==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 17-SEP-04 1XHA . COMPND 2 MOLECULE: CAMP-DEPENDENT PROTEIN KINASE, ALPHA-CATALYTIC . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR C.B.BREITENLECHNER,W.-G.FRIEBE,E.BRUNET,G.WERNER,K.GRAUL, . 370 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17314.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 237 64.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 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 0.5 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 . 23 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 109 29.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 1 2 0 1 0 2 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 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 1 2 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 1 A G >> 0 0 99 0, 0.0 3,-1.0 0, 0.0 4,-0.9 0.000 360.0 360.0 360.0 -68.0 36.9 32.3 12.4 2 2 A N H 3> + 0 0 150 1,-0.3 4,-1.1 2,-0.2 5,-0.1 0.689 360.0 54.7 -62.8 -25.1 38.8 29.4 13.9 3 3 A A H 3> S+ 0 0 82 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.825 107.8 50.6 -74.3 -35.0 39.1 30.8 17.4 4 4 A A H <> S+ 0 0 64 -3,-1.0 4,-1.9 2,-0.2 -2,-0.2 0.634 107.6 54.5 -74.8 -18.4 35.3 31.2 17.5 5 5 A A H X S+ 0 0 67 -4,-0.9 4,-1.4 2,-0.2 -2,-0.2 0.739 111.4 43.2 -83.5 -30.2 34.9 27.6 16.4 6 6 A A H < S+ 0 0 66 -4,-1.1 -2,-0.2 2,-0.2 -3,-0.1 0.847 118.4 46.8 -75.9 -36.4 37.1 26.4 19.3 7 7 A K H >X S+ 0 0 113 -4,-1.9 4,-1.8 1,-0.2 3,-0.8 0.918 118.1 40.7 -68.7 -46.5 35.2 28.8 21.6 8 8 A K H 3X S+ 0 0 61 -4,-1.9 4,-1.2 1,-0.2 2,-0.2 0.876 112.4 56.1 -67.2 -38.5 31.8 27.7 20.2 9 9 A G H 3< S+ 0 0 38 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.1 0.005 116.5 35.6 -86.0 32.1 32.8 24.0 20.2 10 10 A S H <> S+ 0 0 68 -3,-0.8 4,-1.4 -2,-0.2 -1,-0.2 0.371 104.2 65.3-157.3 -42.0 33.7 24.1 23.9 11 11 A E H X S+ 0 0 44 -4,-1.8 4,-1.3 1,-0.2 -2,-0.2 0.831 102.8 55.8 -49.4 -40.8 31.1 26.5 25.3 12 12 A Q H X S+ 0 0 109 -4,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.770 104.4 49.6 -71.1 -29.9 28.7 23.7 24.2 13 13 A E H > S+ 0 0 118 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.796 110.2 51.2 -76.3 -33.9 30.5 21.0 26.3 14 14 A S H X S+ 0 0 81 -4,-1.4 4,-1.8 2,-0.2 -2,-0.2 0.828 112.1 48.1 -67.5 -34.9 30.5 23.2 29.3 15 15 A V H X S+ 0 0 47 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.913 108.1 52.2 -77.3 -46.6 26.7 23.7 28.7 16 16 A K H X S+ 0 0 64 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.881 116.2 42.8 -53.7 -38.6 26.0 19.9 28.3 17 17 A E H X S+ 0 0 157 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.822 111.2 53.7 -82.3 -30.7 27.8 19.4 31.6 18 18 A F H X S+ 0 0 69 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.931 111.1 47.1 -62.4 -44.2 26.2 22.4 33.4 19 19 A L H X S+ 0 0 35 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.871 107.8 53.9 -70.9 -41.7 22.7 21.1 32.5 20 20 A A H X S+ 0 0 61 -4,-1.5 4,-1.4 1,-0.2 -1,-0.2 0.902 112.0 45.3 -55.6 -45.5 23.4 17.5 33.6 21 21 A K H X S+ 0 0 129 -4,-1.5 4,-1.5 1,-0.2 -1,-0.2 0.776 111.5 53.8 -72.4 -29.4 24.5 18.7 37.1 22 22 A A H X S+ 0 0 7 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.845 104.9 53.8 -71.3 -34.9 21.5 21.0 37.2 23 23 A K H X S+ 0 0 63 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.834 109.1 49.7 -68.2 -34.8 19.1 18.1 36.4 24 24 A E H X S+ 0 0 140 -4,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.874 112.2 46.1 -66.2 -45.4 20.6 16.2 39.4 25 25 A D H X S+ 0 0 48 -4,-1.5 4,-1.5 2,-0.2 -2,-0.2 0.868 116.4 46.1 -64.6 -41.2 20.2 19.2 41.8 26 26 A F H X S+ 0 0 1 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.948 110.8 50.9 -67.6 -52.8 16.7 19.8 40.7 27 27 A L H X S+ 0 0 56 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.858 106.6 56.9 -55.2 -37.7 15.6 16.2 40.8 28 28 A K H < S+ 0 0 141 -4,-1.8 4,-0.3 1,-0.2 -1,-0.2 0.945 115.7 34.0 -58.1 -52.4 17.0 15.9 44.4 29 29 A K H < S+ 0 0 94 -4,-1.5 3,-0.3 68,-0.2 -2,-0.2 0.779 116.0 58.5 -78.0 -27.0 14.8 18.8 45.7 30 30 A W H < S+ 0 0 24 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.868 109.4 42.5 -65.5 -40.9 11.9 17.9 43.3 31 31 A E S < S+ 0 0 120 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.488 131.4 27.1 -85.3 -1.7 11.6 14.3 44.8 32 32 A N S S- 0 0 135 -3,-0.3 -1,-0.2 -4,-0.3 -2,-0.1 -0.441 83.4-162.8-160.0 71.1 12.0 15.8 48.3 33 33 A P - 0 0 39 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 -0.246 24.3-110.5 -68.3 147.2 10.8 19.4 48.8 34 34 A A - 0 0 50 59,-0.1 2,-0.3 -5,-0.1 3,-0.1 -0.576 41.3-173.2 -75.1 135.1 11.7 21.7 51.6 35 35 A Q + 0 0 91 -2,-0.3 75,-0.1 1,-0.2 315,-0.1 -0.891 51.6 7.0-126.9 155.7 