==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 02-APR-12 4EH7 . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.OVER,C.GRUETTER,H.WALDMANN,D.RAUH . 337 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16971.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 210 62.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 21 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 12.2 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 . 2 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 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 . 1 1 2 0 2 1 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 4 A E 0 0 157 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 149.7 24.9 4.6 4.8 2 5 A R - 0 0 96 1,-0.1 3,-0.1 88,-0.0 88,-0.0 -0.583 360.0-114.3 -74.8 147.4 23.2 2.8 7.7 3 6 A P - 0 0 77 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.053 38.4 -69.0 -81.1-171.3 23.7 4.7 11.0 4 7 A T - 0 0 108 1,-0.0 15,-3.0 14,-0.0 16,-0.3 -0.672 49.0-161.1 -86.2 126.5 25.6 3.7 14.2 5 8 A F E -A 18 0A 29 -2,-0.5 2,-0.3 13,-0.3 11,-0.1 -0.590 4.0-160.4 -96.8 160.9 24.1 0.9 16.2 6 9 A Y E -A 17 0A 58 11,-2.5 11,-1.5 -2,-0.2 2,-0.2 -0.990 10.7-138.2-139.2 144.8 24.7 0.0 19.8 7 10 A R E +A 16 0A 157 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.537 29.1 150.1 -92.4 160.8 24.0 -3.2 21.7 8 11 A Q E -A 15 0A 61 7,-0.7 7,-2.4 -2,-0.2 2,-0.5 -0.949 38.0-110.5-169.1 177.1 22.5 -3.9 25.1 9 12 A E E -A 14 0A 139 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.976 22.9-175.2-125.7 126.9 20.5 -6.4 27.1 10 13 A L E > -A 13 0A 20 3,-3.1 3,-2.5 -2,-0.5 2,-0.1 -0.970 62.6 -49.6-124.2 119.8 17.0 -5.9 28.3 11 14 A N T 3 S- 0 0 118 -2,-0.5 0, 0.0 1,-0.3 0, 0.0 -0.381 123.4 -20.2 50.1-124.6 15.4 -8.6 30.5 12 15 A K T 3 S+ 0 0 199 -2,-0.1 2,-0.4 -3,-0.1 -1,-0.3 0.377 124.7 81.5 -90.7 5.4 16.0 -11.9 28.6 13 16 A T E < -A 10 0A 37 -3,-2.5 -3,-3.1 2,-0.0 2,-0.2 -0.907 69.1-131.7-125.3 138.7 16.6 -10.3 25.2 14 17 A I E -A 9 0A 67 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.518 23.8-159.1 -73.6 148.2 19.5 -8.6 23.3 15 18 A W E -A 8 0A 2 -7,-2.4 -7,-0.7 -2,-0.2 2,-0.6 -0.968 13.5-175.8-137.6 119.4 18.7 -5.3 21.6 16 19 A E E +A 7 0A 47 -2,-0.4 -9,-0.2 -9,-0.2 83,-0.0 -0.848 25.4 155.3-118.7 97.2 20.7 -3.7 18.7 17 20 A V E -A 6 0A 0 -11,-1.5 -11,-2.5 -2,-0.6 -2,-0.1 -0.780 46.6 -88.5-121.6 154.9 19.3 -0.3 17.9 18 21 A P E > -A 5 0A 6 0, 0.0 3,-2.2 0, 0.0 -13,-0.3 -0.299 36.6-116.5 -58.9 150.9 20.6 2.9 16.3 19 22 A E T 3 S+ 0 0 43 -15,-3.0 21,-0.2 1,-0.3 -14,-0.1 0.806 110.6 79.6 -58.9 -31.2 22.2 5.5 18.6 20 23 A R T 3 S+ 0 0 54 -16,-0.3 20,-2.8 19,-0.1 2,-0.5 0.731 86.3 65.8 -44.4 -29.3 19.3 7.7 17.5 21 24 A Y E < S+B 39 0B 0 -3,-2.2 2,-0.3 18,-0.2 18,-0.2 -0.898 72.3 176.6-105.8 128.5 17.2 5.8 20.1 22 25 A Q E +B 38 0B 68 16,-3.0 16,-3.2 -2,-0.5 -2,-0.0 -0.837 47.7 27.9-129.9 159.9 18.1 6.2 23.7 23 26 A N E S- 0 0 105 -2,-0.3 -1,-0.2 14,-0.2 13,-0.1 0.854 70.1-162.5 59.7 40.8 17.0 5.2 27.2 24 27 A L E + 0 0 14 -3,-0.2 13,-0.2 13,-0.1 -1,-0.2 -0.323 12.8 177.8 -57.2 131.5 15.4 2.0 26.2 25 28 A S E -B 36 0B 61 11,-2.3 11,-2.8 -15,-0.1 -15,-0.0 -0.940 31.1-115.1-145.8 112.6 13.0 0.8 28.9 26 29 A P E +B 35 0B 47 0, 0.0 9,-0.3 0, 0.0 3,-0.1 -0.129 34.4 170.5 -47.4 138.6 10.9 -2.4 28.6 27 30 A V E - 0 0 88 7,-2.7 2,-0.2 1,-0.3 8,-0.2 0.549 63.3 -19.4-123.8 -18.9 7.1 -1.7 28.6 28 31 A G E B 34 0B 43 6,-1.1 6,-2.1 0, 0.0 -1,-0.3 -0.704 360.0 360.0 169.4 134.3 5.5 -5.1 27.7 29 32 A S 0 0 122 4,-0.2 4,-0.3 -2,-0.2 137,-0.0 -0.879 360.0 360.0-114.7 360.0 6.5 -8.4 26.1 30 ! 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 31 35 A Y 0 0 101 0, 0.0 21,-1.8 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 -27.5 5.1 -11.7 18.8 32 36 A G E - C 0 51B 16 19,-0.3 2,-0.3 2,-0.0 19,-0.2 -0.721 360.0 -91.1 153.5 163.5 7.9 -9.6 20.4 33 37 A S E - C 0 50B 15 17,-0.9 17,-2.8 -4,-0.3 2,-0.4 -0.707 32.5-144.6 -98.7 155.8 8.8 -7.3 23.3 34 38 A V E -BC 28 49B 35 -6,-2.1 -7,-2.7 -2,-0.3 -6,-1.1 -0.951 8.8-164.6-121.4 135.8 8.5 -3.5 23.2 35 39 A C E -BC 26 48B 1 13,-2.9 13,-3.0 -2,-0.4 2,-0.3 -0.955 20.9-130.2-112.5 142.2 10.7 -0.8 24.8 36 40 A A E +BC 25 47B 2 -11,-2.8 -11,-2.3 -2,-0.4 2,-0.3 -0.641 40.5 173.7 -71.1 141.3 9.9 2.9 25.4 37 41 A A E - C 0 46B 0 9,-2.3 9,-2.7 -2,-0.3 2,-0.5 -0.951 34.0-118.1-145.3 164.3 12.8 4.9 24.0 38 42 A F E -BC 22 45B 70 -16,-3.2 -16,-3.0 -2,-0.3 2,-0.8 -0.929 24.1-143.7-105.5 132.9 13.7 8.5 23.4 39 43 A D E >>> -BC 21 44B 1 5,-2.9 4,-2.6 -2,-0.5 3,-0.9 -0.848 9.7-166.2-104.8 106.2 14.2 9.4 19.8 40 44 A T T 345S+ 0 0 76 -20,-2.8 -1,-0.2 -2,-0.8 -19,-0.1 0.739 82.3 61.1 -63.8 -27.0 17.0 11.9 19.6 41 45 A K T 345S+ 0 0 153 -21,-0.4 -1,-0.3 1,-0.2 -20,-0.1 0.797 122.8 16.6 -76.3 -29.7 16.3 12.8 16.0 