==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 27-OCT-09 3KF7 . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.-S.SHIEH,J.M.WILLIAMS,R.A.STEGEMAN,L.XING,K.D.JEROME . 337 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16719.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 212 62.9 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 . 43 12.8 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 . 3 0.9 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 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 28.5 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 4 1 0 0 0 1 1 0 1 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 0 2 0 1 2 0 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 0 0 2 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 5 A R 0 0 164 0, 0.0 3,-0.0 0, 0.0 89,-0.0 0.000 360.0 360.0 360.0 128.0 57.3 40.2 8.6 2 6 A P - 0 0 69 0, 0.0 2,-0.4 0, 0.0 0, 0.0 -0.221 360.0 -89.1 -72.2 173.2 56.9 41.7 12.1 3 7 A T - 0 0 103 -2,-0.0 15,-2.5 1,-0.0 2,-0.3 -0.731 41.3-150.5 -89.5 130.0 58.7 40.3 15.2 4 8 A F E -A 17 0A 44 -2,-0.4 2,-0.3 13,-0.2 11,-0.0 -0.734 9.6-167.1 -99.0 146.8 57.0 37.6 17.2 5 9 A Y E -A 16 0A 65 11,-2.4 11,-1.7 -2,-0.3 2,-0.3 -0.920 12.5-136.4-128.1 162.7 57.3 36.8 20.9 6 10 A R E +A 15 0A 153 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.890 24.7 157.2-125.7 143.9 56.2 33.7 22.8 7 11 A Q E -A 14 0A 60 7,-1.9 7,-2.9 -2,-0.3 2,-0.4 -0.989 34.8-119.3-156.9 158.8 54.4 32.9 26.1 8 12 A E E +A 13 0A 113 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.849 28.8 178.9 -96.9 137.8 52.4 30.2 27.9 9 13 A L E > -A 12 0A 27 3,-3.7 3,-1.4 -2,-0.4 -2,-0.0 -0.874 68.0 -24.5-143.6 108.2 48.9 31.1 29.1 10 14 A N T 3 S- 0 0 128 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.940 126.0 -47.9 56.2 53.7 46.6 28.6 30.9 11 15 A K T 3 S+ 0 0 188 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.297 122.6 108.5 71.8 -6.5 48.3 25.5 29.4 12 16 A T E < -A 9 0A 40 -3,-1.4 -3,-3.7 2,-0.0 2,-0.3 -0.836 64.2-137.0-109.6 135.5 48.1 27.2 26.0 13 17 A I E -A 8 0A 68 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.694 16.3-162.3 -89.6 140.8 51.1 28.6 24.0 14 18 A W E -A 7 0A 5 -7,-2.9 -7,-1.9 -2,-0.3 2,-0.5 -0.994 