8.7 22.4 53.9 36 36 A N + 0 0 119 -2,-0.3 74,-0.2 1,-0.1 -1,-0.2 0.840 64.0 155.7 42.2 57.7 8.0 24.6 56.9 37 37 A T + 0 0 67 72,-2.1 2,-0.3 -3,-0.1 73,-0.2 0.309 64.0 1.8 -96.1 7.1 11.3 26.6 56.9 38 38 A A - 0 0 10 71,-0.5 2,-0.3 73,-0.1 73,-0.2 -0.922 65.7-120.2-165.7-161.6 9.8 29.7 58.6 39 39 A H > - 0 0 81 -2,-0.3 3,-1.2 71,-0.1 4,-0.1 -0.990 25.8-114.2-156.9 150.7 6.8 31.3 60.3 40 40 A L G > S+ 0 0 14 -2,-0.3 3,-1.9 1,-0.2 -1,-0.1 0.886 108.6 58.5 -57.3 -48.6 4.7 34.4 59.8 41 41 A D G 3 S+ 0 0 125 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 0.558 89.3 75.2 -72.7 -6.8 5.5 36.2 63.0 42 42 A Q G < S+ 0 0 70 -3,-1.2 21,-2.1 20,-0.1 22,-0.4 0.490 95.2 59.8 -70.3 -9.5 9.3 36.3 62.1 43 43 A F E < S-A 62 0A 7 -3,-1.9 2,-0.4 19,-0.2 19,-0.2 -0.967 74.3-138.3-125.3 140.4 8.5 39.1 59.5 44 44 A E E -A 61 0A 101 17,-2.9 17,-2.2 -2,-0.4 2,-0.6 -0.809 26.1-133.5 -89.1 137.9 7.1 42.6 59.8 45 45 A R E +A 60 0A 82 -2,-0.4 15,-0.2 15,-0.2 3,-0.1 -0.840 34.8 162.1-100.4 123.9 4.6 43.3 57.0 46 46 A I E - 0 0 69 13,-2.1 2,-0.3 -2,-0.6 14,-0.2 0.858 51.3 -14.7-107.2 -53.1 5.2 46.7 55.3 47 47 A K E -A 59 0A 37 12,-1.4 12,-3.5 282,-0.0 2,-0.5 -0.986 55.6-106.3-164.0 145.2 3.5 47.0 51.9 48 48 A T E +A 58 0A 0 -2,-0.3 282,-0.4 10,-0.3 10,-0.3 -0.675 24.3 178.8 -77.8 124.3 1.8 45.3 49.0 49 49 A L E - 0 0 6 8,-1.9 279,-0.3 -2,-0.5 2,-0.3 0.494 68.2 -19.8 -95.6 -12.0 3.9 45.1 45.8 50 50 A G E -A 57 0A 10 7,-1.2 7,-1.7 277,-0.1 -1,-0.3 -0.962 57.6-138.1 176.7 167.0 1.3 43.2 43.8 51 51 A T E +A 56 0A 78 -2,-0.3 5,-0.3 5,-0.3 2,-0.3 -0.901 13.9 175.2-139.0 167.7 -1.8 41.0 43.8 52 52 A G E > -A 55 0A 50 3,-2.3 3,-1.0 -2,-0.3 315,-0.0 -0.875 53.0 -62.7-155.8-168.8 -3.3 37.9 42.2 53 53 A S T 3 S+ 0 0 96 -2,-0.3 3,-0.1 1,-0.2 21,-0.0 0.807 127.2 26.8 -54.5 -43.3 -6.4 35.6 42.4 54 54 A F T 3 S- 0 0 16 24,-0.0 21,-2.5 25,-0.0 2,-0.3 0.276 127.9 -49.1-111.1 9.0 -5.9 34.2 45.9 55 55 A G E < -AB 52 74A 21 -3,-1.0 -3,-2.3 19,-0.2 2,-0.3 -0.956 64.5 -75.7 159.5-139.2 -3.9 36.9 47.7 56 56 A R E -AB 51 73A 33 17,-1.6 17,-3.1 -2,-0.3 2,-0.4 -0.978 20.9-114.9-159.8 156.7 -0.8 39.2 47.4 57 57 A V E -AB 50 72A 31 -7,-1.7 -8,-1.9 -2,-0.3 -7,-1.2 -0.873 38.9-167.2 -99.7 135.4 2.9 39.7 47.4 58 58 A M E -AB 48 71A 9 13,-2.7 13,-2.7 -2,-0.4 2,-0.4 -0.956 27.6-119.7-126.9 139.5 4.2 42.0 50.2 59 59 A L E +AB 47 70A 0 -12,-3.5 -13,-2.1 -2,-0.4 -12,-1.4 -0.686 47.9 175.0 -61.1 127.7 7.4 43.8 51.0 60 60 A V E -AB 45 69A 0 9,-2.5 9,-2.6 -2,-0.4 2,-0.4 -0.939 28.3-135.2-138.8 158.9 8.3 42.3 54.4 61 61 A K E -AB 44 68A 72 -17,-2.2 -17,-2.9 -2,-0.3 2,-0.7 -0.989 14.6-138.4-119.0 124.3 11.3 42.6 56.9 62 62 A H E >> -AB 43 67A 17 5,-2.6 4,-3.2 -2,-0.4 5,-0.5 -0.748 18.4-149.0 -81.6 112.7 12.8 39.4 58.5 63 63 A M T 45S+ 0 0 90 -21,-2.1 -1,-0.1 -2,-0.7 -20,-0.1 0.797 88.0 55.5 -67.0 -34.8 13.4 40.6 62.1 64 64 A E T 45S+ 0 0 180 -22,-0.4 -1,-0.2 1,-0.2 -21,-0.1 0.926 127.9 18.0 -61.8 -43.2 16.4 38.6 63.0 65 65 A T T 45S- 0 0 75 -3,-0.4 -2,-0.2 2,-0.1 -1,-0.2 0.727 91.0-130.9 -96.4 -23.4 18.5 39.9 60.0 66 66 A G T <5 + 0 0 24 -4,-3.2 2,-0.3 1,-0.3 -3,-0.2 0.562 56.1 151.7 67.9 9.5 16.6 43.0 59.0 67 67 A N E < -B 62 0A 78 -5,-0.5 -5,-2.6 -6,-0.1 2,-0.3 -0.574 42.6-131.5 -66.4 131.6 16.7 41.6 55.4 68 68 A H E +B 61 0A 41 -2,-0.3 54,-0.6 -7,-0.2 2,-0.2 -0.693 32.0 172.0 -85.6 137.3 13.8 42.6 53.2 69 69 A Y E -BC 60 121A 22 -9,-2.6 -9,-2.5 -2,-0.3 2,-0.5 -0.822 35.1-116.2-130.3 173.4 11.9 40.0 51.2 70 70 A A E -BC 59 120A 9 50,-2.6 50,-2.9 -2,-0.2 2,-0.5 -0.975 32.3-162.8-113.1 115.1 8.8 39.7 49.0 71 71 A M E -BC 58 119A 0 -13,-2.7 -13,-2.7 -2,-0.5 2,-0.6 -0.865 8.4-150.5-103.5 128.4 6.3 37.3 50.6 72 72 A K E -BC 57 118A 19 46,-3.1 46,-1.7 -2,-0.5 2,-0.6 -0.872 13.0-165.0 -95.8 122.8 3.4 35.8 48.6 73 73 A I E -BC 56 117A 9 -17,-3.1 -17,-1.6 -2,-0.6 2,-0.4 -0.956 6.3-175.0-112.9 117.5 0.4 35.1 50.7 74 74 A L E -BC 55 116A 10 42,-2.1 42,-2.3 -2,-0.6 2,-0.7 -0.907 24.5-131.5-111.1 138.2 -2.3 32.8 49.3 75 75 A D E >> - C 0 115A 43 -21,-2.5 4,-1.6 -2,-0.4 3,-0.6 -0.820 13.8-150.4 -87.0 111.8 -5.6 32.1 51.0 76 76 A K H 3> S+ 0 0 3 38,-1.9 4,-2.2 -2,-0.7 5,-0.2 0.860 92.6 57.3 -50.3 -42.0 -6.0 28.2 51.0 77 77 A Q H 3> S+ 0 0 76 37,-0.5 4,-2.1 1,-0.2 -1,-0.2 0.864 105.6 46.3 -63.1 -42.3 -9.8 28.5 50.9 78 78 A K H <> S+ 0 0 96 -3,-0.6 4,-1.5 2,-0.2 -1,-0.2 0.828 111.0 55.4 -67.9 -33.1 -10.0 30.6 47.7 79 79 A V H <>S+ 0 0 0 -4,-1.6 5,-2.0 2,-0.2 6,-0.3 0.939 109.5 44.7 -63.2 -48.5 -7.5 28.2 46.0 80 80 A V H ><5S+ 0 0 46 -4,-2.2 3,-1.6 1,-0.2 -2,-0.2 0.937 112.7 53.1 -58.9 -50.3 -9.7 25.2 46.8 81 81 A K H 3<5S+ 0 0 151 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.769 110.1 46.0 -53.8 -36.2 -12.8 27.1 45.6 82 82 A L T 3<5S- 0 0 102 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.354 112.1-119.9 -94.1 4.8 -11.2 28.0 42.2 83 83 A K T < 5S+ 0 0 176 -3,-1.6 -3,-0.2 -4,-0.3 -2,-0.1 0.924 76.4 124.2 56.8 53.1 -10.0 24.4 41.7 84 84 A E >< + 0 0 30 -5,-2.0 4,-2.4 2,-0.1 5,-0.3 0.068 20.6 119.1-127.5 20.2 -6.3 25.5 41.6 85 85 A I H > S+ 0 0 45 -6,-0.3 4,-2.5 1,-0.2 5,-0.2 0.952 80.0 49.3 -50.4 -50.5 -4.8 23.3 44.3 86 86 A E H > S+ 0 0 119 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.850 110.3 48.6 -62.7 -38.8 -2.6 21.6 41.7 87 87 A H H > S+ 0 0 17 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.869 112.5 47.5 -70.8 -41.0 -1.3 24.8 40.2 88 88 A T H X S+ 0 0 4 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.875 112.8 50.4 -64.8 -38.0 -0.5 26.4 43.6 89 89 A L H X S+ 0 0 9 -4,-2.5 4,-2.2 -5,-0.3 -2,-0.2 0.884 109.9 50.2 -69.0 -36.3 1.3 23.1 44.5 90 90 A N H X S+ 0 0 15 -4,-2.2 4,-2.4 1,-0.2 5,-0.3 0.898 106.8 56.3 -65.1 -43.4 3.3 23.1 41.3 91 91 A E H X S+ 0 0 9 -4,-2.0 4,-2.6 95,-0.2 -2,-0.2 0.930 113.8 36.6 -53.5 -53.2 4.4 26.7 41.8 92 92 A K H X S+ 0 0 5 -4,-1.6 4,-2.7 1,-0.2 5,-0.3 0.962 116.2 52.8 -71.1 -50.6 5.9 26.1 45.3 93 93 A R H X S+ 0 0 61 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.810 115.6 42.3 -51.5 -34.9 7.3 22.6 44.4 94 94 A I H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 3,-0.4 0.932 112.9 49.5 -82.5 -48.2 9.0 24.1 41.3 95 95 A L H < S+ 0 0 7 -4,-2.6 11,-0.4 -5,-0.3 -2,-0.2 0.919 110.9 51.0 -56.4 -42.4 10.4 27.4 42.9 96 96 A Q H < S+ 0 0 20 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.811 116.3 41.5 -70.0 -27.1 11.9 25.5 45.8 97 97 A A H < S+ 0 0 2 -4,-0.8 -1,-0.2 -3,-0.4 -68,-0.2 0.694 99.3 86.0 -88.9 -24.0 13.6 23.0 43.4 98 98 A V < - 0 0 13 -4,-2.1 2,-0.2 -3,-0.2 8,-0.2 -0.335 48.4-179.2 -84.1 162.6 14.9 25.5 40.7 99 99 A N + 0 0 96 -2,-0.1 5,-0.1 6,-0.1 -73,-0.1 -0.720 20.5 127.6-165.7 110.2 18.1 27.5 40.6 100 100 A F > - 0 0 18 3,-0.3 3,-2.0 -2,-0.2 53,-0.0 -0.982 61.7-106.9-163.8 149.4 19.4 29.9 38.0 101 101 A P T 3 S+ 0 0 35 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.797 118.0 43.9 -58.5 -29.8 20.7 33.5 37.9 102 102 A F T 3 S+ 0 0 0 47,-0.1 80,-2.9 79,-0.1 2,-0.5 0.213 95.1 92.4-101.9 18.3 17.5 34.9 36.3 103 103 A L B < S-e 182 0B 5 -3,-2.0 -3,-0.3 78,-0.3 80,-0.1 -0.949 85.3-110.4-109.1 127.2 14.9 33.0 38.5 104 104 A V - 0 0 7 78,-2.0 2,-0.4 -2,-0.5 -2,-0.1 -0.208 38.6-125.1 -47.0 126.4 13.5 34.6 41.6 105 105 A K - 0 0 101 -4,-0.1 16,-2.0 -6,-0.1 2,-0.6 -0.714 11.5-141.0 -82.5 130.7 15.0 32.7 44.5 106 106 A L E +D 120 0A 21 -11,-0.4 14,-0.3 -2,-0.4 3,-0.1 -0.845 21.9 178.1 -84.5 121.8 12.6 31.2 47.1 107 107 A E E - 0 0 65 12,-2.8 2,-0.3 -2,-0.6 13,-0.2 0.911 62.2 -3.3 -87.9 -58.4 14.2 31.6 50.6 108 108 A F E -D 119 0A 39 11,-1.3 11,-2.7 2,-0.0 -1,-0.3 -0.901 57.1-172.0-128.7 160.9 11.5 30.2 52.9 109 109 A S E +D 118 0A 3 -2,-0.3 -72,-2.1 9,-0.2 -71,-0.5 -0.970 17.0 148.2-147.8 149.5 8.1 28.8 52.6 110 110 A F E -D 117 0A 2 7,-1.6 7,-2.5 -2,-0.3 2,-0.3 -0.956 26.1-136.8-160.7 177.7 5.5 27.8 55.2 111 111 A K E -D 116 0A 63 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.983 9.4-171.1-142.4 152.7 1.8 27.5 56.0 112 112 A D - 0 0 26 3,-2.0 230,-0.1 -2,-0.3 -2,-0.0 -0.780 55.8 -70.4-128.8-177.5 -0.6 28.2 58.9 113 113 A N S S+ 0 0 51 -2,-0.3 229,-2.1 225,-0.2 226,-0.1 0.793 129.2 23.8 -40.3 -37.3 -4.2 27.4 59.4 114 114 A S S S+ 0 0 9 224,-0.1 -38,-1.9 227,-0.1 -37,-0.5 0.883 116.2 33.1-100.7 -45.9 -5.3 29.9 56.8 115 115 A N E -C 75 0A 11 -40,-0.2 -3,-2.0 -39,-0.1 2,-0.3 -0.733 56.4-127.8-127.1 160.1 -2.6 30.6 54.2 116 116 A L E -CD 74 111A 0 -42,-2.3 -42,-2.1 -2,-0.3 2,-0.4 -0.821 30.6-157.6 -97.0 146.8 0.3 29.5 52.2 117 117 A Y E +CD 73 110A 0 -7,-2.5 -7,-1.6 -2,-0.3 2,-0.4 -0.985 17.2 180.0-134.4 134.8 3.5 31.6 52.3 118 118 A M E -CD 72 109A 0 -46,-1.7 -46,-3.1 -2,-0.4 2,-0.6 -0.981 11.8-161.4-132.6 121.7 6.4 31.9 49.9 119 119 A V E +CD 71 108A 0 -11,-2.7 -12,-2.8 -2,-0.4 -11,-1.3 -0.908 20.6 173.3-108.5 119.1 9.2 34.3 50.9 120 120 A M E -CD 70 106A 8 -50,-2.9 -50,-2.6 -2,-0.6 -14,-0.2 -0.772 39.8 -75.1-125.2 164.6 11.4 35.3 48.0 121 121 A E E -C 69 0A 84 -16,-2.0 2,-0.4 -2,-0.3 -52,-0.2 -0.341 50.9-119.0 -54.4 137.7 14.2 37.7 47.2 122 122 A Y - 0 0 29 -54,-0.6 -1,-0.1 -62,-0.1 -54,-0.1 -0.716 20.2-161.2 -80.1 129.9 13.1 41.3 46.9 123 123 A A > - 0 0 7 -2,-0.4 3,-1.6 52,-0.1 51,-0.3 -0.898 4.4-171.6-112.4 95.3 13.7 42.9 43.5 124 124 A P T 3 S+ 0 0 29 0, 0.0 202,-0.5 0, 0.0 51,-0.2 0.526 73.7 78.8 -71.1 -4.5 13.5 46.7 44.2 125 125 A G T 3 S- 0 0 0 49,-1.5 50,-0.2 1,-0.2 192,-0.1 0.630 92.0-143.7 -71.6 -17.1 13.6 47.5 40.5 126 126 A G < - 