42 46 A T T <45S- 0 0 60 -3,-0.9 -2,-0.2 2,-0.2 -1,-0.2 0.528 96.9-123.2-118.2 -14.3 12.8 14.1 16.5 43 47 A G T <5 + 0 0 43 -4,-2.6 2,-0.2 1,-0.3 -3,-0.2 0.559 68.8 124.9 80.1 9.5 12.7 14.6 20.3 44 48 A L E < -C 39 0B 71 -5,-0.6 -5,-2.9 -6,-0.0 2,-0.3 -0.637 65.8-114.7 -98.8 157.4 9.7 12.3 20.8 45 49 A R E -C 38 0B 119 -7,-0.2 59,-1.4 -2,-0.2 2,-0.3 -0.729 44.4-175.7 -79.5 140.1 9.2 9.3 23.0 46 50 A V E -CD 37 103B 0 -9,-2.7 -9,-2.3 -2,-0.3 2,-0.5 -0.903 27.6-120.7-135.0 161.1 8.7 6.2 20.8 47 51 A A E -CD 36 102B 14 55,-4.0 55,-2.6 -2,-0.3 2,-0.5 -0.928 22.8-163.9-102.4 131.5 7.9 2.5 21.1 48 52 A V E -CD 35 101B 0 -13,-3.0 -13,-2.9 -2,-0.5 2,-0.5 -0.972 5.7-163.2-117.5 118.5 10.5 0.1 19.7 49 53 A K E -CD 34 100B 27 51,-2.9 51,-2.6 -2,-0.5 2,-0.6 -0.912 7.0-156.0-105.8 124.6 9.3 -3.4 19.1 50 54 A K E -CD 33 99B 25 -17,-2.8 -17,-0.9 -2,-0.5 2,-0.2 -0.896 23.0-130.4 -93.1 120.3 11.7 -6.3 18.6 51 55 A L E -C 32 0B 7 47,-2.8 2,-0.6 -2,-0.6 47,-0.3 -0.533 18.5-124.8 -71.4 136.8 10.0 -9.1 16.7 52 56 A S S S- 0 0 58 -21,-1.8 4,-0.2 1,-0.2 -1,-0.1 -0.767 79.7 -29.7 -84.9 115.0 10.5 -12.5 18.3 53 57 A R S > S- 0 0 162 -2,-0.6 3,-1.9 1,-0.1 -1,-0.2 0.903 72.7-170.9 39.8 64.5 12.0 -15.0 15.8 54 58 A P T 3 S+ 0 0 1 0, 0.0 10,-0.5 0, 0.0 11,-0.2 0.711 82.6 38.1 -56.9 -20.6 10.4 -13.2 12.8 55 59 A F T 3 S+ 0 0 23 41,-0.3 -2,-0.1 1,-0.1 6,-0.1 -0.117 73.8 124.9-127.6 33.6 11.5 -16.1 10.6 56 60 A Q S < S- 0 0 111 -3,-1.9 2,-0.2 -4,-0.2 -1,-0.1 0.833 85.7 -13.5 -60.9 -41.1 10.9 -19.1 12.9 57 61 A S S > S- 0 0 42 -4,-0.2 4,-2.6 -3,-0.2 5,-0.2 -0.837 81.2 -85.7-147.7-178.6 8.7 -20.8 10.3 58 62 A I H > S+ 0 0 73 -2,-0.2 4,-2.7 2,-0.2 5,-0.2 0.897 129.2 51.4 -59.8 -40.1 6.8 -20.1 7.1 59 63 A I H > S+ 0 0 94 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.890 112.9 43.2 -68.7 -44.2 3.9 -18.9 9.3 60 64 A H H > S+ 0 0 47 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.890 113.9 52.0 -60.5 -46.7 6.2 -16.5 11.3 61 65 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.923 113.3 43.2 -60.7 -46.2 7.9 -15.3 8.2 62 66 A K H X S+ 0 0 28 -4,-2.7 4,-2.9 2,-0.2 -1,-0.2 0.872 112.8 52.9 -67.2 -39.8 4.6 -14.5 6.5 63 67 A R H X S+ 0 0 111 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.895 109.2 50.0 -59.9 -41.5 3.3 -12.9 9.7 64 68 A T H X S+ 0 0 7 -4,-2.6 4,-2.5 -10,-0.5 -2,-0.2 0.950 112.5 46.6 -63.2 -51.2 6.4 -10.7 9.9 65 69 A Y H