==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/HYDROLASE 17-AUG-11 3TG1 . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR Y.Y.ZHANG,J.W.WU,Z.X.WANG . 464 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22966.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 292 62.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 38 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 2 2 0 2 1 0 1 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 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 PARALLEL BRIDGES PER LADDER . 1 2 2 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 1 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 0 191 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 136.4 25.7 -30.1 51.5 2 6 A P - 0 0 80 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.178 360.0 -89.3 -79.8-158.8 22.8 -31.9 53.2 3 7 A T - 0 0 76 2,-0.0 15,-2.7 13,-0.0 2,-0.2 -0.968 39.6-158.5-123.0 112.4 22.6 -35.4 54.7 4 8 A F E -A 17 0A 38 -2,-0.5 2,-0.4 13,-0.3 11,-0.1 -0.513 3.8-152.1 -89.1 160.3 21.5 -38.2 52.3 5 9 A Y E -A 16 0A 64 11,-1.8 11,-0.9 -2,-0.2 9,-0.0 -0.943 13.0-140.5-137.0 112.5 20.1 -41.6 53.3 6 10 A R + 0 0 151 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.211 30.2 156.1 -66.6 159.4 20.6 -44.6 51.1 7 11 A Q - 0 0 61 7,-0.5 7,-1.8 2,-0.1 2,-0.5 -0.946 36.1-117.6-175.3 160.9 17.8 -47.1 50.5 8 12 A E E +B 13 0B 131 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.946 26.4 175.9-123.1 118.6 16.8 -49.7 48.0 9 13 A L E > S-B 12 0B 27 3,-2.4 3,-1.7 -2,-0.5 -2,-0.1 -0.973 70.4 -22.5-119.6 129.7 13.6 -49.6 46.0 10 14 A N T 3 S- 0 0 127 -2,-0.5 2,-1.2 1,-0.3 -1,-0.2 0.870 122.9 -50.4 34.9 72.7 12.8 -52.1 43.3 11 15 A K T 3 S+ 0 0 199 -3,-0.1 2,-0.4 1,-0.1 -1,-0.3 0.204 121.6 96.6 56.1 -17.2 16.4 -53.2 42.5 12 16 A T E < S-B 9 0B 33 -3,-1.7 -3,-2.4 -2,-1.2 2,-0.6 -0.843 71.7-130.9 -93.6 140.4 17.7 -49.6 42.1 13 17 A I E -B 8 0B 51 -2,-0.4 2,-0.6 -5,-0.2 -5,-0.2 -0.814 16.5-155.6 -96.4 120.7 19.4 -47.8 45.0 14 18 A W - 0 0 3 -7,-1.8 2,-0.6 -2,-0.6 -7,-0.5 -0.844 9.7-174.6-100.2 121.3 18.2 -44.3 45.9 15 19 A E + 0 0 45 -2,-0.6 -9,-0.2 -9,-0.2 -11,-0.1 -0.916 24.1 157.4-114.7 104.9 20.5 -41.8 47.7 16 20 A V E -A 5 0A 0 -11,-0.9 -11,-1.8 -2,-0.6 -2,-0.0 -0.955 43.4 -85.7-135.9 149.9 18.7 -38.6 48.6 17 21 A P E > -A 4 0A 6 0, 0.0 3,-2.4 0, 0.0 -13,-0.3 -0.105 42.3-111.3 -51.7 140.4 18.8 -35.6 51.0 18 22 A E T 3 S+ 0 0 111 -15,-2.7 22,-0.2 1,-0.3 -14,-0.1 0.738 112.9 67.0 -40.7 -38.7 17.2 -35.9 54.5 19 23 A R T 3 S+ 0 0 48 20,-0.1 21,-2.0 -16,-0.1 2,-0.5 0.800 87.2 73.8 -60.7 -32.0 14.5 -33.4 53.5 20 24 A Y E < S+C 39 0C 0 -3,-2.4 2,-0.3 19,-0.2 19,-0.2 -0.762 70.8 170.6 -85.6 128.5 13.0 -35.8 50.9 21 25 A Q E +C 38 0C 67 17,-2.4 17,-1.1 -2,-0.5 -2,-0.0 -0.982 42.7 31.4-142.6 151.6 11.1 -38.6 52.7 22 26 A N E - 0 0 117 -2,-0.3 -1,-0.1 15,-0.2 14,-0.1 0.734 69.1-162.7 75.4 27.2 8.7 -41.5 52.1 23 27 A L E - 0 0 13 -3,-0.1 14,-0.2 15,-0.1 -1,-0.2 -0.096 7.6-172.0 -39.4 125.4 10.0 -42.3 48.6 24 28 A S E -C 36 0C 66 12,-2.5 12,-3.2 -15,-0.0 2,-0.2 -0.942 27.0-118.4-133.3 111.9 7.5 -44.5 46.8 25 29 A P E +C 35 0C 52 0, 0.0 10,-0.2 0, 0.0 3,-0.1 -0.257 34.8 171.9 -52.8 112.1 8.4 -46.1 43.5 26 30 A V E - 0 0 92 8,-2.4 2,-0.3 1,-0.3 9,-0.2 0.636 54.5 -80.6 -96.6 -19.8 5.9 -44.7 40.9 27 31 A G E -C 34 0C 35 7,-1.2 7,-2.7 2,-0.0 -1,-0.3 -0.962 39.3-138.2 151.3-168.5 7.7 -46.2 37.9 28 32 A S + 0 0 76 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.804 17.1 160.7-162.5-157.6 10.5 -46.0 35.4 29 33 A G - 0 0 43 -2,-0.2 -2,-0.0 1,-0.2 0, 0.0 -0.968 65.9 -38.0 151.9-164.4 11.5 -46.5 31.8 30 34 A A S S+ 0 0 110 -2,-0.3 -1,-0.2 1,-0.2 3,-0.1 0.969 131.3 53.0 -53.7 -59.5 14.3 -45.5 29.4 31 35 A Y S S- 0 0 102 1,-0.2 21,-0.3 -3,-0.1 2,-0.3 0.868 119.9 -93.5 -43.2 -52.6 14.6 -42.0 30.9 32 36 A G - 0 0 9 19,-0.2 2,-0.2 2,-0.0 19,-0.2 -0.957 46.6 -49.7 158.1-173.8 15.0 -43.3 34.5 33 37 A S E - D 0 50C 30 17,-1.6 17,-3.5 -2,-0.3 2,-0.4 -0.609 42.5-160.3 -93.0 150.2 13.3 -44.2 37.7 34 38 A V E -CD 27 49C 27 -7,-2.7 -8,-2.4 15,-0.3 -7,-1.2 -0.983 3.9-165.6-136.7 129.7 10.9 -42.0 39.6 35 39 A C E -CD 25 48C 0 13,-2.7 13,-2.8 -2,-0.4 2,-0.3 -0.918 18.7-133.9-113.2 136.3 9.8 -42.0 43.3 36 40 A A E +CD 24 47C 12 -12,-3.2 -12,-2.5 -2,-0.4 11,-0.2 -0.662 43.0 159.1 -78.5 137.2 6.8 -40.2 44.8 37 41 A A E - D 0 46C 3 9,-3.2 9,-0.6 -2,-0.3 2,-0.3 -0.632 40.9-111.8-141.2-159.9 7.8 -38.4 48.0 38 42 A F E -CD 21 45C 86 -17,-1.1 -17,-2.4 7,-0.3 2,-1.0 -0.953 20.5-146.7-146.4 120.9 7.2 -35.8 50.6 39 43 A D E >>> -CD 20 44C 1 5,-2.6 4,-2.7 -2,-0.3 3,-1.2 -0.767 7.9-169.4 -96.4 94.3 9.5 -32.8 51.0 40 44 A T T 345S+ 0 0 85 -21,-2.0 2,-0.2 -2,-1.0 -1,-0.2 0.795 86.7 64.0 -49.3 -31.1 9.5 -31.9 54.7 41 45 A K T 345S+ 0 0 139 -22,-0.4 -1,-0.3 1,-0.2 -21,-0.1 -0.100 123.0 13.0 -86.1 36.7 11.4 -28.7 53.7 42 46 A T T <45S- 0 0 65 -3,-1.2 -2,-0.2 -2,-0.2 -1,-0.2 0.308 92.9-119.6-179.6 -19.6 8.4 -27.5 51.7 43 47 A G T <5 + 0 0 49 -4,-2.7 2,-0.4 1,-0.2 -3,-0.2 0.446 69.9 131.8 78.8 -0.9 5.3 -29.5 52.5 44 48 A H E < -D 39 0C 79 -5,-0.6 -5,-2.6 -6,-0.0 2,-0.3 -0.704 61.3-131.3 -90.8 131.7 5.0 -30.6 48.9 45 49 A R E -D 38 0C 153 -2,-0.4 59,-2.2 -7,-0.2 2,-0.3 -0.618 