==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 27-MAR-06 2GHM . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR R.L.WALTER,M.J.MEKEL,A.G.EVDOKIMOV,M.E.POKROSS,J.A.MAIER . 336 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17024.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 210 62.5 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 . 39 11.6 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 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 0 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 . 0 1 2 0 3 0 1 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 5 A R 0 0 172 0, 0.0 2,-0.1 0, 0.0 89,-0.0 0.000 360.0 360.0 360.0 142.1 24.2 3.6 7.4 2 6 A P - 0 0 71 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.448 360.0 -95.1 -96.1-178.8 24.3 4.7 11.1 3 7 A T - 0 0 95 -2,-0.1 15,-2.7 1,-0.0 16,-0.3 -0.722 35.8-156.5-103.3 146.6 26.1 3.2 14.1 4 8 A F E -A 17 0A 34 -2,-0.3 2,-0.3 13,-0.3 11,-0.1 -0.706 3.5-153.3-116.8 166.2 24.5 0.8 16.6 5 9 A Y E -A 16 0A 34 11,-1.9 11,-1.4 -2,-0.2 2,-0.5 -0.982 11.7-132.7-141.6 158.4 25.0 -0.3 20.2 6 10 A R E +A 15 0A 168 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.907 28.0 157.1-119.5 123.6 24.3 -3.3 22.2 7 11 A Q E -A 14 0A 72 7,-1.7 7,-2.2 -2,-0.5 2,-0.7 -0.891 38.8-118.6-129.3 168.1 22.7 -3.7 25.6 8 12 A E E -A 13 0A 137 -2,-0.3 2,-1.2 5,-0.2 5,-0.3 -0.920 21.6-165.8-109.6 109.2 20.8 -6.6 27.4 9 13 A L - 0 0 18 3,-1.4 3,-0.3 -2,-0.7 4,-0.0 -0.620 65.9 -55.8 -96.2 75.1 17.2 -5.6 28.2 10 14 A N S S- 0 0 120 -2,-1.2 2,-1.4 1,-0.3 -1,-0.2 0.961 116.1 -28.4 59.3 89.0 16.2 -8.3 30.7 11 15 A K S S+ 0 0 195 -3,-0.1 -1,-0.3 1,-0.0 -2,-0.1 -0.691 128.9 81.4 64.2 -88.2 16.8 -11.6 28.8 12 16 A T S S- 0 0 58 -2,-1.4 -3,-1.4 -3,-0.3 2,-0.3 -0.033 71.3-151.6 -39.6 130.8 16.2 -10.0 25.4 13 17 A I E -A 8 0A 69 -5,-0.3 2,-0.3 -3,-0.1 -5,-0.2 -0.755 10.9-154.4-102.5 163.2 19.3 -8.2 24.1 14 18 A W E -A 7 0A 4 -7,-2.2 -7,-1.7 -2,-0.3 2,-0.5 -1.000 16.3-167.0-147.1 127.0 18.9 -5.3 21.6 15 19 A E E +A 6 0A 28 -2,-0.3 -9,-0.2 -9,-0.2 -11,-0.0 -0.928 28.7 158.5-120.0 109.5 21.0 -3.6 18.9 16 20 A V E -A 5 0A 3 -11,-1.4 -11,-1.9 -2,-0.5 2,-0.1 -0.813 46.7 -86.9-126.4 160.3 19.7 -0.2 17.8 17 21 A P E > -A 4 0A 5 0, 0.0 3,-1.7 0, 0.0 -13,-0.3 -0.426 38.4-119.6 -59.9 143.3 21.0 2.9 16.1 18 22 A E T 3 S+ 0 0 88 -15,-2.7 22,-0.2 1,-0.3 -14,-0.1 0.680 107.4 83.2 -61.1 -18.5 22.5 5.4 18.5 19 23 A R T 3 S+ 0 0 58 -16,-0.3 21,-2.5 1,-0.1 2,-0.8 0.941 87.5 62.4 -43.1 -45.6 19.8 7.8 17.2 20 24 A Y E < S+B 39 0B 1 -3,-1.7 2,-0.2 19,-0.2 19,-0.2 -0.765 71.3 165.6 -90.5 110.9 17.7 6.0 19.8 21 25 A Q E +B 38 0B 63 17,-2.0 17,-2.7 -2,-0.8 -3,-0.0 -0.747 47.0 44.6-109.1 163.1 18.9 6.4 23.4 22 26 A N E - 0 0 127 -2,-0.2 2,-0.6 1,-0.2 -1,-0.2 0.914 64.5-169.5 79.4 50.7 17.2 5.7 26.8 23 27 A L E + 0 0 17 -3,-0.1 14,-0.2 14,-0.1 -1,-0.2 -0.607 10.6 173.4 -84.7 114.5 15.7 2.3 26.3 24 28 A S E -B 36 0B 68 12,-2.1 12,-2.9 -2,-0.6 -15,-0.0 -0.978 33.8-121.6-124.7 120.0 13.3 1.4 29.0 25 29 A P E -B 35 0B 60 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.310 21.4-168.4 -70.9 141.5 11.4 -1.8 28.5 26 30 A V E - 0 0 91 8,-2.7 2,-0.3 1,-0.4 9,-0.2 0.389 53.1 -73.1-109.8 -6.4 7.6 -1.3 28.6 27 31 A G E -B 34 0B 39 7,-0.8 7,-1.3 2,-0.0 -1,-0.4 -0.918 48.9 -94.3 141.3-162.8 6.5 -5.0 28.7 28 32 A S + 0 0 111 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.824 23.2 169.3-151.9 174.8 6.2 -8.1 26.7 29 33 A G - 0 0 52 3,-0.4 -2,-0.0 -2,-0.2 3,-0.0 -0.947 49.4 -89.7-179.4 173.8 4.2 -10.5 24.5 30 34 A A S S+ 0 0 80 -2,-0.3 3,-0.1 1,-0.2 22,-0.0 0.606 118.3 47.7 -85.2 -12.7 4.6 -13.5 22.2 31 35 A Y S S- 0 0 110 1,-0.4 21,-2.1 21,-0.1 2,-0.3 0.611 127.2 -42.7-104.3 -18.2 5.2 -11.7 18.9 32 36 A G E - C 0 51B 10 19,-0.3 -3,-0.4 20,-0.1 -1,-0.4 -0.968 54.0-111.8-179.8-174.1 7.8 -9.2 20.2 33 37 A S E - C 0 50B 15 17,-1.6 17,-1.9 -2,-0.3 2,-0.4 -0.949 26.0-135.6-136.8 161.0 8.7 -7.0 23.0 34 38 A V E -BC 27 49B 42 -7,-1.3 -8,-2.7 -2,-0.3 -7,-0.8 -0.924 9.0-162.2-124.4 139.3 8.9 -3.1 23.3 35 39 A C E -BC 25 48B 0 13,-2.6 13,-2.7 -2,-0.4 2,-0.2 -0.964 21.5-133.1-108.0 139.1 11.1 -0.4 24.7 36 40 A A E +BC 24 47B 18 -12,-2.9 -12,-2.1 -2,-0.4 2,-0.3 -0.571 41.6 179.8 -70.8 149.8 10.1 3.1 25.3 37 41 A A E - C 0 46B 6 9,-2.0 9,-3.2 -2,-0.2 2,-0.4 -1.000 34.6-122.2-163.1 155.4 12.8 5.3 23.9 38 42 A F E -BC 21 45B 80 -17,-2.7 -17,-2.0 -2,-0.3 2,-0.7 -0.840 23.9-148.0-103.8 132.4 14.1 8.7 23.3 39 43 A D E >> -B 20 0B 0 5,-1.5 4,-1.9 -2,-0.4 3,-1.3 -0.901 3.8-162.1-112.4 106.2 14.8 9.6 19.7 40 44 A T T 34 S+ 0 0 73 -21,-2.5 -1,-0.2 -2,-0.7 -20,-0.1 0.779 84.8 61.6 -53.3 -33.7 17.6 12.1 19.5 41 45 A K T 34 S+ 0 0 135 -22,-0.2 -1,-0.3 1,-0.2 -21,-0.1 0.661 119.7 16.3 -76.1 -22.4 16.6 13.1 15.9 42 46 A T T <4 S- 0 0 61 -3,-1.3 -1,-0.2 2,-0.2 -2,-0.2 0.490 92.3-121.4-130.5 -5.4 13.1 14.5 16.6 43 47 A G S < S+ 0 0 50 -4,-1.9 2,-0.1 1,-0.2 -3,-0.1 0.126 72.3 122.5 84.9 -19.5 12.9 15.1 20.3 44 48 A H - 0 0 104 -5,-0.2 -5,-1.5 -6,-0.1 -1,-0.2 -0.437 67.7-116.3 -85.5 148.6 9.9 12.8 20.6 45 49 A R E -C 38 0B 185 -7,-0.2 59,-1.6 -2,-0.1 2,-0.3 -0.558 42.5-173.0 -72.0 143.2 9.5 9.8 22.8 46 50 A V E -CD 37 103B 0 -9,-3.2 -9,-2.0 57,-0.3 2,-0.5 -0.921 22.6-124.0-140.4 162.3 9.1 6.7 20.6 47 51 A A E -CD 36 102B 17 55,-3.6 55,-2.0 -2,-0.3 2,-0.4 -0.965 20.1-163.3-117.8 128.3 8.3 3.0 20.9 48 52 A V E -CD 35 101B 2 -13,-2.7 -13,-2.6 -2,-0.5 2,-0.5 -0.941 2.3-166.9-116.8 127.2 10.6 0.3 19.5 49 53 A K E -CD 34 100B 52 51,-2.6 51,-2.1 -2,-0.4 2,-0.5 -0.967 5.2-160.9-121.6 113.4 9.4 -3.3 19.0 50 54 A K E -CD 33 99B 29 -17,-1.9 -17,-1.6 -2,-0.5 49,-0.2 -0.823 27.0-123.0 -87.9 123.4 11.9 -6.1 18.4 51 55 A L E -C 32 0B 9 47,-2.5 -19,-0.3 -2,-0.5 47,-0.2 -0.368 15.6-134.0 -65.8 142.1 10.2 -9.2 16.8 52 56 A S S S- 0 0 50 -21,-2.1 3,-0.1 1,-0.2 -1,-0.1 0.965 84.3 -14.9 -60.3 -82.6 10.5 -12.4 18.7 53 57 A R S > S+ 0 0 162 1,-0.2 3,-1.1 -22,-0.1 4,-0.3 -0.644 73.6 173.4-133.3 74.6 11.4 -15.0 16.2 54 58 A P T 3 S+ 0 0 2 0, 0.0 10,-0.4 0, 0.0 11,-0.2 0.682 79.5 22.5 -65.1 -28.0 10.6 -13.3 12.9 55 59 A F T 3 S+ 0 0 8 41,-0.3 6,-0.1 -3,-0.1 269,-0.1 0.141 82.1 116.2-127.5 16.4 12.0 -16.0 10.6 56 60 A Q S < S- 0 0 108 -3,-1.1 2,-0.3 2,-0.0 -1,-0.1 0.677 89.8 -4.6 -55.4 -27.6 12.0 -19.1 12.8 57 61 A S S > S- 0 0 39 -4,-0.3 4,-2.1 -3,-0.1 5,-0.1 -0.912 81.4 -89.3-154.6-175.5 9.4 -20.7 10.4 58 62 A I H > S+ 0 0 84 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.866 124.3 47.9 -75.4 -33.0 7.2 -20.1 7.3 59 63 A I H > S+ 0 0 119 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.920 115.6 42.7 -76.7 -42.7 4.3 -18.8 9.4 60 64 A H H > S+ 0 0 33 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.887 116.1 50.8 -61.7 -42.7 6.5 -16.5 11.5 61 65 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.946 112.4 45.1 -65.9 -43.2 8.3 -15.4 8.3 62 66 A K H X S+ 0 0 31 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.855 113.2 51.9 -68.0 -31.3 5.1 -14.7 6.5 63 67 A R H X S+ 0 0 39 -4,-1.8 4,-2.6 2,-0.2 104,-0.2 0.882 106.1 52.9 -75.9 -34.7 3.7 -12.9 9.5 64 68 A T H X S+ 0 0 4 -4,-2.4 4,-2.3 -10,-0.4 5,-0.2 0.946 111.4 47.5 -60.8 -49.2 6.7 -10.6 9.8 65 69 A Y H X S+ 0 0 12 -4,-1.9 4,-2.9 1,-0.2 5,-0.3 0.933 111.3 51.0 -60.4 -46.8 6.3 -9.7 6.2 66 70 A R H X S+ 0 0 39 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.936 110.6 49.0 -54.7 -48.5 2.5 -9.0 6.7 67 71 A E H X S+ 0 0 18 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.920 113.9 44.3 -64.6 -46.1 3.2 -6.8 9.6 68 72 A L H X S+ 0 0 3 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.911 114.3 48.3 -62.5 -46.7 5.8 -4.7 7.9 69 73 A R H X S+ 0 0 33 -4,-2.9 4,-1.6 1,-0.2 -2,-0.2 0.926 113.5 50.2 -60.2 -40.9 3.8 -4.4 4.7 70 74 A L H X S+ 0 0 8 -4,-2.6 4,-1.0 -5,-0.3 -2,-0.2 0.906 112.3 46.5 -63.3 -36.8 0.8 -3.4 6.8 71 75 A L H < S+ 0 0 9 -4,-2.2 11,-0.8 1,-0.2 3,-0.2 0.854 108.3 53.5 -78.7 -37.3 2.8 -0.8 8.7 72 76 A K H < S+ 0 0 41 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.863 109.4 52.0 -63.4 -33.8 4.5 0.8 5.7 73 77 A H H < S+ 0 0 32 -4,-1.6 2,-0.5 -5,-0.2 234,-0.2 0.802 88.2 91.5 -76.3 -25.1 1.0 1.2 4.1 74 78 A M < + 0 0 5 -4,-1.0 8,-0.5 -3,-0.2 2,-0.3 -0.611 37.7 158.1 -85.6 120.4 -0.8 3.0 7.1 75 79 A K + 0 0 146 -2,-0.5 2,-0.3 6,-0.1 5,-0.1 -0.828 33.4 107.7-140.8 86.8 -0.6 6.9 7.1 76 80 A H > - 0 0 25 3,-0.5 3,-1.4 -2,-0.3 57,-0.0 -0.967 69.1-120.9-167.9 146.3 -3.5 8.2 9.2 77 81 A E T 3 S+ 0 0 106 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.769 109.4 50.2 -83.6 -16.3 -3.6 9.8 12.6 78 82 A N T 3 S+ 0 0 1 83,-0.1 84,-2.6 51,-0.1 2,-0.4 0.226 103.1 68.6 -95.2 14.8 -5.8 7.3 14.2 79 83 A V B < S-f 162 0C 0 -3,-1.4 -3,-0.5 82,-0.3 84,-0.2 -0.999 93.2-106.9-136.9 130.6 -3.8 4.3 13.1 80 84 A I - 0 0 15 82,-2.8 2,-0.3 -2,-0.4 -6,-0.1 -0.221 44.5-159.5 -65.1 143.7 -0.3 3.6 14.5 81 85 A G - 0 0 18 -4,-0.1 2,-0.9 22,-0.1 22,-0.2 -0.850 20.7 -98.7-130.0 164.8 2.4 4.3 11.9 82 86 A L + 0 0 15 -11,-0.8 20,-0.2 -8,-0.5 3,-0.1 -0.663 32.5 167.5 -87.8 104.1 6.0 3.5 11.0 83 87 A L S S- 0 0 32 18,-2.2 2,-0.3 -2,-0.9 19,-0.2 0.924 75.2 -12.4 -72.4 -40.0 8.5 6.1 12.0 84 88 A D E -E 101 0B 24 17,-1.3 17,-2.4 252,-0.1 2,-0.4 -0.997 50.7-163.4-159.2 147.6 11.4 3.7 11.3 85 89 A V E +E 100 0B 6 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.987 26.8 160.6-133.1 133.5 12.3 0.1 10.6 86 90 A F E -E 99 0B 14 13,-1.8 13,-2.0 -2,-0.4 -2,-0.0 -0.969 25.3-158.9-147.3 156.0 15.8 -1.2 10.9 87 91 A T - 0 0 14 -2,-0.3 11,-0.1 11,-0.2 8,-0.1 -0.981 25.4-131.8-125.6 150.9 17.9 -4.3 11.3 88 92 A P S S+ 0 0 20 0, 0.0 2,-0.1 0, 0.0 -84,-0.1 0.728 78.7 101.4 -62.3 -24.7 21.5 -4.6 12.7 89 93 A A - 0 0 18 8,-0.3 -2,-0.2 1,-0.1 6,-0.1 -0.397 58.0-159.5 -78.2 140.0 22.6 -6.7 9.7 90 94 A R S S+ 0 0 184 -2,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.668 77.9 37.0 -90.6 -16.7 24.5 -5.2 6.9 91 95 A S S > S- 0 0 34 1,-0.1 4,-0.8 0, 0.0 3,-0.4 -0.940 79.2-118.0-132.1 159.5 23.5 -8.1 4.5 92 96 A L T >4 S+ 0 0 58 -2,-0.3 3,-0.7 1,-0.2 -1,-0.1 0.861 114.0 62.9 -48.8 -43.8 20.5 -10.4 3.7 93 97 A E T 34 S+ 0 0 147 1,-0.2 -1,-0.2 -3,-0.0 -4,-0.0 0.900 110.1 35.3 -51.2 -48.5 22.9 -13.2 4.7 94 98 A E T 34 S+ 0 0 156 -3,-0.4 2,-0.5 2,-0.0 -1,-0.2 0.518 90.2 126.3 -90.4 -2.3 23.2 -12.0 8.3 95 99 A F << + 0 0 2 -4,-0.8 3,-0.1 -3,-0.7 233,-0.1 -0.425 16.2 123.7 -66.4 106.6 19.5 -10.8 8.4 96 100 A N + 0 0 81 -2,-0.5 2,-0.4 1,-0.2 -41,-0.3 0.458 54.6 64.4-137.2 -10.7 17.7 -12.2 11.4 97 101 A D - 0 0 50 -43,-0.1 2,-0.4 -44,-0.1 -8,-0.3 -0.954 53.1-169.0-127.7 140.4 16.3 -9.4 13.5 98 102 A V - 0 0 3 -2,-0.4 -47,-2.5 -47,-0.2 2,-0.4 -0.991 1.4-171.7-127.6 136.6 13.7 -6.7 12.8 99 103 A Y E -DE 50 86B 2 -13,-2.0 -13,-1.8 -2,-0.4 2,-0.3 -0.981 4.3-162.3-128.5 143.1 12.7 -3.7 14.8 100 104 A L E -DE 49 85B 10 -51,-2.1 -51,-2.6 -2,-0.4 2,-0.4 -0.893 4.6-160.5-125.0 148.1 9.9 -1.3 14.2 101 105 A V E +DE 48 84B 2 -17,-2.4 -18,-2.2 -2,-0.3 -17,-1.3 -0.988 18.1 154.7-134.6 136.4 9.5 2.3 15.6 102 106 A T E -D 47 0B 21 -55,-2.0 -55,-3.6 -2,-0.4 -20,-0.1 -0.912 52.7 -65.6-147.0 173.5 6.4 4.5 16.1 103 107 A H E -D 46 0B 71 -2,-0.3 2,-0.4 -22,-0.2 -57,-0.3 -0.256 57.7-108.0 -64.1 146.5 5.4 7.4 18.4 104 108 A L - 0 0 46 -59,-1.6 2,-0.4 -67,-0.1 -59,-0.1 -0.637 31.1-160.6 -78.3 130.8 5.1 6.5 22.0 105 109 A M - 0 0 26 -2,-0.4 50,-0.2 1,-0.1 3,-0.1 -0.864 11.8-142.2-107.0 147.4 1.5 6.3 23.4 106 110 A G + 0 0 69 -2,-0.4 2,-0.3 48,-0.2 49,-0.2 0.664 68.4 2.5 -89.1 -20.3 0.9 6.6 27.1 107 111 A A E -G 154 0C 46 47,-1.4 47,-3.0 3,-0.0 2,-0.3 -0.992 57.1-127.6-159.8 160.8 -2.0 4.2 27.8 108 112 A D E > -G 153 0C 44 -2,-0.3 3,-1.1 45,-0.3 45,-0.2 -0.761 33.2-113.6-110.0 161.5 -4.4 1.7 26.4 109 113 A L G > S+ 0 0 5 43,-2.1 3,-1.2 40,-1.6 41,-0.2 0.686 101.7 