11.0-177.2-129.5 126.1 50.7 32.0 22.2 15 19 A E E +A 6 0A 66 -2,-0.4 -9,-0.2 -9,-0.2 -11,-0.0 -0.919 26.5 154.1-123.2 99.1 53.1 33.2 19.5 16 20 A V E -A 5 0A 1 -11,-1.7 -11,-2.4 -2,-0.5 -2,-0.0 -0.865 47.4 -87.6-129.2 160.0 52.1 36.8 18.4 17 21 A P E > -A 4 0A 4 0, 0.0 3,-1.9 0, 0.0 -13,-0.2 -0.346 41.9-115.8 -62.4 146.1 53.5 39.9 16.8 18 22 A E T 3 S+ 0 0 83 -15,-2.5 22,-0.1 1,-0.3 -14,-0.1 0.729 108.0 74.9 -58.2 -26.5 54.9 42.4 19.3 19 23 A R T 3 S+ 0 0 44 -16,-0.2 21,-3.0 20,-0.1 2,-0.7 0.766 85.1 73.4 -60.1 -24.1 52.3 45.1 18.4 20 24 A Y E < S+B 39 0B 0 -3,-1.9 2,-0.3 19,-0.2 19,-0.2 -0.854 72.8 172.0 -92.7 116.4 49.8 43.0 20.5 21 25 A Q E +B 38 0B 71 17,-2.6 17,-2.8 -2,-0.7 -2,-0.0 -0.762 43.6 30.8-121.9 165.3 50.7 43.5 24.1 22 26 A N E - 0 0 126 -2,-0.3 2,-0.2 15,-0.2 -1,-0.2 0.890 69.3-165.9 57.0 48.7 49.2 42.6 27.6 23 27 A L E - 0 0 16 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.473 8.7-178.8 -68.1 129.4 47.5 39.4 26.5 24 28 A S E -B 36 0B 63 12,-2.0 12,-2.4 -2,-0.2 -15,-0.0 -0.988 30.2-114.9-132.2 125.6 45.1 38.2 29.2 25 29 A P E +B 35 0B 46 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.326 34.0 172.1 -61.3 134.0 43.0 35.0 28.9 26 30 A V E - 0 0 87 8,-2.7 2,-0.3 1,-0.4 9,-0.2 0.550 55.9 -44.7-115.4 -16.2 39.3 35.6 28.6 27 31 A G E -B 34 0B 36 7,-1.3 7,-2.1 2,-0.0 2,-0.8 -0.961 47.8 -88.6 173.5 169.7 38.0 32.1 27.8 28 32 A S E -B 33 0B 115 -2,-0.3 2,-0.8 5,-0.2 5,-0.2 -0.927 56.2-176.0 -94.1 94.4 38.0 28.8 26.1 29 33 A G - 0 0 33 -2,-0.8 4,-0.1 3,-0.6 -2,-0.0 -0.564 43.9 -63.0-110.2 65.1 35.8 30.3 23.4 30 34 A A S S- 0 0 47 -2,-0.8 -1,-0.2 1,-0.1 22,-0.1 0.806 114.7 -2.3 67.9 122.3 34.8 27.6 21.0 31 35 A Y S S+ 0 0 140 -3,-0.1 21,-2.1 20,-0.1 2,-0.3 0.795 134.9 22.9 34.5 43.3 37.3 25.6 18.8 32 36 A G E S- C 0 51B 8 19,-0.3 -3,-0.6 21,-0.0 2,-0.3 -0.908 83.7 -90.7 158.2 172.7 40.0 27.8 20.3 33 37 A S E -BC 28 50B 20 17,-1.7 17,-2.7 -2,-0.3 2,-0.4 -0.856 32.7-146.1-116.8 155.3 41.2 30.0 23.1 34 38 A V E -BC 27 49B 28 -7,-2.1 -8,-2.7 -2,-0.3 -7,-1.3 -0.967 11.9-173.7-133.1 132.6 40.9 33.8 23.4 35 39 A C E -BC 25 48B 1 13,-2.7 13,-3.1 -2,-0.4 2,-0.4 -0.921 22.7-133.1-119.6 147.4 42.9 36.6 24.8 36 40 A A E +BC 24 47B 19 -12,-2.4 -12,-2.0 -2,-0.3 2,-0.3 -0.839 39.0 174.3 -86.1 137.6 42.2 40.3 25.2 37 41 A A E - C 0 46B 6 9,-3.0 9,-2.5 -2,-0.4 2,-0.5 -0.883 33.4-115.3-139.4 171.6 45.2 42.3 24.0 38 42 A F E -BC 21 45B 74 -17,-2.8 -17,-2.6 -2,-0.3 2,-0.9 -0.957 21.8-146.0-111.9 125.3 46.3 45.9 23.4 39 43 A D E >> -BC 20 44B 2 5,-2.5 4,-2.7 -2,-0.5 5,-0.7 -0.810 8.7-166.9 -93.9 103.0 47.0 46.8 19.8 40 44 A T T 45S+ 0 0 75 -21,-3.0 -1,-0.2 -2,-0.9 -20,-0.1 0.767 83.1 61.3 -61.7 -28.0 49.9 49.3 19.9 41 45 A K T 45S+ 0 0 135 -22,-0.2 -1,-0.2 1,-0.2 -21,-0.1 0.928 121.9 18.9 -63.7 -47.2 49.3 50.3 16.2 42 46 A T T 45S- 0 0 73 -3,-0.4 -2,-0.2 2,-0.2 -1,-0.2 0.643 96.0-126.9 -99.6 -19.9 45.7 51.6 16.7 43 47 A G T <5S+ 0 0 39 -4,-2.7 2,-0.3 1,-0.3 -3,-0.2 0.570 70.5 122.5 76.9 11.5 45.7 52.1 20.5 44 48 A L E < -C 39 0B 83 -5,-0.7 -5,-2.5 1,-0.0 -1,-0.3 -0.718 67.3-110.4-107.8 153.0 42.6 50.0 20.8 45 49 A R E -C 38 0B 184 -2,-0.3 59,-2.2 -7,-0.2 2,-0.3 -0.637 39.4-169.9 -78.3 138.5 41.8 46.8 22.7 46 50 A V E -CD 37 103B 0 -9,-2.5 -9,-3.0 -2,-0.3 2,-0.5 -0.885 23.1-130.0-128.1 158.7 41.4 43.6 20.6 47 51 A A E -CD 36 102B 19 55,-3.0 55,-2.0 -2,-0.3 2,-0.5 -0.957 23.3-164.1-107.2 128.4 40.3 40.1 21.0 48 52 A V E -CD 35 101B 0 -13,-3.1 -13,-2.7 -2,-0.5 2,-0.5 -0.972 1.4-165.6-115.9 121.4 42.7 37.4 19.7 49 53 A K E -CD 34 100B 25 51,-2.5 51,-2.4 -2,-0.5 2,-0.6 -0.943 6.6-157.3-108.5 125.8 41.5 33.9 19.1 50 54 A K E -CD 33 99B 31 -17,-2.7 -17,-1.7 -2,-0.5 49,-0.2 -0.903 27.6-124.0 -97.5 119.2 44.1 31.1 18.5 51 55 A L E -C 32 0B 4 47,-2.3 2,-0.6 -2,-0.6 -19,-0.3 -0.319 20.4-123.9 -66.6 143.9 42.3 28.3 16.7 52 56AA S S S- 0 0 55 -21,-2.1 4,-0.2 1,-0.2 -1,-0.1 -0.830 78.2 -27.7 -91.4 123.3 42.5 24.9 18.4 53 57 A R S > S- 0 0 187 -2,-0.6 3,-1.6 1,-0.1 4,-0.2 0.849 74.4-175.7 44.0 54.7 44.0 22.0 16.3 54 58 A P T 3 S+ 0 0 1 0, 0.0 10,-0.4 0, 0.0 3,-0.2 0.754 77.3 34.1 -57.5 -27.8 42.9 23.7 13.0 55 59 A F T 3 S+ 0 0 20 41,-0.3 -2,-0.1 1,-0.1 269,-0.1 -0.081 77.7 120.4-120.6 34.8 44.1 20.9 10.7 56 60 A Q S < S- 0 0 120 -3,-1.6 2,-0.3 -4,-0.2 -1,-0.1 0.763 86.9 -13.8 -66.6 -32.1 43.4 17.9 13.0 57 61 A S S > S- 0 0 34 -4,-0.2 4,-2.8 -3,-0.2 5,-0.2 -0.924 79.7 -87.0-160.6 174.8 41.0 16.3 10.4 58 62 A I H > S+ 0 0 83 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.899 