47.2-170.4 -64.6 132.2 4.5 -34.2 47.8 46 50 A V E -DE 37 103C 0 -9,-0.6 -9,-3.2 -2,-0.3 2,-0.5 -0.884 28.0-123.9-134.1 169.2 7.2 -34.4 45.1 47 51 A A E -DE 36 102C 17 55,-4.0 55,-2.2 -2,-0.3 2,-0.5 -0.942 19.6-165.0-112.9 124.5 8.6 -36.4 42.3 48 52 A V E -DE 35 101C 0 -13,-2.8 -13,-2.7 -2,-0.5 2,-0.6 -0.944 4.9-161.0-109.6 121.9 12.2 -37.5 42.4 49 53 A K E -DE 34 100C 39 51,-3.2 51,-2.2 -2,-0.5 2,-0.7 -0.905 6.1-152.1-105.5 122.1 13.6 -38.8 39.1 50 54 A K E -DE 33 99C 20 -17,-3.5 -17,-1.6 -2,-0.6 2,-0.7 -0.848 9.3-159.1 -93.0 117.7 16.8 -40.8 39.4 51 55 A L E + E 0 98C 9 47,-3.9 47,-2.1 -2,-0.7 2,-0.3 -0.872 16.0 178.8 -98.8 109.3 18.7 -40.4 36.1 52 56 A S E + E 0 97C 65 -2,-0.7 45,-0.1 -21,-0.3 -2,-0.0 -0.816 61.7 17.9-111.0 154.5 21.2 -43.3 35.7 53 57 A R S > S+ 0 0 153 43,-0.6 3,-0.5 -2,-0.3 -1,-0.2 0.933 72.3 150.6 54.2 45.6 23.5 -44.0 32.9 54 58 A P T 3 S+ 0 0 5 0, 0.0 10,-0.4 0, 0.0 11,-0.2 0.672 74.7 38.7 -79.5 -15.5 23.2 -40.3 31.8 55 59 A F T 3 S+ 0 0 8 41,-0.2 6,-0.1 1,-0.1 266,-0.1 0.113 74.7 113.0-122.2 21.6 26.7 -40.5 30.4 56 60 A Q S < S+ 0 0 112 -3,-0.5 2,-0.2 2,-0.0 -1,-0.1 0.066 90.1 12.1 -82.2 28.6 26.9 -44.0 28.8 57 61 A S S > S- 0 0 36 1,-0.1 4,-3.1 -3,-0.1 5,-0.2 -0.879 76.1-109.7 172.2 158.1 27.1 -42.3 25.4 58 62 A I H > S+ 0 0 82 -2,-0.2 4,-2.8 2,-0.2 5,-0.3 0.953 120.8 50.5 -67.4 -49.6 27.7 -39.0 23.7 59 63 A I H > S+ 0 0 128 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.904 116.5 43.1 -52.6 -42.5 24.0 -38.9 22.5 60 64 A H H > S+ 0 0 74 2,-0.2 4,-3.3 3,-0.2 5,-0.2 0.920 111.0 52.5 -71.9 -46.2 23.1 -39.6 26.2 61 65 A A H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 -2,-0.2 0.954 114.9 42.6 -54.8 -52.1 25.5 -37.2 27.8 62 66 A K H X S+ 0 0 34 -4,-2.8 4,-3.4 2,-0.2 -1,-0.2 0.962 112.8 53.0 -58.6 -53.6 24.3 -34.4 25.6 63 67 A R H X S+ 0 0 117 -4,-2.3 4,-2.6 -5,-0.3 5,-0.3 0.906 110.0 48.6 -48.5 -47.7 20.6 -35.4 26.0 64 68 A T H X S+ 0 0 8 -4,-3.3 4,-1.9 -10,-0.4 -1,-0.3 0.930 112.2 49.5 -60.9 -42.3 21.2 -35.3 29.8 65 69 A Y H X S+ 0 0 15 -4,-2.5 4,-2.6 -5,-0.2 5,-0.2 0.949 111.1 49.6 -58.4 -50.6 22.8 -31.9 29.4 66 70 A R H X S+ 0 0 79 -4,-3.4 4,-2.6 1,-0.2 5,-0.3 0.950 109.4 49.0 -55.6 -56.1 19.9 -30.6 27.3 67 71 A E H X S+ 0 0 16 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.902 112.9 48.5 -54.0 -45.4 17.1 -31.7 29.6 68 72 A L H X S+ 0 0 5 -4,-1.9 4,-2.7 -5,-0.3 5,-0.2 0.960 112.7 45.8 -62.6 -50.6 18.8 -30.2 32.6 69 73 A R H X S+ 0 0 43 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.924 115.2 48.2 -57.2 -46.4 19.5 -26.8 31.0 70 74 A L H X S+ 0 0 30 -4,-2.6 4,-1.6 -5,-0.2 -1,-0.2 