83.3 -68.7 -16.9 -8.2 1.8 26.8 110 114 A N G 3 S+ 0 0 89 39,-0.6 -1,-0.2 1,-0.3 40,-0.1 0.550 80.4 67.7 -69.8 1.0 -8.3 -1.4 28.9 111 115 A N G X + 0 0 92 -3,-1.1 2,-1.8 38,-0.2 3,-0.7 0.168 59.7 125.1-100.9 16.4 -7.4 0.7 32.0 112 116 A I T < + 0 0 33 -3,-1.2 3,-0.3 1,-0.2 -1,-0.1 -0.163 19.5 123.8 -83.6 47.5 -10.7 2.7 32.3 113 117 A V T 3 S- 0 0 143 -2,-1.8 2,-0.3 1,-0.3 -1,-0.2 0.912 101.2 -2.5 -63.9 -44.0 -11.6 1.8 35.9 114 118 A K < 0 0 77 -3,-0.7 -1,-0.3 4,-0.0 4,-0.1 -0.834 360.0 360.0-148.5 112.3 -11.6 5.6 36.3 115 119 A C 0 0 99 2,-0.7 -3,-0.2 -3,-0.3 -4,-0.1 0.334 360.0 360.0 55.0 360.0 -10.6 7.8 33.3 116 ! 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 0.0 117 121 A K 0 0 138 0, 0.0 -2,-0.7 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 153.0 -15.8 4.9 34.0 118 122 A L - 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0 0 33 -2,-0.3 -9,-0.1 1,-0.2 -10,-0.0 -0.538 27.3-147.7 -74.3 124.9 -17.9 -5.8 29.6 208 222 A L S S+ 0 0 39 -11,-0.5 -1,-0.2 -2,-0.4 -34,-0.1 0.871 92.9 26.6 -59.7 -37.2 -21.2 -6.1 27.8 209 223 A F + 0 0 4 -36,-0.3 2,-1.8 -12,-0.1 -1,-0.3 -0.668 67.4 171.7-131.0 73.2 -20.5 -9.7 27.0 210 224 A P + 0 0 67 0, 0.0 -37,-0.0 0, 0.0 7,-0.0 -0.392 21.7 173.0 -85.2 66.4 -18.2 -11.4 29.6 211 225 A G - 0 0 2 -2,-1.8 -38,-0.1 1,-0.1 3,-0.1 -0.190 35.6-143.9 -73.2 161.7 -18.5 -15.0 28.4 212 226 A T S S- 0 0 88 1,-0.2 2,-0.3 -40,-0.1 -1,-0.1 0.485 79.7 -10.6-100.1 -9.7 -16.5 -18.1 29.7 213 227 A D S > S- 0 0 76 -44,-0.0 4,-3.0 -41,-0.0 5,-0.3 -0.970 87.4 -74.9-171.0 175.1 -16.3 -19.8 26.3 214 228 A H T 4 S+ 0 0 83 -2,-0.3 4,-0.3 1,-0.2 -3,-0.0 0.532 128.6 47.3 -61.0 -11.3 -17.6 -19.7 22.7 215 229 A I T > S+ 0 0 83 2,-0.1 4,-1.8 3,-0.1 -1,-0.2 0.826 115.8 41.9 -91.0 -45.8 -20.9 -21.2 23.9 216 230 A D H > S+ 0 0 35 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.881 111.7 55.5 -71.0 -39.6 -21.5 -18.9 26.9 217 231 A Q H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.934 108.5 49.5 -56.9 -46.6 -20.4 -15.9 24.9 218 232 A L H > S+ 0 0 8 -4,-0.3 4,-2.2 -5,-0.3 -1,-0.2 0.889 109.5 51.2 -61.9 -40.3 -23.0 -16.7 22.3 219 233 A K H X S+ 0 0 109 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.937 107.9 52.1 -65.4 -41.0 -25.6 -17.0 25.0 220 234 A L H X S+ 0 0 28 -4,-2.9 4,-0.7 1,-0.2 3,-0.2 0.948 111.5 48.4 -60.6 -43.4 -24.7 -13.7 26.4 221 