127.5 53.4 -62.2 -39.1 39.1 17.2 7.3 59 63 A I H > S+ 0 0 131 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.907 112.0 42.3 -61.6 -48.0 36.3 18.4 9.5 60 64 A H H > S+ 0 0 35 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.898 114.6 52.2 -64.8 -41.2 38.6 20.8 11.4 61 65 A A H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.937 111.6 44.7 -66.4 -43.6 40.4 21.9 8.3 62 66 A K H X S+ 0 0 31 -4,-2.8 4,-3.0 1,-0.2 -1,-0.2 0.906 112.9 52.8 -65.2 -41.6 37.1 22.8 6.5 63 67 A R H X S+ 0 0 13 -4,-2.0 4,-2.9 -5,-0.3 -2,-0.2 0.915 108.1 50.3 -58.6 -45.3 35.9 24.5 9.6 64 68 A T H X S+ 0 0 1 -4,-2.6 4,-2.1 -10,-0.4 -2,-0.2 0.924 113.3 45.5 -60.3 -45.4 39.1 26.6 9.8 65 69 A Y H X S+ 0 0 14 -4,-2.1 4,-3.0 2,-0.2 5,-0.2 0.952 112.4 52.3 -61.4 -48.9 38.8 27.7 6.2 66 70 A R H X S+ 0 0 47 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.913 110.9 46.5 -54.5 -49.2 35.0 28.4 6.7 67 71 A E H X S+ 0 0 8 -4,-2.9 4,-3.2 2,-0.2 -1,-0.2 0.917 114.2 46.8 -60.4 -46.6 35.6 30.7 9.7 68 72 A L H X S+ 0 0 2 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.929 114.3 46.9 -64.6 -46.4 38.5 32.6 8.0 69 73 A R H X S+ 0 0 32 -4,-3.0 4,-1.1 2,-0.2 -2,-0.2 0.929 115.4 47.1 -56.7 -48.7 36.5 33.1 4.8 70 74 A L H >X S+ 0 0 3 -4,-2.6 4,-1.7 -5,-0.2 3,-0.7 0.942 113.8 46.2 -59.5 -51.9 33.4 34.2 6.8 71 75 A L H 3< S+ 0 0 9 -4,-3.2 11,-0.9 1,-0.2 -1,-0.2 0.846 109.1 55.2 -65.3 -33.7 35.3 36.6 9.0 72 76 A K H 3< S+ 0 0 40 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.789 112.2 45.2 -65.8 -27.0 37.2 38.1 6.1 73 77 A H H << S+ 0 0 44 -4,-1.1 2,-0.6 -3,-0.7 234,-0.2 0.786 86.2 96.4 -89.1 -30.5 33.8 38.9 4.4 74 78 A M < + 0 0 4 -4,-1.7 8,-0.3 6,-0.1 2,-0.3 -0.501 40.0 161.4 -71.6 112.4 31.8 40.3 7.3 75 79 A K + 0 0 157 -2,-0.6 2,-0.3 6,-0.1 -1,-0.1 -0.716 31.3 109.0-132.0 79.7 32.1 44.2 7.1 76 80 A H B > S-F 79 0C 16 3,-0.6 3,-1.7 -2,-0.3 57,-0.0 -0.989 71.0-121.7-155.6 142.2 29.3 45.5 9.1 77 81 A E T 3 S+ 0 0 101 -2,-0.3 56,-0.1 1,-0.3 4,-0.1 0.693 112.7 48.4 -66.7 -18.0 29.1 47.4 12.5 78 82 A N T 3 S+ 0 0 7 83,-0.1 84,-2.3 54,-0.1 2,-0.3 0.124 106.3 65.2-105.3 16.8 26.8 44.7 14.0 79 83 A V B < S-Fg 76 162C 3 -3,-1.7 -3,-0.6 82,-0.3 84,-0.2 -0.996 87.5-112.2-136.6 134.6 28.9 41.7 12.9 