0.880 112.4 48.8 -60.9 -42.0 16.0 -26.7 29.6 71 75 A L H < S+ 0 0 8 -4,-2.4 11,-0.8 -5,-0.3 -1,-0.2 0.871 108.0 53.2 -69.8 -37.9 14.5 -27.6 32.9 72 76 A K H < S+ 0 0 36 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.771 108.6 54.7 -68.3 -22.6 16.5 -25.0 34.8 73 77 A H H < S+ 0 0 42 -4,-1.2 2,-0.2 -5,-0.2 -2,-0.2 0.912 84.7 84.9 -79.1 -47.7 15.2 -22.4 32.4 74 78 A M < + 0 0 4 -4,-1.6 8,-0.4 6,-0.1 2,-0.2 -0.420 43.0 165.7 -64.7 124.0 11.4 -22.7 32.6 75 79 A K + 0 0 165 -2,-0.2 2,-0.3 6,-0.1 6,-0.1 -0.698 30.7 118.7-138.6 80.7 9.9 -20.7 35.5 76 80 A H > - 0 0 19 3,-0.4 3,-2.7 -2,-0.2 57,-0.0 -0.989 67.8-122.7-152.6 134.0 6.2 -20.5 34.8 77 81 A E T 3 S+ 0 0 51 -2,-0.3 4,-0.1 1,-0.3 302,-0.1 0.667 113.7 46.7 -49.3 -23.2 3.1 -21.7 36.7 78 82 A N T 3 S+ 0 0 2 83,-0.1 84,-1.8 2,-0.1 2,-0.4 0.204 102.9 73.6-111.7 19.0 2.0 -23.8 33.7 79 83 A V B < S-g 162 0D 1 -3,-2.7 -3,-0.4 82,-0.3 84,-0.2 -0.992 91.5 -96.8-135.0 139.9 5.3 -25.4 32.9 80 84 A I - 0 0 14 82,-2.9 2,-0.4 -2,-0.4 -6,-0.1 -0.252 49.5-164.8 -50.2 130.1 7.2 -28.2 34.6 81 85 A G - 0 0 21 -6,-0.1 2,-0.8 -4,-0.1 22,-0.4 -0.949 22.9-114.9-128.3 149.0 9.7 -26.6 36.9 82 86 A L + 0 0 11 -11,-0.8 20,-0.2 -8,-0.4 3,-0.1 -0.693 25.9 177.3 -84.1 109.4 12.8 -27.8 38.8 83 87 A L S S- 0 0 27 18,-2.3 2,-0.3 -2,-0.8 19,-0.2 0.761 73.8 -15.9 -76.1 -29.1 12.3 -27.6 42.6 84 88 A D E -F 101 0C 20 17,-1.3 17,-3.2 249,-0.1 -1,-0.3 -0.950 52.3-162.8-171.1 155.2 15.8 -29.2 43.1 85 89 A V E +F 100 0C 6 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.967 26.7 162.0-146.2 129.0 18.6 -31.1 41.3 86 90 A F E -F 99 0C 16 13,-1.9 13,-1.8 -2,-0.3 3,-0.1 -0.928 25.7-155.6-147.2 171.0 21.3 -33.0 43.3 87 91 A T - 0 0 13 -2,-0.3 11,-0.1 11,-0.2 -71,-0.1 -0.972 18.0-147.5-150.5 129.8 24.1 -35.6 43.2 88 92 A P S S+ 0 0 15 0, 0.0 -1,-0.1 0, 0.0 7,-0.1 0.869 75.1 103.9 -67.0 -29.0 25.6 -37.7 46.0 89 93 A A - 0 0 15 8,-0.2 -2,-0.2 1,-0.1 6,-0.1 -0.100 54.0-167.5 -47.8 145.0 28.9 -37.5 44.1 90 94 A R + 0 0 174 1,-0.2 2,-0.3 5,-0.0 -1,-0.1 0.675 69.4 45.0-109.0 -28.4 31.3 -35.1 45.6 91 95 A S S >> S- 0 0 38 1,-0.1 3,-0.8 0, 0.0 4,-0.6 -0.880 85.2-117.0-118.4 149.5 33.9 -34.9 42.8 92 96 A L T 34 S+ 0 0 70 -2,-0.3 233,-0.1 1,-0.3 -1,-0.1 0.667 119.3 55.5 -55.8 -14.4 33.3 -34.6 39.0 93 97 A E T 34 S+ 0 0 171 1,-0.2 -1,-0.3 3,-0.0 -4,-0.0 0.825 105.6 46.3 -87.6 -36.7 34.9 -38.1 38.9 94 98 A E T <4 S+ 0 0 90 -3,-0.8 2,-0.4 -6,-0.0 -2,-0.2 0.368 94.9 110.9 -84.6 3.8 32.5 -39.7 41.4 95 99 A F < + 0 0 0 -4,-0.6 3,-0.1 1,-0.1 230,-0.0 -0.669 19.8 112.7 -86.3 130.9 29.8 -38.1 39.3 96 100 A N + 0 0 61 -2,-0.4 -43,-0.6 