0 0 0 -3,-1.6 48,-2.6 48,-0.3 2,-0.2 -0.227 40.2 -32.2 75.6-172.8 9.9 46.6 40.1 127 127 A E B >> -F 173 0B 18 199,-0.4 4,-1.1 46,-0.2 3,-0.5 -0.542 45.2-128.6 -82.4 143.3 8.5 44.8 37.1 128 128 A M H 3> S+ 0 0 0 44,-3.0 4,-2.5 41,-0.5 3,-0.4 0.928 109.6 69.4 -44.5 -46.7 9.8 45.3 33.5 129 129 A F H 3> S+ 0 0 13 40,-2.0 4,-1.9 43,-0.2 5,-0.2 0.897 95.8 51.0 -38.1 -55.5 6.1 46.0 32.8 130 130 A S H <> S+ 0 0 24 -3,-0.5 4,-1.5 1,-0.2 -1,-0.2 0.865 114.5 40.1 -59.9 -45.7 6.3 49.3 34.7 131 131 A H H X S+ 0 0 2 -4,-1.1 4,-1.8 -3,-0.4 -1,-0.2 0.762 110.8 60.4 -72.8 -27.2 9.4 50.7 32.9 132 132 A L H X S+ 0 0 0 -4,-2.5 4,-1.1 -5,-0.2 -2,-0.2 0.921 111.2 38.8 -66.9 -37.9 8.2 49.4 29.5 133 133 A R H < S+ 0 0 54 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.836 115.0 51.7 -81.4 -37.3 5.0 51.5 29.7 134 134 A R H < S+ 0 0 161 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.940 118.4 36.9 -63.5 -46.5 6.5 54.6 31.2 135 135 A I H < S- 0 0 80 -4,-1.8 2,-0.7 1,-0.1 -2,-0.2 0.677 102.7-131.6 -83.1 -21.0 9.3 54.8 28.6 136 136 A G S < S- 0 0 24 -4,-1.1 2,-0.3 -5,-0.2 -1,-0.1 -0.491 70.4 -10.5 99.7 -63.1 7.2 53.6 25.7 137 137 A R - 0 0 114 -2,-0.7 2,-0.3 -6,-0.1 95,-0.2 -0.985 65.2-111.1-159.8 168.2 9.6 51.1 24.4 138 138 A F - 0 0 6 93,-2.4 2,-0.1 -2,-0.3 96,-0.0 -0.736 33.2-111.5-103.6 151.2 13.1 49.7 24.6 139 139 A S > - 0 0 60 -2,-0.3 4,-2.2 1,-0.1 3,-0.4 -0.414 37.9-105.3 -74.4 158.8 15.8 49.9 22.0 140 140 A E H > S+ 0 0 32 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.885 122.0 50.7 -56.7 -47.0 16.8 46.6 20.3 141 141 A P H > S+ 0 0 78 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.850 113.3 48.5 -57.2 -33.7 20.1 46.3 22.3 142 142 A H H > S+ 0 0 16 -3,-0.4 4,-1.1 2,-0.2 -2,-0.2 0.807 113.9 45.4 -71.1 -36.8 18.0 46.9 25.5 143 143 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.873 111.6 53.0 -73.6 -36.7 15.5 44.4 24.4 144 144 A R H X S+ 0 0 38 -4,-2.8 4,-2.1 2,-0.2 5,-0.2 0.828 101.3 58.6 -72.8 -34.3 18.1 41.9 23.5 145 145 A F H X S+ 0 0 10 -4,-1.6 4,-0.9 1,-0.2 -1,-0.2 0.946 113.8 40.0 -58.0 -46.0 19.9 42.2 26.8 146 146 A Y H X S+ 0 0 1 -4,-1.1 4,-1.4 1,-0.2 3,-0.3 0.884 112.5 55.1 -69.2 -38.3 16.6 41.0 28.4 147 147 A A H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.850 101.8 56.6 -66.8 -41.3 15.8 38.4 25.7 148 148 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.840 104.9 52.8 -58.1 -38.9 19.0 36.6 26.1 149 149 A Q H X S+ 0 0 0 -4,-0.9 4,-1.6 -3,-0.3 -1,-0.2 0.885 111.6 46.7 -65.6 -37.4 18.3 36.1 29.8 150 150 A I H X S+ 0 0 0 -4,-1.4 4,-2.1 2,-0.2 5,-0.2 0.923 108.5 55.0 -70.6 -39.8 14.9 34.6 28.8 151 151 A V H X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.923 113.3 40.8 -57.9 -49.1 16.4 32.4 26.2 152 152 A L H X S+ 0 0 12 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.814 111.2 58.2 -69.2 -30.8 18.9 30.8 28.7 153 153 A T H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.867 109.9 42.8 -66.5 -37.2 16.2 30.6 31.3 154 154 A F H X S+ 0 0 0 -4,-2.1 4,-3.3 2,-0.2 5,-0.4 0.866 107.7 59.4 -78.5 -35.4 14.0 28.5 29.1 155 155 A E H X S+ 0 0 29 -4,-1.9 4,-1.3 -5,-0.2 -2,-0.2 0.923 111.5 43.6 -55.6 -43.9 16.9 26.4 28.0 156 156 A Y H X S+ 0 0 6 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.969 116.7 43.3 -60.6 -58.0 17.3 25.6 31.7 157 157 A L H ><>S+ 0 0 3 -4,-2.4 5,-2.8 1,-0.2 3,-0.6 0.902 113.6 50.9 -62.3 -44.5 13.6 25.1 32.5 158 158 A H H ><5S+ 0 0 22 -4,-3.3 3,-1.7 1,-0.2 -1,-0.2 0.848 104.4 57.8 -62.4 -34.0 13.0 23.0 29.4 159 159 A S H 3<5S+ 0 0 32 -4,-1.3 -1,-0.2 -5,-0.4 -2,-0.2 0.838 106.2 51.0 -63.0 -30.4 16.0 20.8 30.2 160 160 A L T <<5S- 0 0 0 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.217 122.2-110.8 -86.3 11.7 14.1 20.1 33.5 161 161 A D T < 5S+ 0 0 34 -3,-1.7 30,-3.0 1,-0.2 2,-0.2 0.678 74.7 141.2 61.9 21.5 11.0 19.2 31.6 162 162 A L E < -H 190 0C 2 -5,-2.8 2,-0.4 28,-0.2 -1,-0.2 -0.630 39.1-160.3 -92.9 151.9 9.4 22.4 32.9 163 163 A I E -H 189 0C 4 26,-1.7 26,-1.7 -2,-0.2 54,-0.1 -0.999 3.2-162.3-130.7 134.8 7.1 24.7 31.0 164 164 A Y - 0 0 1 -2,-0.4 23,-0.2 24,-0.2 -1,-0.1 0.928 10.8-176.8 -89.1 -49.5 6.6 28.2 32.3 165 165 A R + 0 0 17 52,-0.1 36,-0.2 1,-0.1 -1,-0.1 0.495 61.3 73.1 68.5 12.5 3.4 29.3 30.5 166 166 A D + 0 0 17 34,-0.1 5,-0.2 202,-0.1 2,-0.2 -0.077 53.7 159.4-148.6 45.6 3.2 32.9 31.6 167 167 A L + 0 0 3 37,-0.1 34,-0.2 3,-0.1 37,-0.1 -0.498 23.4 117.8 -72.4 134.9 5.9 35.0 29.9 168 168 A K S > S- 0 0 7 -2,-0.2 3,-2.0 35,-0.0 4,-0.1 -0.784 75.9 -94.6 171.3 149.5 5.1 38.7 29.9 169 169 A P G > S+ 0 0 0 0, 0.0 -40,-2.0 0, 0.0 3,-1.2 0.718 117.7 67.7 -51.5 -22.2 6.7 41.9 31.4 170 170 A E G 3 S+ 0 0 9 1,-0.3 -40,-0.1 -42,-0.2 -3,-0.1 0.840 102.5 45.0 -69.8 -30.8 4.5 41.7 34.4 171 171 A N G < S+ 0 0 4 -3,-2.0 12,-2.4 -5,-0.2 2,-0.6 0.131 94.0 88.4 -99.2 17.3 6.3 38.5 35.6 172 172 A L E < - G 0 182B 0 -3,-1.2 -44,-3.0 10,-0.2 -43,-0.2 -0.879 62.7-163.0-122.7 94.0 9.9 39.8 34.9 173 173 A M E -FG 127 181B 17 8,-1.9 8,-2.5 -2,-0.6 2,-0.6 -0.505 13.4-133.8 -74.7 148.0 11.3 41.6 37.9 174 174 A I E - G 0 180B 0 -48,-2.6 -49,-1.5 -51,-0.3 -48,-0.3 -0.898 22.1-150.8-104.8 120.2 14.3 43.9 37.6 175 175 A D > - 0 0 11 4,-2.8 3,-2.1 -2,-0.6 -52,-0.1 -0.204 35.5 -88.6 -86.0-179.6 17.0 43.4 40.3 176 176 A Q T 3 S+ 0 0 133 1,-0.3 -1,-0.1 2,-0.1 142,-0.1 0.683 128.7 51.6 -63.3 -19.5 19.4 46.0 41.8 177 177 A Q T 3 S- 0 0 98 2,-0.1 135,-0.4 138,-0.1 -1,-0.3 0.377 119.3-109.2 -99.3 1.2 21.9 45.1 39.0 178 178 A G S < S+ 0 0 0 -3,-2.1 2,-0.2 1,-0.3 -2,-0.1 0.530 77.9 126.0 84.0 6.0 19.4 45.6 36.2 179 179 A Y - 0 0 5 133,-0.1 -4,-2.8 1,-0.1 -1,-0.3 -0.482 62.9 -95.5 -89.3 164.3 19.1 41.9 35.3 180 180 A I E - G 0 174B 0 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.567 26.4-172.9 -83.5 142.3 15.8 39.9 35.2 181 181 A Q E - G 0 173B 12 -8,-2.5 -8,-1.9 -2,-0.2 -78,-0.3 -0.894 22.5-144.0-128.9 102.6 14.4 37.7 37.9 182 182 A V E +eG 103 172B 0 -80,-2.9 -78,-2.0 -2,-0.4 -10,-0.2 -0.462 27.3 174.1 -61.1 129.7 11.4 35.7 36.5 183 183 A T + 0 0 13 -12,-2.4 -12,-0.1 -2,-0.2 -1,-0.0 -0.660 38.6 64.9-120.5-174.9 8.5 35.2 39.1 184 184 A D + 0 0 57 -2,-0.2 3,-0.5 1,-0.1 -1,-0.1 0.994 42.6 178.8 64.5 71.3 4.9 33.9 39.3 185 185 A F > + 0 0 1 1,-0.2 3,-1.1 2,-0.1 -1,-0.1 0.037 42.2 122.0 -89.7 23.9 5.4 30.2 38.5 186 186 A G T 3 S+ 0 0 24 1,-0.3 -95,-0.2 -95,-0.1 -1,-0.2 0.825 78.6 39.3 -56.5 -38.9 1.6 29.7 39.0 187 187 A L T 3 S+ 0 0 15 -3,-0.5 -1,-0.3 -23,-0.2 -2,-0.1 0.462 90.5 118.9 -89.9 -2.3 1.2 28.3 35.5 188 188 A A < - 0 0 2 -3,-1.1 2,-0.3 -101,-0.1 -24,-0.2 -0.316 38.4-179.0 -70.8 148.2 4.4 26.2 35.5 189 189 A K E -H 163 0C 44 -26,-1.7 -26,-1.7 2,-0.1 2,-0.6 -0.990 29.4-131.5-149.2 131.8 4.2 22.4 35.1 190 190 A R E +H 162 0C 51 -2,-0.3 2,-0.3 -28,-0.2 -28,-0.2 -0.837 46.9 160.7 -83.8 122.5 6.7 19.6 35.0 191 191 A V - 0 0 26 -30,-3.0 2,-0.5 -2,-0.6 26,-0.1 -0.965 38.5-161.6-155.1 125.6 5.8 17.5 31.9 192 192 A K S S- 0 0 157 -2,-0.3 2,-0.1 2,-0.1 -2,-0.0 -0.921 79.7 -7.5 -99.5 129.6 7.2 14.9 29.5 193 193 A G S S- 0 0 57 -2,-0.5 2,-0.1 2,-0.0 22,-0.1 -0.463 112.0 -3.3 76.6-151.2 5.0 14.9 26.4 194 194 A R - 0 0 160 -2,-0.1 2,-0.3 22,-0.1 22,-0.2 -0.409 47.8-175.5 -94.3 150.7 1.8 16.7 25.9 195 195 A T B -I 215 0D 4 20,-2.0 20,-2.8 -2,-0.1 -4,-0.0 -0.906 7.0-165.7-133.7 165.6 -0.4 18.9 28.1 196 196 A W + 0 0 156 -2,-0.3 18,-0.2 18,-0.2 16,-0.1 0.564 35.1 129.3-130.0 -17.7 -3.8 20.5 27.5 197 197 A X - 0 0 57 1,-0.1 2,-1.1 18,-0.1 174,-0.1 -0.196 53.8-132.9 -57.0 131.2 -4.8 23.2 29.9 198 198 A L + 0 0 29 172,-0.1 2,-0.3 12,-0.0 173,-0.2 -0.699 56.8 128.9 -79.9 100.5 -6.0 26.4 28.3 199 199 A C + 0 0 2 -2,-1.1 2,-0.2 171,-0.2 171,-0.2 -0.972 16.1 79.2-149.3 164.7 -4.1 29.0 30.3 200 200 A G B S-J 369 0E 2 169,-1.1 169,-2.1 -2,-0.3 171,-0.1 -0.690 81.7 -50.4 127.7 179.0 -1.8 32.1 30.0 201 201 A T >> - 0 0 2 167,-0.3 3,-1.0 -2,-0.2 4,-0.8 -0.759 52.3-124.6 -85.5 132.2 -2.2 35.7 29.2 202 202 A P G >4 S+ 0 0 1 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.871 107.9 52.2 -41.3 -53.3 -4.3 36.3 26.0 203 203 A E G 34 S+ 0 0 0 1,-0.3 35,-0.2 -3,-0.0 -35,-0.0 0.786 115.4 41.6 -55.5 -36.0 -1.6 38.4 24.2 204 204 A Y G <4 S+ 0 0 10 -3,-1.0 -1,-0.3 -37,-0.1 2,-0.2 0.367 84.1 124.5 -96.4 -3.7 1.1 35.7 24.8 205 205 A L << - 0 0 7 -3,-1.2 -5,-0.1 -4,-0.8 15,-0.0 -0.444 58.1-130.0 -66.7 133.7 -1.0 32.6 24.0 206 206 A A >> - 0 0 0 -2,-0.2 4,-1.6 1,-0.1 3,-1.3 -0.443 22.1-114.0 -77.6 153.0 0.4 30.3 21.3 207 207 A P H 3> S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 6,-0.1 0.872 113.9 57.5 -59.6 -39.8 -2.0 29.2 18.6 208 208 A E H 34>S+ 0 0 3 1,-0.2 5,-2.2 2,-0.2 6,-0.6 0.678 106.0 51.8 -69.9 -17.2 -2.0 25.5 19.6 209 209 A I H X45S+ 0 0 12 -3,-1.3 3,-1.3 3,-0.2 -1,-0.2 0.861 109.6 48.1 -77.1 -45.4 -3.2 26.5 23.1 210 210 A I H 3<5S+ 0 0 40 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.1 0.889 112.1 51.4 -60.8 -36.4 -6.1 28.6 21.6 211 211 A L T 3<5S- 0 0 88 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.1 0.293 107.9-122.2 -90.0 11.2 -7.0 25.7 19.4 212 212 A S T < 5 + 0 0 98 -3,-1.3 -3,-0.2 -5,-0.1 -2,-0.1 0.831 65.0 142.4 53.9 40.7 -7.2 23.0 22.2 213 213 A K < - 0 0 122 -5,-2.2 -4,-0.1 -6,-0.1 -1,-0.1 0.746 63.9-109.7 -85.3 -23.6 -4.6 21.0 20.3 214 214 A G - 0 0 11 -6,-0.6 -18,-0.2 -18,-0.2 2,-0.2 0.417 47.9-168.0 82.4 126.7 -2.5 19.7 23.1 215 215 A Y B -I 195 0D 6 -20,-2.8 -20,-2.0 -22,-0.1 2,-0.2 -0.667 