80 84 A I + 0 0 18 82,-2.1 2,-0.2 -2,-0.3 -6,-0.1 -0.402 42.5 170.4 -64.8 135.4 32.4 40.7 14.0 81 85 A G - 0 0 16 -2,-0.1 2,-0.5 -8,-0.1 22,-0.2 -0.760 34.9 -79.4-131.4-174.8 35.0 41.0 11.3 82 86 A L + 0 0 16 -11,-0.9 20,-0.2 -8,-0.3 3,-0.1 -0.785 28.1 173.6 -97.4 127.7 38.8 40.9 11.1 83 87 A L S S- 0 0 35 18,-2.9 2,-0.3 -2,-0.5 19,-0.2 0.683 83.0 -8.5 -81.9 -31.0 41.2 43.6 12.0 84 88 A D E -E 101 0B 24 17,-1.4 17,-2.7 252,-0.1 -1,-0.3 -0.985 52.5-164.6-161.8 154.2 44.1 41.1 11.5 85 89 A V E +E 100 0B 7 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.945 25.7 162.3-144.8 136.2 44.9 37.4 10.8 86 90 A F E -E 99 0B 14 13,-2.1 13,-2.4 -2,-0.3 -2,-0.0 -0.974 24.9-162.3-152.0 161.4 48.4 36.0 11.3 87 91 A T - 0 0 13 -2,-0.3 11,-0.1 11,-0.2 -71,-0.1 -0.981 25.0-136.4-141.1 143.9 50.5 32.8 11.7 88 92 A P S S+ 0 0 12 0, 0.0 -84,-0.1 0, 0.0 7,-0.1 0.708 72.7 115.3 -70.6 -18.0 54.0 32.6 13.0 89 93BA A - 0 0 9 8,-0.3 -2,-0.2 1,-0.1 6,-0.1 -0.184 54.3-160.2 -51.8 139.2 54.7 30.1 10.2 90 94 A R S S+ 0 0 193 1,-0.1 2,-0.3 -89,-0.0 -1,-0.1 0.682 75.1 14.2 -92.6 -22.7 57.2 31.3 7.7 91 95 A S S S- 0 0 38 1,-0.1 -1,-0.1 0, 0.0 4,-0.1 -0.875 82.5 -99.6-142.7 174.7 56.0 28.9 5.0 92 96 A L S > S+ 0 0 60 -2,-0.3 3,-1.3 1,-0.2 -1,-0.1 0.865 118.7 56.1 -64.9 -38.3 53.1 26.5 4.1 93 97 A E T 3 S+ 0 0 167 1,-0.3 -1,-0.2 3,-0.0 -4,-0.0 0.870 111.2 43.6 -65.6 -33.3 55.0 23.4 5.3 94 98 A E T 3 S+ 0 0 126 -3,-0.1 2,-0.8 -6,-0.0 -1,-0.3 0.302 87.7 120.1 -88.3 7.0 55.5 25.0 8.8 95 99 A F < + 0 0 1 -3,-1.3 3,-0.1 1,-0.2 233,-0.1 -0.648 16.7 126.0 -86.3 103.8 51.8 26.2 8.9 96 100 A N + 0 0 92 -2,-0.8 2,-0.4 1,-0.2 -41,-0.3 0.425 58.5 62.5-131.0 -6.7 49.9 24.7 11.8 97 101 A D - 0 0 37 -44,-0.1 2,-0.4 -43,-0.1 -8,-0.3 -0.968 51.8-169.2-130.9 141.3 48.5 27.7 13.7 98 102 A V - 0 0 0 -2,-0.4 -47,-2.3 -47,-0.2 2,-0.4 -0.994 4.5-166.7-126.3 133.2 46.0 30.5 12.8 99 103 A Y E -DE 50 86B 1 -13,-2.4 -13,-2.1 -2,-0.4 2,-0.4 -0.983 4.4-164.7-120.1 133.8 45.3 33.7 14.9 100 104 A L E -DE 49 85B 10 -51,-2.4 -51,-2.5 -2,-0.4 2,-0.4 -0.934 4.1-163.4-116.2 139.7 42.3 35.9 14.3 101 105 A V E +DE 48 84B 0 -17,-2.7 -18,-2.9 -2,-0.4 -17,-1.4 -0.972 14.9 158.8-131.2 138.9 41.9 39.5 15.7 102 106 A T E -D 47 0B 20 -55,-2.0 -55,-3.0 -2,-0.4 -20,-0.1 -0.928 51.0 -69.4-144.6 165.4 38.9 41.8 16.0 103 107 A H E -D 46 0B 76 -2,-0.3 2,-0.6 -57,-0.2 -57,-0.3 -0.382 54.2-118.7 -57.0 132.0 37.8 44.8 18.1 104 108 A L + 0 0 48 -59,-2.2 -59,-0.2 1,-0.2 -1,-0.1 -0.678 34.9 173.6 -79.9 117.1 37.3 43.9 21.8 105 109 A M - 0 0 20 -2,-0.6 51,-0.4 50,-0.1 -1,-0.2 0.885 34.5-144.0 -82.9 -49.6 33.7 44.5 22.9 106 110 A G + 0 0 61 1,-0.1 2,-0.3 49,-0.1 49,-0.1 0.376 59.7 38.2 109.9 -3.1 34.5 42.8 26.2 107 111 A A - 0 0 31 47,-0.3 47,-2.5 43,-0.0 2,-0.2 -0.980 67.4-121.5-161.4 161.7 31.3 40.9 27.2 108 112 A D B -H 153 0C 38 -2,-0.3 45,-0.2 45,-0.3 4,-0.2 -0.644 38.9-102.9-102.2 171.3 28.5 38.8 25.9 109 113 A L S >> S+ 0 0 4 43,-1.6 4,-1.8 40,-1.4 3,-1.7 0.865 121.3 58.8 -59.8 -39.9 24.8 39.6 26.2 110 114 A N H 3> S+ 0 0 48 39,-0.4 4,-1.3 1,-0.3 -1,-0.2 0.918 92.0 67.4 -55.7 -44.7 24.5 37.0 29.0 111 115 A N H 34 S+ 0 0 108 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.2 0.545 110.6 37.3 -55.8 -7.4 27.1 38.9 31.1 112 116 A I H <4 S+ 0 0 77 -3,-1.7 4,-0.3 -4,-0.2 -1,-0.2 0.698 102.1 68.4-110.0 -37.2 24.4 41.7 31.3 113 117 A V H >< S+ 0 0 23 -4,-1.8 3,-0.9 2,-0.1 -2,-0.2 0.737 79.0 102.2 -54.4 -24.5 21.2 39.6 31.6 114 118 A K T 3< S- 0 0 165 -4,-1.3 3,-0.1 1,-0.2 91,-0.0 -0.424 101.1 -8.8 -66.0 135.4 22.3 38.5 35.1 115 119 A C T 3 S+ 0 0 146 1,-0.1 2,-0.3 -2,-0.1 -1,-0.2 0.390 123.5 91.1 58.5 0.5 20.6 40.3 38.1 116 120 A Q < - 0 0 103 -3,-0.9 2,-0.3 -4,-0.3 -1,-0.1 -0.856 51.5-171.1-126.9 152.0 19.1 42.7 35.5 117 121 A K - 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0 0 121 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.1 -0.516 50.8-102.4 -68.6 131.5 -2.7 16.8 23.2 250 264 A Q - 0 0 150 -2,-0.2 -1,-0.1 -4,-0.1 -4,-0.0 -0.350 43.6-165.8 -60.9 130.8 -3.9 19.6 21.0 251 265 A M - 0 0 55 -3,-0.1 -24,-2.4 -23,-0.1 2,-0.1 -0.976 12.1-130.7-124.5 133.9 -2.8 22.9 22.6 252 266 A P - 0 0 97 0, 0.0 -26,-0.4 0, 0.0 2,-0.3 -0.440 31.8 -97.2 -77.8 155.6 -4.1 26.4 21.7 253 267 A K - 0 0 112 -28,-0.3 -28,-0.2 -2,-0.1 -29,-0.1 -0.586 45.5-128.5 -63.4 126.5 -2.0 29.5 20.9 254 268 A M - 0 0 81 -30,-2.5 2,-0.7 -2,-0.3 3,-0.1 -0.418 27.1 -95.5 -75.4 158.4 -1.8 31.4 24.2 255 269 A N >> - 0 0 95 1,-0.2 4,-2.1 -2,-0.1 3,-1.0 -0.668 