1,-0.3 2,-0.3 0.165 59.3 81.6 176.6 28.7 27.5 -40.3 37.2 97 101 A D E -E 52 0C 30 -45,-0.1 2,-0.4 -44,-0.1 -1,-0.3 -0.978 51.8-171.4-146.6 130.2 24.1 -40.0 38.9 98 102 A V E -E 51 0C 2 -47,-2.1 -47,-3.9 -2,-0.3 2,-0.5 -0.992 3.4-166.7-130.0 135.3 21.6 -37.2 38.5 99 103 A Y E -EF 50 86C 0 -13,-1.8 -13,-1.9 -2,-0.4 2,-0.4 -0.978 4.0-165.0-122.9 125.7 18.4 -36.6 40.5 100 104 A L E -EF 49 85C 6 -51,-2.2 -51,-3.2 -2,-0.5 2,-0.4 -0.905 5.6-158.5-111.8 136.1 15.7 -34.2 39.4 101 105 A V E +EF 48 84C 0 -17,-3.2 -18,-2.3 -2,-0.4 -17,-1.3 -0.957 19.6 156.9-118.1 133.5 13.0 -33.0 41.8 102 106 A T E -E 47 0C 24 -55,-2.2 -55,-4.0 -2,-0.4 -20,-0.1 -0.985 51.8 -74.6-149.4 156.7 9.6 -31.5 40.8 103 107 A H E -E 46 0C 55 -22,-0.4 2,-0.8 -2,-0.3 -57,-0.3 -0.225 53.0-115.2 -48.6 132.1 6.1 -31.1 42.3 104 108 A L - 0 0 39 -59,-2.2 2,-0.7 -67,-0.1 -59,-0.1 -0.673 35.7-160.8 -70.2 112.1 4.5 -34.5 42.2 105 109 A M - 0 0 47 -2,-0.8 2,-0.2 50,-0.1 49,-0.1 -0.896 7.3-144.6-101.5 117.5 1.7 -33.6 39.8 106 110 A G + 0 0 38 -2,-0.7 48,-0.5 47,-0.1 -2,-0.0 -0.486 57.0 2.0 -79.9 150.9 -1.1 -36.1 40.1 107 111 A A - 0 0 52 -2,-0.2 47,-0.4 46,-0.1 2,-0.3 0.201 66.7-129.7 63.3 172.1 -3.1 -37.3 37.1 108 112 A D > - 0 0 26 45,-0.2 4,-2.2 52,-0.0 3,-0.3 -0.949 32.5 -96.7-153.8 157.6 -2.6 -36.2 33.5 109 113 A L H > S+ 0 0 0 43,-2.7 4,-2.4 40,-1.0 5,-0.2 0.797 123.0 60.0 -51.9 -31.7 -5.1 -35.0 30.9 110 114 A N H > S+ 0 0 70 39,-0.6 4,-2.1 42,-0.3 -1,-0.2 0.980 107.1 43.5 -58.8 -58.4 -5.4 -38.5 29.6 111 115 A N H > S+ 0 0 56 -3,-0.3 4,-1.0 1,-0.2 -2,-0.2 0.921 113.4 51.9 -53.8 -50.0 -6.6 -39.8 33.0 112 116 A I H >X S+ 0 0 10 -4,-2.2 4,-2.3 1,-0.2 3,-1.3 0.954 111.0 45.9 -52.6 -57.7 -9.0 -36.9 33.5 113 117 A V H 3< S+ 0 0 28 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.832 113.3 49.7 -56.9 -38.2 -10.7 -37.3 30.1 114 118 A K H 3< S+ 0 0 140 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.626 115.5 45.3 -77.4 -11.8 -11.1 -41.0 30.4 115 119 A C H << S+ 0 0 73 -3,-1.3 2,-0.3 -4,-1.0 -2,-0.2 0.898 119.5 3.2 -96.4 -52.6 -12.6 -40.7 33.9 116 120 A Q < - 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0 0 43 -2,-0.4 -9,-0.1 1,-0.1 -10,-0.0 -0.379 25.7-151.0 -56.8 130.2 -9.8 -38.7 19.8 205 222 A L S S+ 0 0 37 -11,-0.3 -1,-0.1 1,-0.2 -34,-0.1 0.929 84.7 21.6 -74.7 -48.3 -10.1 -36.5 16.7 206 223 A F + 0 0 6 -36,-0.3 2,-2.0 2,-0.1 -1,-0.2 -0.626 66.1 169.5-124.1 72.1 -7.5 -38.1 14.5 207 224 A P + 0 0 64 0, 0.0 2,-0.2 0, 0.0 -37,-0.1 -0.560 24.2 178.3 -82.6 76.8 -6.9 -41.6 15.6 208 225 A G - 0 0 3 -2,-2.0 2,-1.0 -41,-0.1 -39,-0.1 -0.551 31.0-134.2 -85.5 147.7 -4.9 -42.6 12.6 209 226 A T S > S- 0 0 98 -2,-0.2 4,-0.6 1,-0.1 3,-0.2 -0.838 87.1 -20.0-101.5 91.7 -3.2 -45.9 12.0 210 227 A D T 4 S- 0 0 82 -2,-1.0 2,-1.1 1,-0.2 -1,-0.1 0.570 98.1 -92.2 88.1 11.5 0.3 -45.2 10.8 211 228 A H T > S+ 0 0 91 1,-0.2 4,-1.8 4,-0.0 -1,-0.2 0.036 112.4 88.9 89.3 -28.1 -0.1 -41.7 9.6 212 229 A I H > S+ 0 0 63 -2,-1.1 4,-1.6 -3,-0.2 3,-0.5 0.977 105.0 31.6 -44.5 -67.3 -0.9 -42.3 6.0 213 230 A D H X S+ 0 0 31 -4,-0.6 4,-4.8 1,-0.2 5,-0.3 0.804 109.8 72.1 -68.2 -25.0 -4.5 -42.4 7.1 214 231 A Q H > S+ 0 0 1 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.944 103.7 39.5 -50.8 -49.2 -3.5 -39.9 9.7 215 232 A L H X S+ 0 0 15 -4,-1.8 4,-2.9 -3,-0.5 -1,-0.3 0.834 115.1 53.5 -69.2 -35.0 -3.2 -37.5 6.8 216 233 A K H X S+ 0 0 95 -4,-1.6 4,-3.0 2,-0.2 -2,-0.2 0.964 109.3 47.6 -63.5 -52.1 -6.3 -38.9 5.3 217 234 A L H < S+ 0 0 36 -4,-4.8 4,-0.5 2,-0.2 -2,-0.2 0.911 114.0 48.0 -54.1 -45.8 -8.3 -38.4 8.5 218 235 A I H >X S+ 0 0 0 -4,-2.1 3,-2.6 -5,-0.3 4,-1.9 0.987 113.2 45.6 -60.0 -59.2 -7.0 -34.9 8.8 219 236 A L H 3X S+ 0 0 1 -4,-2.9 4,-2.4 1,-0.3 -2,-0.2 0.855 103.0 66.7 -50.8 -40.2 -7.8 -34.0 5.2 220 237 A R H 3< S+ 0 0 156 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.665 113.5 31.2 -55.9 -18.6 -11.2 -35.6 5.6 221 238 A L H <4 S+ 0 0 9 -3,-2.6 30,-2.7 -4,-0.5 -2,-0.2 0.831 127.6 33.1-106.3 -60.5 -12.0 -32.8 8.1 222 239 A V H < S- 0 0 19 -4,-1.9 28,-0.2 28,-0.2 -3,-0.2 0.747 112.5-119.3 -71.9 -23.0 -10.1 -29.6 7.0 223 240 A G < - 0 0 7 -4,-2.4 -1,-0.1 -5,-0.5 -3,-0.1 -0.012 34.0 -57.8 99.7 153.5 -10.4 -30.5 3.4 224 241 A T S S- 0 0 21 24,-1.9 26,-0.1 1,-0.1 6,-0.1 -0.409 76.3 -81.1 -65.3 141.8 -8.0 -31.3 0.6 225 242 A P - 0 0 32 0, 0.0 -1,-0.1 0, 0.0 23,-0.0 0.264 43.4-119.1 -40.1 164.9 -5.6 -28.3 -0.1 226 243 A G - 0 0 39 -3,-0.1 4,-0.2 1,-0.0 -3,-0.0 0.180 39.2 -85.0 -86.4-148.8 -6.5 -25.3 -2.1 227 244 A A S S+ 0 0 77 2,-0.1 4,-0.4 3,-0.1 -1,-0.0 0.851 126.2 20.4 -91.5 -43.6 -4.8 -24.2 -5.3 228 245 A E S S+ 0 0 134 2,-0.2 3,-0.1 1,-0.1 -1,-0.0 0.783 115.9 67.9 -93.3 -35.1 -1.9 -22.2 -3.8 229 246 A L S > S+ 0 0 48 1,-0.3 3,-1.4 2,-0.2 -2,-0.1 0.892 99.7 51.8 -51.5 -43.3 -2.1 -23.8 -0.4 230 247 A L G > S+ 0 0 47 1,-0.3 3,-0.9 -4,-0.2 -1,-0.3 0.908 104.1 57.7 -62.1 -37.3 -0.9 -27.0 -2.0 231 248 A K G 3 S+ 0 0 153 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.2 -0.006 93.5 72.9 -81.9 33.3 1.9 -24.9 -3.5 232 249 A K G < S+ 0 0 81 -3,-1.4 -1,-0.3 -2,-0.2 2,-0.2 0.039 87.3 80.8-129.1 23.4 2.8 -24.1 0.1 233 250 A I < - 0 0 44 -3,-0.9 2,-0.2 2,-0.1 -3,-0.0 -0.528 60.0-130.0-126.0-171.7 4.3 -27.4 1.1 234 251 A