X S+ 0 0 14 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.910 112.6 51.5 -53.5 -50.1 6.0 -9.7 6.2 66 70 A R H X S+ 0 0 68 -4,-2.9 4,-2.8 2,-0.2 -2,-0.2 0.896 110.3 46.5 -54.6 -51.7 2.2 -9.0 6.8 67 71 A E H X S+ 0 0 30 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.929 114.1 48.3 -62.5 -46.1 2.8 -6.8 9.9 68 72 A L H X S+ 0 0 1 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.955 113.0 47.5 -58.1 -51.4 5.5 -4.8 8.1 69 73 A R H X S+ 0 0 32 -4,-2.9 4,-1.2 1,-0.2 -2,-0.2 0.923 115.0 46.8 -55.4 -46.6 3.4 -4.3 5.0 70 74 A L H >X S+ 0 0 37 -4,-2.8 4,-1.6 2,-0.2 3,-0.7 0.964 113.5 46.5 -60.1 -53.4 0.4 -3.3 7.1 71 75 A L H 3< S+ 0 0 10 -4,-2.8 11,-1.0 1,-0.3 -2,-0.2 0.862 110.5 53.4 -61.8 -36.7 2.3 -0.8 9.3 72 76 A K H 3< S+ 0 0 33 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.797 110.1 48.8 -66.7 -28.1 4.1 0.7 6.3 73 77 A H H << S+ 0 0 31 -4,-1.2 2,-0.5 -3,-0.7 233,-0.2 0.818 86.9 96.7 -81.9 -30.5 0.7 1.4 4.7 74 78 A M < + 0 0 15 -4,-1.6 8,-0.4 6,-0.1 2,-0.3 -0.475 38.3 159.0 -71.8 115.1 -1.1 3.0 7.6 75 79 A K + 0 0 137 -2,-0.5 2,-0.3 6,-0.1 5,-0.1 -0.708 31.8 108.0-135.9 84.1 -0.9 6.8 7.4 76 80 A H B > S-F 79 0C 16 3,-0.5 3,-2.1 -2,-0.3 57,-0.0 -0.966 71.9-116.7-163.1 141.5 -3.7 8.2 9.5 77 81 A E T 3 S+ 0 0 115 -2,-0.3 4,-0.1 1,-0.3 56,-0.1 0.682 113.7 43.2 -54.3 -30.9 -4.0 10.0 12.8 78 82 A N T 3 S+ 0 0 6 83,-0.1 84,-2.6 54,-0.1 2,-0.4 0.181 102.8 74.4-108.8 18.6 -6.0 7.3 14.4 79 83 A V B < S-Fg 76 162C 7 -3,-2.1 -3,-0.5 82,-0.3 84,-0.2 -0.996 88.7-107.5-128.6 134.2 -4.0 4.3 13.2 80 84 A I - 0 0 22 82,-3.1 2,-0.3 -2,-0.4 -6,-0.1 -0.359 45.9-170.6 -56.9 129.8 -0.7 3.2 14.5 81 85 A G - 0 0 17 -4,-0.1 2,-0.8 -2,-0.1 22,-0.3 -0.768 26.8 -94.0-122.6 170.4 1.9 4.0 11.8 82 86 A L + 0 0 12 -11,-1.0 20,-0.2 -8,-0.4 3,-0.1 -0.751 30.7 173.8 -92.0 109.8 5.6 3.3 11.2 83 87 A L S S- 0 0 23 18,-2.5 2,-0.3 -2,-0.8 19,-0.2 0.901 76.0 -18.9 -68.5 -41.6 8.1 5.9 12.4 84 88 A D E -E 101 0B 20 17,-1.6 17,-3.6 251,-0.1 2,-0.3 -0.990 50.6-160.9-162.2 155.6 10.9 3.6 11.5 85 89 A V E +E 100 0B 6 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.984 26.3 161.6-143.4 136.4 11.9 0.0 10.8 86 90 A F E -E 99 0B 15 13,-1.9 13,-2.0 -2,-0.3 3,-0.1 -0.984 25.7-156.8-151.9 154.8 15.4 -1.2 11.0 87 91 A T - 0 0 14 -2,-0.3 11,-0.1 2,-0.2 8,-0.1 -0.984 22.9-137.7-126.9 147.4 17.6 -4.3 11.2 88 92 A P S S+ 0 0 16 0, 0.0 -1,-0.1 0, 