16.9-158.8-144.3-179.0 0.9 21.4 23.3 216 216 A N > - 0 0 56 -2,-0.2 3,-2.1 -22,-0.2 4,-0.3 -0.704 57.0 -37.7-148.8-165.2 4.5 21.4 24.8 217 217 A K T >> S+ 0 0 63 1,-0.3 3,-2.3 -2,-0.2 4,-0.5 0.727 114.4 78.4 -28.4 -41.5 7.6 23.5 25.5 218 218 A A H >> S+ 0 0 0 1,-0.3 4,-1.8 2,-0.2 3,-0.7 0.705 75.4 70.7 -63.4 -20.8 7.2 25.3 22.2 219 219 A V H <> S+ 0 0 6 -3,-2.1 4,-1.8 1,-0.3 -1,-0.3 0.773 94.4 58.4 -64.5 -25.4 4.5 27.6 23.5 220 220 A D H <> S+ 0 0 2 -3,-2.3 4,-2.4 -4,-0.3 -1,-0.3 0.802 103.7 50.7 -70.2 -32.1 7.2 29.3 25.6 221 221 A W H > S- 0 0 120 1,-0.1 3,-1.4 -3,-0.0 4,-1.2 -0.915 80.3-131.8-113.0 136.6 -11.8 41.8 23.8 243 243 A P H 3> S+ 0 0 39 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.761 104.5 62.9 -54.6 -32.2 -9.7 38.5 24.1 244 244 A I H 3> S+ 0 0 97 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.841 102.7 50.1 -69.5 -26.4 -11.7 36.7 21.4 245 245 A Q H <> S+ 0 0 94 -3,-1.4 4,-1.5 2,-0.2 -1,-0.2 0.870 109.2 51.8 -74.6 -37.1 -10.4 39.3 18.9 246 246 A I H X S+ 0 0 0 -4,-1.2 4,-2.1 2,-0.2 3,-0.3 0.948 107.3 53.4 -59.0 -46.5 -6.8 38.7 20.2 247 247 A Y H X S+ 0 0 46 -4,-2.6 4,-1.8 1,-0.2 5,-0.2 0.907 107.8 48.8 -61.2 -42.9 -7.1 35.0 19.7 248 248 A E H X S+ 0 0 125 -4,-1.5 4,-1.3 1,-0.2 -1,-0.2 0.824 109.3 52.8 -68.4 -31.5 -8.2 35.2 16.1 249 249 A K H X>S+ 0 0 108 -4,-1.5 5,-0.7 -3,-0.3 4,-0.5 0.902 109.4 51.1 -63.2 -42.3 -5.4 37.6 15.3 250 250 A I H <5S+ 0 0 0 -4,-2.1 3,-0.4 1,-0.2 -2,-0.2 0.848 114.9 40.2 -64.5 -39.2 -3.0 35.0 16.8 251 251 A V H <5S+ 0 0 47 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.676 93.4 83.3 -88.3 -15.7 -4.3 32.1 14.7 252 252 A S H <5S- 0 0 70 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.806 100.1-125.5 -54.8 -29.6 -4.7 34.1 11.4 253 253 A G T <5 + 0 0 44 -4,-0.5 2,-0.4 -3,-0.4 -1,-0.1 0.509 67.9 121.4 95.9 13.9 -1.0 33.4 10.9 254 254 A K < + 0 0 159 -5,-0.7 2,-0.3 2,-0.0 -1,-0.2 -0.911 32.8 168.7-135.9 137.8 -0.2 37.2 10.5 255 255 A V - 0 0 40 -2,-0.4 2,-0.4 -3,-0.1 -17,-0.1 -0.995 16.5-151.4-143.4 142.6 2.0 39.9 12.0 256 256 A R - 0 0 184 -2,-0.3 -2,-0.0 -19,-0.3 0, 0.0 -0.931 14.7-148.4-121.3 138.5 3.0 43.5 11.2 257 257 A F - 0 0 40 -2,-0.4 -28,-0.0 1,-0.1 9,-0.0 -0.840 22.0-107.0-108.6 141.4 6.2 45.1 12.3 258 258 A P > - 0 0 12 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 -0.270 31.4-118.8 -52.1 148.5 7.0 48.7 13.1 259 259 A S T 3 S+ 0 0 130 1,-0.2 -2,-0.0 0, 0.0 0, 0.0 0.713 112.4 62.8 -66.2 -19.1 9.1 50.5 10.4 260 260 A H T 3 S+ 0 0 78 2,-0.1 -1,-0.2 -27,-0.0 2,-0.1 0.736 77.7 105.3 -80.5 -19.7 11.8 51.0 13.0 261 261 A F S < S- 0 0 7 -3,-0.9 -4,-0.1 1,-0.1 -28,-0.0 -0.372 75.3-119.3 -59.0 131.2 12.4 47.3 13.6 262 262 A S > - 0 0 42 1,-0.1 4,-2.5 -2,-0.1 3,-0.2 -0.285 21.8-114.1 -62.6 155.7 15.7 46.0 12.1 263 263 A S H > S+ 0 0 83 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.875 118.4 56.3 -62.4 -38.3 15.4 43.2 9.4 264 264 A D H > S+ 0 0 71 2,-0.2 4,-2.4 1,-0.2 32,-0.4 0.875 108.0 47.8 -59.5 -38.6 17.2 40.9 11.8 265 265 A L H > S+ 0 0 0 -3,-0.2 4,-3.2 2,-0.2 -2,-0.2 0.943 110.8 50.5 -67.9 -47.9 14.5 41.5 14.5 266 266 A K H X S+ 0 0 59 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.843 113.6 46.5 -57.3 -33.5 11.7 41.0 12.0 267 267 A D H X S+ 0 0 49 -4,-1.9 4,-1.2 2,-0.2 -1,-0.2 0.882 111.1 48.7 -83.7 -40.2 13.3 37.7 10.9 268 268 A L H >X S+ 0 0 0 -4,-2.4 4,-1.5 2,-0.2 3,-0.6 0.955 115.1 48.5 -54.0 -49.9 14.0 36.4 14.4 269 269 A L H 3X S+ 0 0 0 -4,-3.2 4,-2.4 1,-0.2 -2,-0.2 0.867 104.6 57.0 -65.2 -38.2 10.4 37.3 15.1 270 270 A R H 3< S+ 0 0 113 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.803 111.3 45.8 -59.9 -31.0 8.9 35.6 11.9 271 271 A N H << S+ 0 0 37 -4,-1.2 10,-2.4 -3,-0.6 3,-0.4 0.732 115.0 44.1 -86.8 -24.3 10.6 32.4 13.1 272 272 A L H < S+ 0 0 0 -4,-1.5 2,-1.1 8,-0.2 -2,-0.2 0.897 111.5 53.3 -80.6 -42.0 9.4 32.5 16.8 273 273 A L S < S+ 0 0 11 -4,-2.4 2,-0.6 -5,-0.2 -1,-0.2 -0.262 81.4 139.6 -88.3 49.8 5.8 33.6 16.0 274 274 A Q - 0 0 57 -2,-1.1 6,-0.2 -3,-0.4 5,-0.1 -0.850 42.7-162.1-104.8 116.0 5.4 30.7 13.6 275 275 A V S S+ 0 0 43 -2,-0.6 2,-0.6 -22,-0.1 -1,-0.1 0.866 76.6 81.8 -60.3 -39.0 2.0 28.8 13.7 276 276 A D S >> S- 0 0 69 1,-0.2 3,-1.6 -23,-0.1 4,-0.6 -0.606 71.0-156.6 -72.5 112.8 3.5 25.8 11.9 277 277 A L T 34 S+ 0 0 59 -2,-0.6 3,-0.3 1,-0.3 -1,-0.2 0.744 90.2 63.2 -64.3 -26.8 5.2 23.8 14.8 278 278 A T T 34 S+ 0 0 109 1,-0.2 -1,-0.3 6,-0.0 -2,-0.1 0.581 112.2 37.5 -70.1 -9.1 7.6 22.1 12.3 279 279 A K T <4 S+ 0 0 123 -3,-1.6 2,-0.4 -5,-0.1 -2,-0.2 0.450 87.1 111.3-122.7 -6.1 9.1 25.6 11.5 280 280 A R >< - 0 0 0 -4,-0.6 3,-1.6 -3,-0.3 -8,-0.2 -0.594 69.4-115.5 -84.4 129.6 9.1 27.5 14.8 281 281 A F T 3 S+ 0 0 29 -10,-2.4 -7,-0.1 -2,-0.4 7,-0.1 -0.316 102.6 38.3 -60.5 144.4 12.5 28.3 16.4 282 282 A G T 3 S+ 0 0 11 5,-0.8 -1,-0.2 -61,-0.0 6,-0.2 0.034 112.9 64.9 100.0 -18.3 13.0 26.6 19.7 283 283 A N S < S+ 0 0 53 -3,-1.6 -2,-0.2 4,-0.2 2,-0.1 0.246 78.5 94.6-124.5 5.6 11.3 23.6 18.3 284 284 A L S > S- 0 0 54 3,-0.3 3,-1.8 -5,-0.1 6,-0.1 -0.399 93.7 -81.7 -98.7 176.6 13.6 22.3 15.5 285 285 A K T 3 S+ 0 0 110 1,-0.3 -1,-0.0 -2,-0.1 0, 0.0 0.814 131.0 44.8 -44.4 -42.2 16.3 19.7 15.4 286 286 A N T > S- 0 0 106 1,-0.2 3,-1.3 2,-0.1 -1,-0.3 0.540 92.1-169.1 -86.9 -9.2 18.9 22.2 16.8 287 287 A G T X + 0 0 19 -3,-1.8 3,-1.1 1,-0.3 -5,-0.8 -0.301 63.3 0.7 68.6-132.7 16.6 23.6 19.5 288 288 A V T >> S+ 0 0 15 1,-0.2 4,-2.3 -6,-0.2 3,-1.5 0.784 120.1 74.5 -61.2 -30.6 17.6 26.7 21.4 289 289 A N H <> S+ 0 0 68 -3,-1.3 4,-2.7 1,-0.3 -1,-0.2 0.798 85.9 62.9 -61.6 -27.0 20.8 27.0 19.3 290 290 A D H <4 S+ 0 0 39 -3,-1.1 -1,-0.3 2,-0.2 -2,-0.2 0.820 110.0 41.1 -61.7 -33.3 18.8 28.3 16.3 291 291 A I H X4 S+ 0 0 0 -3,-1.5 3,-1.0 -4,-0.4 6,-0.3 0.901 114.3 50.6 -77.2 -49.4 17.8 31.3 18.4 292 292 A K H 3< S+ 0 0 23 -4,-2.3 -2,-0.2 1,-0.3 8,-0.2 0.921 115.1 43.4 -56.2 -46.7 21.3 31.8 20.0 293 293 A N T 3< S+ 0 0 127 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.476 87.1 121.4 -77.8 -8.6 23.0 31.7 16.6 294 294 A H S X S- 0 0 11 -3,-1.0 3,-1.4 -5,-0.2 -3,-0.1 -0.291 75.7-115.4 -58.0 145.5 20.4 33.9 14.9 295 295 A K G > S+ 0 0 123 1,-0.3 3,-1.8 2,-0.2 4,-0.2 0.775 112.5 63.8 -53.3 -36.5 21.8 37.2 13.4 296 296 A W G 3 S+ 0 0 1 -32,-0.4 3,-0.4 1,-0.3 -1,-0.3 0.855 105.2 48.3 -60.9 -32.1 19.8 39.5 15.9 297 297 A F G X S+ 0 0 4 -3,-1.4 3,-1.9 -6,-0.3 -1,-0.3 0.148 75.6 114.4 -91.0 17.4 21.9 37.9 18.7 298 298 A A T < S+ 0 0 87 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.875 77.8 49.2 -59.4 -37.9 25.2 38.3 16.9 299 299 A T T 3 S+ 0 0 110 -3,-0.4 2,-0.6 -4,-0.2 -1,-0.3 0.348 88.0 112.1 -78.5 3.5 26.4 40.8 19.6 300 300 A T < - 0 0 20 -3,-1.9 2,-1.5 -8,-0.2 3,-0.1 -0.699 53.6-158.7 -94.0 116.9 25.4 38.5 22.5 301 301 A D > - 0 0 74 -2,-0.6 4,-1.8 1,-0.2 5,-0.2 -0.718 14.5-169.0 -86.3 89.5 28.2 37.0 24.7 302 302 A W H > S+ 0 0 26 -2,-1.5 4,-2.2 1,-0.3 -1,-0.2 0.861 83.5 48.6 -52.6 -42.8 25.9 34.2 26.0 303 303 A I H > S+ 0 0 55 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.918 109.6 52.1 -63.6 -44.5 28.4 33.1 28.6 304 304 A A H 4>S+ 0 0 16 2,-0.2 5,-2.7 1,-0.2 6,-0.8 0.777 108.6 51.6 -64.3 -26.6 28.8 36.7 29.8 305 305 A I H ><5S+ 0 0 6 -4,-1.8 3,-1.0 3,-0.2 -2,-0.2 0.934 109.4 49.6 -73.8 -46.0 25.0 37.1 30.2 306 306 A Y H 3<5S+ 0 0 84 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.914 115.7 43.7 -54.1 -43.2 24.9 33.9 32.3 307 307 A Q T 3<5S- 0 0 129 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.483 109.0-125.9 -87.1 -2.4 27.7 35.2 34.5 308 308 A R T < 5 + 0 0 70 -3,-1.0 -3,-0.2 -4,-0.3 4,-0.1 0.875 69.0 132.4 61.7 40.5 26.1 38.7 34.6 309 309 A K < + 0 0 71 -5,-2.7 2,-0.3 -6,-0.1 -4,-0.2 0.394 44.6 93.1 -99.5 -3.9 29.3 40.4 33.4 310 310 A V S S- 0 0 54 -6,-0.8 2,-0.4 -5,-0.1 0, 0.0 -0.730 84.9-108.8 -89.7 143.7 27.4 42.5 30.8 311 311 A E - 0 0 169 -2,-0.3 -2,-0.1 1,-0.1 -133,-0.1 -0.561 27.0-125.0 -72.9 124.8 26.2 46.1 31.8 312 312 A A - 0 0 11 -135,-0.4 3,-0.1 -2,-0.4 -133,-0.1 -0.539 13.8-139.7 -63.0 124.3 22.5 46.4 32.3 313 313 A P S S+ 0 0 71 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.388 92.2 35.9 -65.7 9.5 21.5 49.2 29.9 314 314 A F - 0 0 44 -137,-0.1 -2,-0.0 -136,-0.1 -137,-0.0 -0.770 63.0-179.4-168.6 101.1 19.1 50.4 32.7 315 315 A I - 0 0 114 -2,-0.2 3,-0.1 -3,-0.1 -139,-0.1 -0.969 33.1-127.0-108.6 125.7 19.8 50.2 36.4 316 316 A P - 0 0 19 0, 0.0 2,-0.4 0, 0.0 -191,-0.1 -0.196 31.5 -81.1 -75.8 162.4 16.9 51.5 38.4 317 317 A K - 0 0 58 -192,-0.1 2,-0.7 1,-0.1 9,-0.1 -0.499 46.0-164.3 -58.5 116.5 16.8 54.2 41.1 318 318 A F + 0 0 67 -2,-0.4 2,-0.9 -3,-0.1 -1,-0.1 -0.808 13.1 177.9-109.8 85.7 17.9 52.3 44.2 319 319 A K - 0 0 63 -2,-0.7 5,-0.1 1,-0.2 -1,-0.1 -0.191 57.4 -81.7 -79.4 42.2 17.0 54.5 47.2 320 320 A G S > S- 0 0 42 -2,-0.9 3,-1.2 3,-0.1 -1,-0.2 0.089 72.9 -30.5 80.8 169.7 18.2 51.9 49.8 321 321 A P T 3 S+ 0 0 119 0, 0.0 3,-0.1 0, 0.0 -254,-0.0 -0.144 122.7 18.9 -62.9 149.1 16.6 48.8 51.3 322 322 A G T 3 S+ 0 0 23 1,-0.2 2,-0.3 -262,-0.1 -2,-0.1 0.577 87.4 136.5 68.4 13.4 12.9 48.5 51.8 323 323 A D < - 0 0 51 -3,-1.2 -1,-0.2 1,-0.1 3,-0.1 -0.728 33.7-171.7 -92.3 141.7 12.1 51.3 49.3 324 324 A T > + 0 0 27 -2,-0.3 3,-0.9 1,-0.1 -1,-0.1 -0.249 41.7 123.9-129.8 44.6 9.2 50.7 46.8 325 325 A S T 3 S+ 0 0 91 1,-0.2 -1,-0.1 -8,-0.1 -200,-0.1 0.774 75.5 57.7 -73.0 -29.5 9.4 53.6 44.3 326 326 A N T 3 S+ 0 0 28 -202,-0.5 -199,-0.4 -9,-0.1 2,-0.3 0.307 100.6 74.5 -84.9 8.5 9.6 51.3 41.4 327 327 A F S < S- 0 0 20 -3,-0.9 -277,-0.1 -201,-0.2 -3,-0.1 -0.884 79.5-117.6-121.5 151.8 6.3 49.6 42.4 328 328 A D - 0 0 81 -279,-0.3 2,-0.4 -2,-0.3 -2,-0.1 -0.262 33.4-102.6 -77.7 170.3 2.7 50.7 42.2 329 329 A D - 0 0 128 -2,-0.0 2,-0.3 -282,-0.0 -280,-0.1 -0.835 36.7-175.1-100.5 135.6 0.3 51.2 45.1 330 330 A Y - 0 0 54 -2,-0.4 -282,-0.3 -282,-0.4 2,-0.2 -0.906 34.8 -94.2-126.1 151.4 -2.3 48.7 46.1 331 331 A E - 0 0 170 -2,-0.3 2,-0.3 1,-0.1 0, 0.0 -0.457 45.5-129.7 -55.2 130.5 -5.2 48.6 48.7 332 332 A E - 0 0 88 -2,-0.2 2,-0.4 -284,-0.0 -1,-0.1 -0.652 21.3-167.4 -90.9 143.5 -4.0 46.9 51.9 333 333 A E - 0 0 127 -2,-0.3 2,-0.1 0, 0.0 0, 0.0 -0.991 25.8-114.5-127.4 136.5 -5.9 44.1 53.6 334 334 A E - 0 0 168 -2,-0.4 2,-0.6 1,-0.1 0, 0.0 -0.456 29.5-119.4 -69.4 143.6 -5.2 42.8 57.1 335 335 A I - 0 0 32 -2,-0.1 2,-0.6 2,-0.0 -1,-0.1 -0.775 30.6-166.3 -87.3 118.2 -3.9 39.2 57.3 336 336 A R - 0 0 169 -2,-0.6 2,-0.5 -222,-0.0 -2,-0.0 -0.924 4.8-166.0-112.8 116.3 -6.3 37.1 59.4 337 337 A V - 0 0 59 -2,-0.6 2,-0.1 -223,-0.1 -224,-0.0 -0.863 16.9-136.9 -98.0 132.2 -5.2 33.6 60.6 338 338 A X - 0 0 45 -2,-0.5 -225,-0.2 2,-0.2 -224,-0.1 -0.432 14.1-133.3 -83.4 159.0 -8.0 31.3 61.9 339 339 A I S S+ 0 0 138 -2,-0.1 2,-0.5 -226,-0.1 -1,-0.1 0.579 93.1 73.6 -80.3 -14.7 -8.0 29.0 65.0 340 340 A N S S- 0 0 94 -227,-0.0 2,-0.3 0, 0.0 -2,-0.2 -0.903 87.7-123.2-103.3 126.1 -9.3 26.2 62.7 341 341 A E - 0 0 133 -2,-0.5 2,-0.4 1,-0.0 3,-0.3 -0.486 29.1-156.3 -63.1 121.2 -7.0 24.5 60.2 342 342 A K - 0 0 33 -229,-2.1 -266,-0.1 -2,-0.3 -230,-0.0 -0.831 64.5 -7.6 -99.3 138.8 -8.5 24.8 56.7 343 343 A C S > S+ 0 0 23 -2,-0.4 4,-1.3 1,-0.1 -1,-0.2 0.824 73.7 159.0 54.6 43.8 -7.8 22.4 53.8 344 344 A G T 4 S+ 0 0 20 -3,-0.3 3,-0.3 2,-0.2 4,-0.1 0.923 71.8 44.9 -63.5 -47.7 -5.0 20.5 55.7 345 345 A K T >4 S+ 0 0 84 1,-0.2 3,-1.1 2,-0.2 4,-0.2 0.878 110.2 55.4 -65.2 -40.5 -5.2 17.3 53.5 346 346 A E T 34 S+ 0 0 83 1,-0.2 -1,-0.2 2,-0.1 3,-0.2 0.820 118.4 33.7 -62.3 -32.2 -5.3 19.3 50.3 347 347 A F T >< S+ 0 0 0 -4,-1.3 3,-1.4 -3,-0.3 -1,-0.2 0.161 77.9 120.9-116.0 22.0 -2.1 21.1 51.2 348 348 A S T < S+ 0 0 79 -3,-1.1 -1,-0.1 1,-0.3 -2,-0.1 0.781 76.3 50.5 -55.0 -36.6 -0.1 18.5 53.1 349 349 A E T 3 0 0 88 -4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.628 360.0 360.0 -84.7 -14.4 2.9 18.5 50.8 350 350 A F < 0 0 2 -3,-1.4 -239,-0.1 -315,-0.1 -315,-0.1 -0.438 360.0 360.0 -64.4 360.0 3.3 22.3 50.9 351 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 352 5 B T > 0 0 127 0, 0.0 4,-2.2 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 162.1 -1.0 54.7 14.2 353 6 B T H > + 0 0 55 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.825 360.0 54.8 -66.8 -31.0 -0.7 51.3 15.9 354 7 B Y H > S+ 0 0 124 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.783 108.4 48.2 -72.3 -32.8 0.8 52.8 19.1 355 8 B A H > S+ 0 0 47 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.885 109.2 53.1 -74.7 -41.9 -2.2 55.2 19.5 356 9 B D H < S+ 0 0 105 -4,-2.2 -2,-0.2 2,-0.2 4,-0.2 0.903 112.0 47.1 -55.2 -41.0 -4.7 52.3 18.9 357 10 B F H >< S+ 0 0 1 -4,-1.6 3,-1.5 2,-0.2 5,-0.4 0.947 111.9 48.1 -67.2 -45.1 -2.8 50.5 21.7 358 11 B I H 3< S+ 0 0 87 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.806 112.2 49.9 -68.3 -34.8 -2.8 53.5 24.1 359 12 B A T 3< S+ 0 0 88 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.381 99.1 88.7 -79.7 -3.4 -6.4 54.1 23.6 360 13 B S S < S- 0 0 16 -3,-1.5 3,-0.3 -4,-0.2 -3,-0.1 -0.287 83.9-119.2 -86.2 179.8 -7.2 50.4 24.2 361 14 B G S S+ 0 0 62 1,-0.2 3,-0.2 2,-0.1 -3,-0.1 0.146 98.3 78.3-107.1 19.7 -8.0 48.7 27.6 362 15 B R + 0 0 51 -5,-0.4 -1,-0.2 1,-0.1 4,-0.1 0.068 63.7 90.6-114.0 24.7 -5.1 46.4 27.5 363 16 B T S S+ 0 0 43 -3,-0.3 -1,-0.1 -5,-0.1 3,-0.1 0.635 74.6 80.6 -92.7 -15.0 -2.3 48.8 28.5 364 17 B G S S- 0 0 40 1,-0.2 2,-0.1 -3,-0.2 -3,-0.0 -0.186 104.9 -57.0 -77.9 176.9 -2.7 48.0 32.2 365 18 B R - 0 0 77 1,-0.1 2,-0.4 -195,-0.0 -1,-0.2 -0.374 65.0-135.3 -51.1 127.2 -1.3 45.2 34.2 366 19 B R - 0 0 9 -3,-0.1 2,-0.4 -4,-0.1 -1,-0.1 -0.798 9.5-144.5-104.4 136.7 -2.7 42.0 32.5 367 20 B N - 0 0 124 -2,-0.4 2,-0.1 1,-0.1 -315,-0.0 -0.740 15.0-127.9 -94.3 138.8 -4.2 38.9 34.2 368 21 B A - 0 0 38 -2,-0.4 -167,-0.3 -167,-0.2 2,-0.2 -0.323 25.6-133.8 -66.4 162.5 -3.8 35.4 33.0 369 22 B I B -J 200 0E 61 -169,-2.1 -169,-1.1 -2,-0.1 -1,-0.1 -0.694 13.3-153.5-110.4 170.5 -6.9 33.2 32.5 370 23 B H 0 0 58 -2,-0.2 -171,-0.2 -171,-0.2 -172,-0.1 -0.350 360.0 360.0-134.9 52.6 -7.8 29.7 33.5 371 24 B D 0 0 158 -173,-0.2 -172,-0.1 -171,-0.1 -174,-0.0 0.052 360.0 360.0 45.0 360.0 -10.2 29.0 30.6