235 A I H >X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 3,-0.9 0.869 108.7 49.9 -63.0 -44.7 -25.0 -12.1 23.0 222 236 A L H 3X S+ 0 0 10 -4,-2.2 4,-1.6 1,-0.3 -1,-0.2 0.821 99.8 66.1 -75.5 -23.9 -28.4 -13.6 22.1 223 237 A R H 3< S+ 0 0 128 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 0.820 113.5 32.9 -64.4 -23.5 -29.9 -12.5 25.4 224 238 A L H << S+ 0 0 11 -3,-0.9 30,-2.0 -4,-0.7 -2,-0.2 0.887 133.3 25.4 -96.3 -45.4 -29.4 -8.9 24.2 225 239 A V H < S- 0 0 18 -4,-2.4 28,-0.2 28,-0.2 -3,-0.2 0.625 107.0-131.5 -95.1 -13.0 -29.9 -9.0 20.4 226 240 A G < - 0 0 2 -4,-1.6 -3,-0.2 -5,-0.5 -1,-0.1 0.104 33.7 -48.2 82.0 159.4 -32.0 -12.0 20.4 227 241 A T S S- 0 0 27 24,-1.3 26,-0.1 -5,-0.1 50,-0.1 -0.255 71.0 -92.9 -56.1 146.8 -32.0 -15.3 18.4 228 242 A P - 0 0 27 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.356 40.8-136.5 -63.2 145.0 -31.7 -14.9 14.7 229 243 A G >> - 0 0 39 -3,-0.1 4,-2.7 1,-0.0 3,-1.1 -0.382 38.3 -82.3 -92.4 177.0 -35.0 -14.8 12.8 230 244 A A H 3> S+ 0 0 69 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.814 127.2 62.9 -53.0 -27.2 -35.8 -16.6 9.5 231 245 A E H 34 S+ 0 0 86 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.889 110.9 35.0 -69.0 -35.1 -34.0 -13.7 7.6 232 246 A L H X4 S+ 0 0 21 -3,-1.1 3,-1.0 2,-0.2 4,-0.4 0.846 115.2 55.4 -87.9 -34.0 -30.6 -14.5 9.2 233 247 A L H >< S+ 0 0 34 -4,-2.7 3,-1.7 1,-0.3 -2,-0.2 0.937 100.2 64.2 -59.1 -42.0 -31.2 -18.2 9.3 234 248 A K T 3< S+ 0 0 165 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.797 104.5 45.0 -43.8 -38.4 -31.8 -17.8 5.6 235 249 A K T < S+ 0 0 100 -3,-1.0 2,-0.9 -4,-0.4 -1,-0.3 0.347 81.1 108.3 -99.2 2.4 -28.2 -16.8 5.2 236 250 A I < - 0 0 22 -3,-1.7 6,-0.1 -4,-0.4 -53,-0.0 -0.715 39.5-178.4 -83.7 102.4 -26.3 -19.4 7.3 237 251 A S + 0 0 97 -2,-0.9 2,-0.2 4,-0.0 -1,-0.2 0.924 59.5 88.9 -64.2 -44.1 -24.4 -21.8 4.9 238 252 A S > - 0 0 23 -56,-0.1 4,-1.3 1,-0.1 5,-0.1 -0.349 63.3-157.8 -64.1 126.8 -23.0 -23.9 7.8 239 253 A E H > S+ 0 0 140 2,-0.2 4,-2.2 -2,-0.2 5,-0.1 0.849 90.1 50.1 -73.5 -43.6 -25.3 -26.8 8.9 240 254 A S H > S+ 0 0 89 2,-0.2 4,-3.5 1,-0.2 5,-0.2 0.947 109.2 54.0 -68.1 -44.6 -24.0 -27.3 12.5 241 255 A A H > S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.915 110.8 46.1 -44.2 -49.6 -24.3 -23.6 13.1 242 256 A R H X S+ 0 0 79 -4,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.862 112.3 51.0 -71.9 -34.1 -28.0 -23.9 12.0 243 257 A N H X S+ 0 0 113 -4,-2.2 4,-1.1 2,-0.2 -2,-0.2 0.974 112.3 46.3 -65.0 -51.9 -28.6 -26.9 14.1 244 258 A Y H >< S+ 0 0 73 -4,-3.5 3,-0.9 1,-0.2 4,-0.2 0.945 115.3 43.9 -55.2 -55.1 -27.1 -25.3 17.2 245 259 A I H >< S+ 0 0 21 -4,-2.4 3,-0.8 1,-0.3 -1,-0.2 0.802 113.4 48.7 -66.9 -34.7 -29.0 -22.0 16.9 246 260 A Q H 3< S+ 0 0 124 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.649 104.0 63.0 -77.9 -15.1 -32.4 -23.4 16.0 247 261 A S T << S+ 0 0 89 -4,-1.1 2,-0.3 -3,-0.9 -1,-0.2 0.446 88.3 94.9 -86.5 -2.0 -32.2 -25.9 18.9 248 262 A L S < S- 0 0 44 -3,-0.8 2,-0.2 -4,-0.2 3,-0.1 -0.673 90.5 -96.7 -94.2 144.6 -32.1 -23.0 21.4 249 263 A A - 0 0 93 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.1 -0.426 53.4-104.3 -48.3 119.4 -35.0 -21.6 23.3 250 264 A Q - 0 0 160 -2,-0.2 -1,-0.1 -4,-0.1 -4,-0.0 -0.215 39.5-160.9 -45.1 138.8 -36.1 -18.5 21.3 251 265 A M - 0 0 74 -3,-0.1 -24,-1.3 -23,-0.1 2,-0.2 -0.992 14.2-119.7-131.2 135.8 -34.9 -15.2 23.0 252 266 A P - 0 0 76 0, 0.0 2,-0.3 0, 0.0 -26,-0.3 -0.572 25.6-107.9 -78.4 141.0 -36.4 -11.7 22.3 253 267 A K - 0 0 116 -2,-0.2 -28,-0.2 -28,-0.2 -29,-0.1 -0.518 45.8-135.4 -53.0 116.8 -34.5 -8.7 21.0 254 268 A M - 0 0 79 -30,-2.0 2,-0.5 -2,-0.3 3,-0.1 -0.350 15.7-100.6 -78.2 160.7 -34.3 -6.4 24.0 255 269 A N > - 0 0 93 1,-0.2 4,-0.6 -2,-0.1 -1,-0.1 -0.738 26.8-161.8 -73.0 122.8 -34.8 -2.7 24.3 256 270 A F H >> S+ 0 0 0 -2,-0.5 4,-3.3 2,-0.2 3,-1.0 0.906 89.0 66.2 -73.8 -43.4 -31.4 -1.1 24.2 257 271 A A H 34 S+ 0 0 45 1,-0.3 5,-0.3 2,-0.2 6,-0.2 0.856 108.7 41.7 -39.9 -42.0 -32.9 2.2 25.7 258 272 A N H 34 S+ 0 0 110 1,-0.1 3,-0.5 3,-0.1 -1,-0.3 0.660 112.5 51.8 -84.2 -19.8 -33.5 0.0 28.8 259 273 A V H << S+ 0 0 51 -3,-1.0 2,-0.7 -4,-0.6 -2,-0.2 0.895 117.1 38.5 -79.6 -39.8 -30.2 -1.9 28.8 260 274 A F S >< S- 0 0 10 -4,-3.3 3,-2.0 3,-0.1 -1,-0.2 -0.408 91.6-174.7-102.7 60.0 -28.1 1.3 28.6 261 275 A I T 3 + 0 0 131 -2,-0.7 -3,-0.1 -3,-0.5 3,-0.1 -0.366 64.4 11.3 -72.1 126.0 -30.4 3.2 30.9 262 276 A G T 3 S+ 0 0 80 1,-0.3 -1,-0.3 -5,-0.3 2,-0.1 0.299 94.6 131.1 92.3 -4.3 -29.5 6.9 31.3 263 277 A A S < S- 0 0 27 -3,-2.0 -1,-0.3 -6,-0.2 5,-0.1 -0.455 79.2 -78.2 -70.5 147.4 -27.0 6.9 28.5 264 278 A N >> - 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