0.0 -83,-0.1 0.831 76.4 109.2 -62.4 -31.7 21.2 -4.4 12.6 89 93 A A - 0 0 16 8,-0.2 -2,-0.2 5,-0.1 6,-0.1 -0.062 56.8-160.0 -51.5 142.7 21.9 -6.8 9.6 90 94 A R S S+ 0 0 168 1,-0.1 2,-0.3 -88,-0.0 -1,-0.1 0.642 72.8 21.4-100.2 -20.5 24.1 -5.4 6.8 91 95 A S S >> S- 0 0 42 1,-0.1 4,-0.9 0, 0.0 3,-0.5 -0.926 81.6-105.6-142.1 163.5 23.0 -7.9 4.1 92 96 A L G >4 S+ 0 0 71 -2,-0.3 3,-0.9 1,-0.2 -1,-0.1 0.907 115.0 64.5 -55.3 -44.9 20.1 -10.3 3.3 93 97 A E G 34 S+ 0 0 191 1,-0.3 -1,-0.2 -3,-0.0 -4,-0.0 0.832 113.7 31.4 -47.6 -41.8 22.4 -13.3 4.2 94 98 A E G <4 S+ 0 0 102 -3,-0.5 2,-0.6 3,-0.0 -1,-0.3 0.435 84.8 128.4-102.0 -1.8 22.6 -12.1 7.9 95 99 A F << + 0 0 0 -3,-0.9 3,-0.1 -4,-0.9 232,-0.1 -0.390 21.7 134.9 -52.8 104.2 19.1 -10.4 8.0 96 100 A N + 0 0 86 -2,-0.6 2,-0.4 1,-0.2 -41,-0.3 0.571 50.2 54.0-132.0 -18.1 17.7 -12.1 11.1 97 101 A D - 0 0 45 -3,-0.2 2,-0.4 -44,-0.1 -8,-0.2 -0.947 53.3-164.2-129.4 146.3 16.0 -9.4 13.3 98 102 A V - 0 0 0 -2,-0.4 -47,-2.8 -47,-0.3 2,-0.4 -0.994 3.2-170.5-131.4 134.4 13.4 -6.7 12.7 99 103 A Y E -DE 50 86B 2 -13,-2.0 -13,-1.9 -2,-0.4 2,-0.4 -0.980 8.0-156.5-123.7 136.1 12.6 -3.8 14.9 100 104 A L E -DE 49 85B 8 -51,-2.6 -51,-2.9 -2,-0.4 2,-0.5 -0.922 4.3-155.6-115.5 137.5 9.6 -1.6 14.4 101 105 A V E +DE 48 84B 0 -17,-3.6 -18,-2.5 -2,-0.4 -17,-1.6 -0.954 23.6 151.1-117.9 128.7 9.4 2.0 15.6 102 106 A T E -D 47 0B 18 -55,-2.6 -55,-4.0 -2,-0.5 -20,-0.1 -0.919 50.4 -68.3-143.3 168.8 6.2 3.9 16.4 103 107 A H E -D 46 0B 72 -22,-0.3 2,-0.5 -2,-0.3 -57,-0.2 -0.262 45.9-126.8 -54.9 138.8 4.8 6.7 18.6 104 108 A L - 0 0 51 -59,-1.4 2,-0.3 -67,-0.1 -59,-0.2 -0.817 29.0-163.8 -85.1 129.6 4.7 5.8 22.2 105 109 A M - 0 0 28 -2,-0.5 50,-0.2 1,-0.2 49,-0.1 -0.878 22.8-116.2-114.0 150.5 1.2 6.5 23.5 106 110 A G S S- 0 0 62 -2,-0.3 49,-0.3 47,-0.1 -1,-0.2 0.938 76.3 -21.2 -44.0 -88.7 0.3 6.8 27.2 107 111 A A E -H 154 0C 33 47,-2.3 47,-3.1 1,-0.0 2,-0.3 -0.408 60.7-110.0-115.8-177.2 -2.1 4.0 28.0 108 112 A D E > -H 153 0C 34 45,-0.3 4,-4.2 -2,-0.1 5,-0.4 -0.729 50.0 -87.3-110.0 175.0 -4.4 1.5 26.3 109 113 A L H > S+ 0 0 3 40,-1.8 4,-0.7 43,-1.2 41,-0.2 0.683 125.2 46.5 -69.5 -25.7 -8.2 1.7 26.7 110 114 A N H 4 S+ 0 0 52 2,-0.2 -1,-0.2 42,-0.1 40,-0.1 0.928 122.2 40.4 -70.3 -43.4 -8.7 -0.3 29.9 111 115 A N H >4 S+ 0 0 103 1,-0.2 3,-1.0 2,-0.1 -2,-0.2 0.914 118.7 44.9 -64.8 -47.8 -5.8 1.6 31.4 112 116 A I H 3< S+ 