 248 263 A S H > S+ 0 0 97 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.896 120.4 53.9 -62.5 -39.5 0.1 40.7 51.2 249 264 A D H > S+ 0 0 70 2,-0.2 4,-2.4 1,-0.2 32,-0.3 0.909 108.5 47.6 -58.5 -50.9 2.8 42.9 49.8 250 265 A L H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.941 110.8 51.3 -59.8 -50.1 2.2 41.8 46.2 251 266 A K H X S+ 0 0 49 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.841 111.8 48.8 -55.0 -35.3 -1.6 42.3 46.6 252 267 A D H X S+ 0 0 71 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.916 111.5 46.2 -74.8 -44.8 -0.9 45.9 47.9 253 268 A L H >X S+ 0 0 0 -4,-2.4 4,-1.5 1,-0.2 3,-1.0 0.980 114.8 49.2 -59.1 -51.5 1.5 46.9 45.1 254 269 A L H 3X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.3 -2,-0.2 0.759 106.0 55.9 -60.6 -31.4 -0.9 45.4 42.5 255 270 A R H 3< S+ 0 0 124 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.846 113.6 41.6 -68.8 -28.3 -3.9 47.2 44.0 256 271 A N H << S+ 0 0 38 -4,-1.3 10,-2.5 -3,-1.0 3,-0.3 0.680 118.7 43.9 -88.3 -22.7 -2.1 50.5 43.5 257 272 A L H < S+ 0 0 0 -4,-1.5 2,-0.4 8,-0.2 -2,-0.2 0.822 114.8 50.5 -85.2 -47.7 -0.7 49.7 40.1 258 273 A L S < S+ 0 0 6 -4,-2.6 2,-0.7 -5,-0.2 -1,-0.2 -0.125 80.3 140.7 -86.9 42.2 -4.1 48.3 39.0 259 274 A Q - 0 0 58 -2,-0.4 6,-0.1 -3,-0.3 5,-0.1 -0.768 43.6-156.7 -88.3 116.2 -5.9 51.4 40.2 260 275 A V S S+ 0 0 47 -2,-0.7 2,-1.1 -23,-0.1 -1,-0.2 0.872 79.8 78.3 -59.8 -41.6 -8.6 52.4 37.8 261 276 A D S > S- 0 0 71 1,-0.2 3,-2.2 -3,-0.1 4,-0.3 -0.657 73.6-157.0 -78.4 104.8 -8.5 56.0 38.9 262 277 A L G > S+ 0 0 51 -2,-1.1 3,-0.7 1,-0.3 -1,-0.2 0.729 88.4 60.7 -50.3 -34.8 -5.5 57.3 37.1 263 278 A T G 3 S+ 0 0 94 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.540 109.1 44.2 -79.3 -5.8 -4.9 60.1 39.6 264 279 A K G < S+ 0 0 121 -3,-2.2 2,-0.2 -5,-0.1 -1,-0.2 0.303 89.7 111.4-115.5 1.0 -4.5 57.5 42.4 265 280 A R S X S- 0 0 0 -3,-0.7 3,-1.3 -4,-0.3 -8,-0.2 -0.558 73.5-105.8 -85.5 140.8 -2.2 55.0 40.6 266 281 A F T 3 S+ 0 0 25 -10,-2.5 7,-0.1 1,-0.2 -1,-0.1 -0.387 106.1 31.5 -64.0 140.4 1.4 54.4 41.5 267 282 A G T 3 S+ 0 0 1 5,-1.1 6,-0.3 -2,-0.1 -1,-0.2 -0.046 116.5 62.6 96.3 -29.2 4.0 55.9 39.0 268 283 A N S < S+ 0 0 35 -3,-1.3 -2,-0.2 4,-0.2 -3,-0.1 0.297 83.1 97.8-106.1 5.8 1.5 58.7 38.3 269 284 A L S > S- 0 0 53 3,-0.3 3,-0.6 -4,-0.2 -5,-0.1 -0.233 92.8 -93.4 -85.3-175.7 1.4 60.2 41.9 270 285 A K T 3 S+ 0 0 207 1,-0.2 3,-0.1 2,-0.1 -1,-0.1 0.910 130.3 47.9 -66.5 -37.1 3.4 63.2 43.2 271 286 A N T > S- 0 0 74 1,-0.2 3,-1.5 2,-0.1 -1,-0.2 0.647 97.2-173.9 -77.0 -7.7 6.1 61.0 