S + 0 0 45 -2,-0.2 5,-0.3 -59,-0.0 -2,-0.1 -0.694 52.2 57.5-131.8-176.6 7.3 -29.7 1.0 235 252 A S - 0 0 48 -2,-0.2 -2,-0.1 3,-0.2 -55,-0.1 0.005 62.5-119.1 79.4 171.2 8.4 -33.3 0.2 236 253 A E S > S+ 0 0 154 3,-0.1 4,-1.8 2,-0.1 3,-0.3 0.723 111.5 40.1-105.0 -71.1 8.0 -35.1 -3.0 237 254 A S H >> S+ 0 0 64 1,-0.2 4,-2.3 2,-0.2 3,-0.8 0.922 113.5 53.5 -40.8 -67.6 5.9 -38.0 -1.8 238 255 A A H 3> S+ 0 0 0 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.872 108.5 52.0 -35.5 -54.9 3.8 -35.8 0.5 239 256 A R H 3> S+ 0 0 70 -5,-0.3 4,-1.2 -3,-0.3 -1,-0.3 0.898 112.8 43.7 -52.5 -47.6 3.0 -33.5 -2.5 240 257 A N H < S+ 0 0 23 -4,-1.7 3,-1.2 1,-0.3 -1,-0.2 0.900 114.6 42.2 -50.5 -47.0 -2.6 -35.4 -1.7 243 260 A Q H 3< S+ 0 0 120 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.849 108.4 61.9 -68.2 -32.5 -3.1 -35.0 -5.4 244 261 A S H 3< S+ 0 0 93 -4,-3.1 -1,-0.3 -5,-0.1 -2,-0.2 0.542 97.3 81.1 -66.2 -9.0 -3.3 -38.8 -5.5 245 262 A L S << S- 0 0 31 -3,-1.2 2,-0.6 -4,-0.6 3,-0.0 -0.621 94.1 -98.8-100.3 160.4 -6.4 -38.4 -3.2 246 263 A A - 0 0 83 -2,-0.2 -22,-0.1 1,-0.1 -2,-0.1 -0.684 49.7-104.3 -81.4 116.1 -10.0 -37.6 -4.1 247 264 A Q - 0 0 139 -2,-0.6 -1,-0.1 -4,-0.2 -4,-0.0 -0.118 42.5-165.8 -43.7 117.4 -10.6 -33.9 -3.5 248 265 A M - 0 0 56 -23,-0.0 -24,-1.9 -29,-0.0 2,-0.2 -0.836 15.1-123.8-110.0 145.4 -12.6 -33.6 -0.2 249 266 A P - 0 0 106 0, 0.0 -26,-0.2 0, 0.0 2,-0.1 -0.622 32.2 -98.2 -90.3 150.7 -14.4 -30.4 0.9 250 267 A K - 0 0 108 -2,-0.2 -28,-0.2 -28,-0.2 -27,-0.1 -0.435 40.8-130.5 -63.9 133.2 -13.7 -28.7 4.2 251 268 A M - 0 0 93 -30,-2.7 2,-0.9 -2,-0.1 -1,-0.1 -0.442 18.0-112.7 -80.9 158.8 -16.4 -29.7 6.8 252 269 A N >> - 0 0 89 1,-0.2 3,-3.7 -2,-0.1 4,-0.8 -0.845 20.2-147.9 -95.8 104.6 -18.2 -27.1 8.8 253 270 A F H 3> S+ 0 0 2 -2,-0.9 4,-3.2 1,-0.3 3,-0.3 0.721 93.0 74.3 -42.3 -28.8 -17.0 -27.6 12.4 254 271 A A H 34 S+ 0 0 51 1,-0.3 -1,-0.3 2,-0.2 5,-0.3 0.708 102.0 41.8 -59.9 -19.5 -20.4 -26.5 13.6 255 272 A N H <4 S+ 0 0 114 -3,-3.7 3,-0.5 3,-0.1 -1,-0.3 0.675 114.2 50.5 -99.7 -23.3 -21.7 -29.9 12.4 256 273 A V H < S+ 0 0 58 -4,-0.8 2,-0.6 -3,-0.3 -2,-0.2 0.902 115.3 41.4 -79.7 -43.9 -18.8 -31.9 13.7 257 274 A F S >< S- 0 0 11 -4,-3.2 3,-1.8 3,-0.1 -1,-0.2 -0.455 86.9-171.7-103.5 58.4 -18.9 -30.4 17.2 258 275 A I T 3 + 0 0 128 -2,-0.6 -3,-0.1 -3,-0.5 3,-0.1 -0.197 68.0 8.5 -54.8 134.8 -22.7 -30.4 17.7 259 276 A G T 3 S+ 0 0 87 -5,-0.3 -1,-0.3 1,-0.3 2,-0.2 0.551 97.1 135.1 71.9 8.2 -24.0 -28.6 20.8 260 277 A A S < S- 0 0 26 -3,-1.8 -1,-0.3 -6,-0.2 -3,-0.1 -0.557 71.3 -80.7 -88.0 153.8 -20.5 -27.3 21.6 261 278 A N >> - 