30.8-159.2 -75.5 110.6 -2.6 35.1 24.2 256 270 A F H 3> S+ 0 0 0 -2,-0.7 4,-2.7 1,-0.3 -1,-0.2 0.859 91.6 60.6 -62.3 -37.3 0.8 37.0 23.9 257 271 A A H 34 S+ 0 0 54 1,-0.2 -1,-0.3 2,-0.2 6,-0.2 0.802 110.9 43.2 -56.1 -31.7 -0.7 40.2 25.3 258 272 A N H X4 S+ 0 0 109 -3,-1.0 3,-1.0 2,-0.1 -2,-0.2 0.867 114.9 46.3 -81.3 -42.8 -1.4 38.0 28.4 259 273 A V H 3< S+ 0 0 44 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.807 122.7 36.0 -68.5 -35.9 2.0 36.2 28.6 260 274 A F T >< S+ 0 0 2 -4,-2.7 3,-2.2 -5,-0.2 -1,-0.3 -0.093 90.9 173.6-107.0 31.4 4.0 39.3 28.0 261 275 A I T < + 0 0 126 -3,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.536 64.2 16.0 -3.8 -99.8 1.5 41.4 30.1 262 276 A G T 3 S+ 0 0 76 -4,-0.1 -1,-0.3 2,-0.0 2,-0.1 0.049 92.7 120.6 -91.1 27.5 2.7 44.9 30.6 263 277 A A S < S- 0 0 23 -3,-2.2 5,-0.1 1,-0.2 -3,-0.1 -0.414 85.3 -71.5 -74.4 161.0 5.4 45.1 28.0 264 278 A N >> - 0 0 48 1,-0.2 4,-2.0 -2,-0.1 3,-0.8 -0.347 44.7-134.8 -48.7 123.8 5.2 47.7 25.2 265 279 A P H 3> S+ 0 0 102 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.769 106.2 59.7 -61.5 -22.2 2.3 46.4 23.1 266 280 A L H 3> S+ 0 0 73 2,-0.2 4,-2.2 1,-0.2 27,-0.3 0.848 105.0 49.5 -66.5 -37.3 4.4 47.0 20.0 267 281 A A H <> S+ 0 0 0 -3,-0.8 4,-2.9 2,-0.2 -1,-0.2 0.894 109.1 51.6 -67.2 -41.5 7.0 44.6 21.4 268 282 A V H X S+ 0 0 8 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.909 109.9 49.6 -62.4 -40.1 4.2 42.1 22.0 269 283 A D H X S+ 0 0 47 -4,-1.9 4,-1.0 2,-0.2 -2,-0.2 0.910 111.8 47.9 -65.1 -44.2 3.1 42.4 18.4 270 284 A L H >X S+ 0 0 0 -4,-2.2 4,-1.2 1,-0.2 3,-0.8 0.935 110.0 53.6 -60.6 -46.5 6.6 42.0 17.1 271 285 A L H 3X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 3,-0.3 0.869 105.7 52.1 -56.4 -41.0 7.0 38.9 19.3 272 286 A E H 3< S+ 0 0 64 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.744 110.1 49.9 -70.9 -19.0 3.9 37.2 17.9 273 287 A K H << S+ 0 0 82 -4,-1.0 10,-2.3 -3,-0.8 3,-0.3 0.652 115.2 43.8 -88.5 -18.6 5.3 37.8 14.4 274 288 A M H < S+ 0 0 0 -4,-1.2 2,-0.6 -3,-0.3 -2,-0.2 0.814 108.5 55.3 -88.9 -36.5 8.7 36.3 15.3 275 289 A L S < S+ 0 0 2 -4,-2.3 2,-0.4 -5,-0.2 -1,-0.2 -0.322 73.1 135.8-101.6 50.4 7.5 33.3 17.3 276 290 A V - 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