44.5 272 287 A G T X + 0 0 16 -3,-0.6 3,-1.4 1,-0.3 -5,-1.1 -0.278 60.6 4.4 63.2-128.6 6.0 59.2 41.1 273 288 A V T >> S+ 0 0 24 -6,-0.3 4,-2.6 1,-0.3 3,-1.6 0.780 119.9 74.6 -62.3 -25.0 8.1 56.1 40.5 274 289 A N H <> S+ 0 0 62 -3,-1.5 4,-2.5 1,-0.3 -1,-0.3 0.738 83.2 64.6 -65.6 -25.2 9.2 56.2 44.2 275 290 A D H <4 S+ 0 0 36 -3,-1.4 -1,-0.3 2,-0.2 -2,-0.2 0.789 112.8 36.1 -66.7 -25.8 5.9 55.0 45.4 276 291 A I H X4 S+ 0 0 0 -3,-1.6 3,-1.6 -4,-0.4 6,-0.2 0.879 118.3 49.5 -86.3 -49.2 6.7 51.7 43.4 277 292 A K H 3< S+ 0 0 36 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.826 115.8 43.7 -60.5 -33.5 10.5 51.7 44.2 278 293 A N T 3< S+ 0 0 123 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.1 0.274 86.3 120.7 -96.0 7.2 9.8 52.3 47.9 279 294 A H S X S- 0 0 17 -3,-1.6 3,-1.7 1,-0.1 -3,-0.1 -0.465 72.8-123.3 -72.7 144.2 7.0 49.7 48.2 280 295 A K G > S+ 0 0 52 1,-0.3 3,-0.9 2,-0.2 4,-0.3 0.620 110.2 69.1 -65.0 -14.6 7.6 46.9 50.6 281 296 A W G 3 S+ 0 0 1 -32,-0.3 -1,-0.3 1,-0.2 3,-0.2 0.769 109.6 38.8 -70.2 -23.3 7.1 44.3 47.8 282 297 A F G X S+ 0 0 3 -3,-1.7 3,-1.7 -6,-0.2 -1,-0.2 0.138 84.0 115.0-105.3 16.3 10.5 45.8 46.6 283 298 A A T < S+ 0 0 77 -3,-0.9 -1,-0.1 1,-0.3 -2,-0.1 0.848 80.3 43.3 -58.4 -37.1 11.9 46.2 50.1 284 299 A T T 3 S+ 0 0 124 -4,-0.3 2,-0.5 -3,-0.2 -1,-0.3 0.396 91.3 109.3 -89.9 5.4 14.7 43.6 49.5 285 300 A T < - 0 0 24 -3,-1.7 2,-1.0 -8,-0.1 3,-0.1 -0.713 57.8-153.0 -86.5 125.1 15.5 45.0 45.9 286 301 A D > - 0 0 97 -2,-0.5 4,-1.9 1,-0.2 5,-0.2 -0.854 12.4-162.2 -96.0 101.2 18.8 46.9 45.5 287 302 A W H > S+ 0 0 37 -2,-1.0 4,-1.6 1,-0.2 -1,-0.2 0.766 84.2 47.2 -58.6 -30.8 17.8 49.1 42.7 288 303 A I H > S+ 0 0 108 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.882 109.0 53.6 -81.7 -36.7 21.3 50.0 41.6 289 304 A A H 4>S+ 0 0 12 2,-0.2 5,-2.7 1,-0.2 6,-0.7 0.807 108.7 51.0 -68.3 -26.2 22.5 46.5 41.7 290 305 A I H ><5S+ 0 0 6 -4,-1.9 3,-0.9 3,-0.2 -1,-0.2 0.951 113.7 44.7 -68.1 -48.0 19.6 45.5 39.4 291 306 A Y H 3<5S+ 0 0 79 -4,-1.6 -2,-0.2 1,-0.3 -3,-0.1 0.892 115.7 45.9 -57.5 -46.4 20.6 48.4 37.1 292 307 A Q T 3<5S- 0 0 114 -4,-3.2 -1,-0.3 -5,-0.1 -2,-0.2 0.505 112.3-125.8 -75.7 -5.9 24.3 47.4 37.3 293 308 A R T < 5 + 0 0 66 -3,-0.9 -3,-0.2 -4,-0.2 4,-0.1 0.802 69.5 134.0 60.3 36.5 23.2 43.8 36.8 294 309 A K < + 0 0 156 -5,-2.7 2,-0.4 -6,-0.2 -4,-0.2 0.258 40.3 97.9 -93.8 7.3 25.0 42.7 39.9 295 310 A V S S- 0 0 49 -6,-0.7 2,-0.6 -5,-0.2 0, 0.0 -0.849 83.5-111.4 -98.2 137.6 22.0 40.6 41.2 296 311 A E - 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