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0 0 36 -2,-1.7 6,-0.1 -3,-0.2 5,-0.1 -0.892 53.5-145.1-107.3 136.4 -5.8 -24.9 9.9 274 291 A L S S+ 0 0 38 -2,-0.4 2,-1.2 1,-0.1 -99,-0.2 0.827 85.3 75.4 -73.2 -33.2 -3.6 -26.8 7.4 275 292 A D S >> S- 0 0 10 1,-0.2 3,-3.8 2,-0.1 4,-1.1 -0.691 70.9-158.4 -83.2 98.3 -1.6 -23.7 6.4 276 293 A S T 34 S+ 0 0 18 -2,-1.2 -1,-0.2 1,-0.3 -90,-0.1 0.663 90.9 63.2 -51.4 -17.1 0.7 -23.2 9.4 277 294 A D T 34 S+ 0 0 121 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.1 0.631 106.1 43.2 -84.7 -12.2 1.1 -19.6 8.3 278 295 A K T <4 S+ 0 0 140 -3,-3.8 -2,-0.2 2,-0.1 -1,-0.2 0.567 89.8 112.3-101.7 -16.8 -2.6 -19.0 8.8 279 296 A R S < S- 0 0 9 -4,-1.1 -8,-0.2 -6,-0.1 -9,-0.1 -0.389 74.8-111.9 -63.9 129.8 -2.7 -20.9 12.1 280 297 A I - 0 0 14 -10,-2.0 2,-0.1 -13,-0.2 -1,-0.1 -0.164 30.7-121.8 -58.3 149.4 -3.3 -18.7 15.1 281 298 A T > - 0 0 57 1,-0.1 4,-2.2 -92,-0.0 5,-0.2 -0.427 21.2-110.0 -89.0 172.4 -0.5 -18.1 17.7 282 299 A A H > S+ 0 0 3 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.967 121.7 48.5 -63.9 -49.0 -0.6 -18.9 21.4 283 300 A A H > S+ 0 0 50 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.926 113.8 46.1 -53.8 -50.1 -0.6 -15.1 22.2 284 301 A Q H > S+ 0 0 111 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.834 111.0 52.7 -63.6 -34.4 -3.4 -14.5 19.6 285 302 A A H >< S+ 0 0 0 -4,-2.2 3,-1.1 1,-0.2 -1,-0.2 0.877 99.7 62.9 -71.2 -36.1 -5.4 -17.5 20.9 286 303 A L H 3< S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.874 105.5 47.5 -52.9 -38.3 -5.1 -16.1 24.5 287 304 A A H 3< S+ 0 0 55 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.580 83.4 118.3 -83.0 -14.0 -7.1 -13.1 23.3 288 305 A H S X< S- 0 0 19 -3,-1.1 3,-2.2 -4,-0.5 7,-0.1 -0.210 81.6-109.5 -54.7 149.4 -9.8 -15.0 21.5 289 306 A A G > S+ 0 0 54 1,-0.3 3,-1.1 2,-0.2 4,-0.2 0.624 111.4 77.5 -56.2 -16.8 -13.3 -14.4 22.9 290 307 A Y G 3 S+ 0 0 2 -27,-0.3 -1,-0.3 1,-0.2 3,-0.1 0.745 98.8 41.9 -67.5 -22.4 -13.3 -18.0 24.2 291 308 A F G X> S+ 0 0 0 -3,-2.2 4,-2.6 -6,-0.2 3,-1.7 0.172 76.2 129.6-110.8 17.4 -11.0 -16.9 27.1 292 309 A A G X4 S+ 0 0 64 -3,-1.1 3,-0.6 1,-0.3 -1,-0.1 0.855 73.2 44.7 -34.2 -70.9 -12.7 -13.6 27.9 293 310 A Q G 34 S+ 0 0 54 1,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.707 123.6 38.0 -52.9 -24.1 -13.2 -14.1 31.7 294 311 A Y G <4 S+ 0 0 25 -3,-1.7 2,-0.5 -8,-0.1 -1,-0.2 0.640 83.8 111.1-105.9 -19.5 -9.6 -15.3 32.0 295 312 A H << + 0 0 65 -4,-2.6 5,-0.1 -3,-0.6 -8,-0.0 -0.444 31.1 157.9 -65.2 114.1 -7.6 -13.2 29.5 296 313 A D > - 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