0 0 39 -4,-4.2 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-2,-0.2 0.882 112.7 31.6 -52.3 -42.2 -29.4 -12.8 25.4 223 238 A L H << S+ 0 0 8 -4,-1.2 30,-2.5 -3,-0.7 -2,-0.2 0.871 130.6 31.8 -83.2 -42.3 -29.0 -9.1 24.5 224 239 A V H < S- 0 0 13 -4,-2.4 28,-0.3 28,-0.2 52,-0.2 0.563 108.4-117.9 -99.5 -10.1 -29.6 -9.0 20.8 225 240 A G < - 0 0 2 -4,-2.6 -1,-0.2 26,-0.4 -2,-0.1 0.031 36.7 -63.8 89.6 157.5 -32.1 -11.9 20.5 226 241 A T S S- 0 0 18 24,-1.9 26,-0.1 1,-0.1 19,-0.0 -0.498 74.0 -78.9 -72.6 147.5 -31.9 -15.2 18.7 227 242 A P - 0 0 11 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.178 46.2-132.0 -53.4 136.1 -31.6 -14.9 14.9 228 243 A G > - 0 0 47 -3,-0.1 4,-2.4 1,-0.1 3,-0.2 -0.120 33.9 -92.9 -69.6 179.0 -34.9 -14.2 13.0 229 244 A A H > S+ 0 0 83 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.803 125.9 61.1 -64.9 -30.4 -36.0 -16.2 9.9 230 245 A E H 4 S+ 0 0 111 1,-0.2 -1,-0.2 2,-0.2 4,-0.0 0.893 112.0 36.1 -63.6 -39.7 -34.3 -13.5 7.8 231 246 A L H >4 S+ 0 0 32 -3,-0.2 3,-1.8 1,-0.2 -2,-0.2 0.873 112.2 58.2 -80.1 -42.1 -30.9 -14.3 9.3 232 247 A L H >< S+ 0 0 21 -4,-2.4 3,-1.4 1,-0.3 -2,-0.2 0.806 98.8 60.0 -59.2 -33.9 -31.3 -18.0 9.7 233 248 A K T 3< S+ 0 0 176 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.499 100.6 56.3 -79.5 -3.2 -31.9 -18.4 6.0 234 249 A K T < S+ 0 0 78 -3,-1.8 2,-0.7 -5,-0.1 -1,-0.3 0.355 82.1 103.6-104.1 0.8 -28.5 -16.9 5.3 235 250 A I < - 0 0 37 -3,-1.4 6,-0.1 -4,-0.2 -3,-0.0 -0.782 49.1-172.7 -92.6 113.7 -26.7 -19.6 7.4 236 251 A S + 0 0 98 -2,-0.7 2,-0.5 4,-0.0 -1,-0.1 0.610 59.5 85.8 -83.5 -18.1 -25.1 -22.2 5.2 237 252 A S > - 0 0 48 1,-0.1 4,-2.6 2,-0.0 5,-0.2 -0.784 62.5-155.6 -91.4 126.3 -24.0 -24.6 7.9 238 253 A E H > S+ 0 0 131 -2,-0.5 4,-3.4 2,-0.2 5,-0.2 0.930 93.4 48.5 -64.1 -48.5 -26.5 -27.1 9.0 239 254 A S H > S+ 0 0 91 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.872 113.6 47.4 -65.0 -38.0 -25.1 -27.7 12.5 240 255 A A H > S+ 0 0 16 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.954 114.6 46.5 -62.3 -51.6 -24.9 -24.0 13.2 241 256 A R H X S+ 0 0 66 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.923 115.6 46.6 -58.9 -44.0 -28.4 -23.4 11.9 242 257 A N H X S+ 0 0 62 -4,-3.4 4,-1.2 -5,-0.2 -1,-0.2 0.899 110.5 53.4 -68.2 -39.8 -29.6 -26.4 14.0 243 258 A Y H X S+ 0 0 80 -4,-2.9 4,-1.5 2,-0.2 3,-0.5 0.959 114.5 38.0 -55.4 -57.7 -27.7 -25.2 17.1 244 259 A I H < S+ 0 0 3 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.825 115.9 53.5 -70.6 -31.4 -29.1 -21.7 17.3 245 260 A Q H < S+ 0 0 102 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.737 107.9 55.5 -68.3 -23.6 -32.5 -22.9 16.2 246 261 A S H < S+ 0 0 101 -4,-1.2 -2,-0.2 -3,-0.5 -1,-0.2 0.864 92.1 80.3 -78.0 -38.9 -32.3 -25.4 19.1 247 262 A L S < S- 0 0 40 -4,-1.5 2,-0.2 1,-0.2 -21,-0.0 -0.105 98.9 -71.6 -73.7 170.8 -31.7 -23.0 22.0 248 263 A T - 0 0 110 1,-0.1 2,-0.6 -22,-0.0 -1,-0.2 -0.429 54.1-115.5 -67.5 126.7 -34.3 -21.0 23.8 249 264 A Q - 0 0 103 -2,-0.2 -1,-0.1 -3,-0.1 -4,-0.0 -0.519 33.4-164.4 -73.1 107.7 -35.6 -18.2 21.6 250 265 A M - 0 0 60 -2,-0.6 -24,-1.9 3,-0.0 2,-0.3 -0.688 13.6-133.2 -88.0 141.5 -34.6 -14.9 23.2 251 266 A P - 0 0 105 0, 0.0 -26,-0.4 0, 0.0 2,-0.1 -0.697 36.3 -94.4 -86.0 153.2 -36.3 -11.7 22.1 252 267 A K - 0 0 105 -28,-0.3 -28,-0.2 -2,-0.3 -29,-0.1 -0.437 45.1-124.3 -60.0 134.8 -34.0 -8.7 21.4 253 268 A M - 0 0 55 -30,-2.5 2,-0.6 -2,-0.1 -1,-0.1 -0.419 23.2-104.0 -75.4 157.6 -33.8 -6.6 24.5 254 269 A N > - 0 0 87 1,-0.2 4,-1.8 -2,-0.1 3,-0.4 -0.788 27.3-150.4 -78.7 121.5 -34.6 -2.9 24.4 255 270 A F H > S+ 0 0 1 -2,-0.6 4,-3.0 1,-0.2 -1,-0.2 0.848 93.8 62.4 -67.6 -34.6 -31.2 -1.2 24.5 256 271 A A H 4 S+ 0 0 48 1,-0.2 -1,-0.2 2,-0.2 5,-0.2 0.875 107.8 45.4 -53.4 -38.5 -32.7 1.9 26.3 257 272 A N H >4 S+ 0 0 112 -3,-0.4 3,-0.9 1,-0.2 -2,-0.2 0.904 114.8 45.5 -72.8 -41.8 -33.5 -0.5 29.2 258 273 A V H 3< S+ 0 0 61 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.848 120.5 39.8 -71.1 -33.2 -30.2 -2.3 29.2 259 274 A F T >< S- 0 0 8 -4,-3.0 3,-2.1 -5,-0.1 -1,-0.2 -0.199 89.1-171.2-109.6 42.2 -28.2 1.0 29.0 260 275 A I T < + 0 0 142 -3,-0.9 -3,-0.1 1,-0.3 3,-0.1 0.000 65.4 4.4 -46.0 125.7 -30.4 3.0 31.4 261 276 A G T 3 S+ 0 0 87 1,-0.3 -1,-0.3 -5,-0.2 2,-0.1 0.339 91.8 131.9 83.6 -4.4 -29.6 6.8 31.5 262 277 A A S < S- 0 0 25 -3,-2.1 -1,-0.3 -6,-0.2 5,-0.1 -0.458 78.2 -74.3 -72.6 152.6 -26.9 6.8 28.8 263 278 A N > - 0 0 43 1,-0.2 4,-2.1 -2,-0.1 3,-0.4 -0.238 42.8-131.0 -42.9 126.9 -27.2 9.4 26.2 264 279 A P H > S+ 0 0 104 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.820 108.4 56.0 -56.2 -31.8 -30.2 8.3 23.9 265 280 A L H > S+ 0 0 70 2,-0.2 4,-2.2 1,-0.2 27,-0.2 0.895 105.4 49.8 -67.4 -41.7 -27.9 8.9 20.9 266 281 A A H > S+ 0 0 0 -3,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.885 111.1 50.7 -59.5 -40.8 -25.2 6.5 22.3 267 282 A V H X S+ 0 0 15 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.902 109.8 50.2 -64.8 -40.7 -28.0 3.9 22.8 268 283 A D H X S+ 0 0 60 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.886 110.5 48.1 -63.7 -44.1 -29.2 4.4 19.3 269 284 A L H >X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 3,-0.6 0.944 109.8 53.8 -64.7 -46.0 -25.6 4.0 17.8 270 285 A L H 3X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.3 -1,-0.2 0.837 105.2 54.1 -53.4 -38.2 -25.2 0.8 20.0 271 286 A E H 3< S+ 0 0 45 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.833 111.1 46.2 -63.4 -35.3 -28.4 -0.5 18.5 272 287 A K H << S+ 0 0 84 -4,-1.3 10,-2.3 -3,-0.6 3,-0.4 0.752 117.0 42.6 -81.8 -24.6 -26.9 0.0 15.1 273 288 A M H < S+ 0 0 0 -4,-1.9 -2,-0.2 8,-0.2 -3,-0.2 0.812 108.7 56.5 -87.6 -35.3 -23.6 -1.5 15.9 274 289 A L S < S+ 0 0 2 -4,-2.5 2,-0.4 -5,-0.2 -1,-0.2 -0.071 71.1 139.6 -96.2 36.9 -24.7 -4.5 17.9 275 290 A V - 0 0 41 -3,-0.4 6,-0.1 1,-0.1 -83,-0.1 -0.659 49.8-142.8 -78.3 127.6 -27.0 -6.0 15.2 276 291 A L S S+ 0 0 29 -2,-0.4 2,-0.6 -52,-0.2 -99,-0.2 0.922 87.4 70.4 -56.1 -47.8 -26.7 -9.8 15.0 277 292 A D S >> S- 0 0 15 1,-0.2 3,-1.6 -3,-0.1 4,-0.5 -0.641 73.1-156.0 -77.6 117.0 -27.0 -9.9 11.2 278 293 A S G >4 S+ 0 0 8 -2,-0.6 3,-0.5 1,-0.3 -1,-0.2 0.736 88.9 67.0 -71.6 -25.5 -23.7 -8.4 9.9 279 294 A D G 34 S+ 0 0 85 1,-0.2 -1,-0.3 -93,-0.0 -2,-0.1 0.735 108.0 40.4 -60.0 -25.2 -25.4 -7.4 6.6 280 295 A K G <4 S+ 0 0 127 -3,-1.6 -1,-0.2 2,-0.1 -2,-0.2 0.493 89.3 115.4-105.0 -4.3 -27.5 -4.9 8.5 281 296 A R S << S- 0 0 7 -3,-0.5 -8,-0.2 -4,-0.5 -93,-0.1 -0.406 74.7-104.9 -66.7 140.9 -24.7 -3.7 10.9 282 297 A I - 0 0 17 -10,-2.3 2,-0.1 -13,-0.2 -1,-0.1 -0.311 34.5-130.1 -62.5 145.6 -23.8 -0.0 10.5 283 298 A T > - 0 0 52 1,-0.1 4,-2.4 -3,-0.1 5,-0.1 -0.442 23.3-106.5 -89.5 171.7 -20.4 0.6 8.7 284 299 A A H > S+ 0 0 3 2,-0.2 4,-1.9 1,-0.2 -149,-0.2 0.937 121.0 49.7 -62.2 -47.9 -17.6 2.9 10.1 285 300 A A H > S+ 0 0 49 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.921 114.0 45.4 -57.9 -48.8 -18.4 5.6 7.4 286 301 A Q H >4 S+ 0 0 115 1,-0.2 3,-0.7 2,-0.2 4,-0.4 0.880 109.7 54.9 -61.0 -38.9 -22.1 5.5 8.3 287 302 A A H >< S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.2 6,-0.2 0.878 101.1 59.1 -67.8 -32.9 -21.4 5.5 12.1 288 303 A L H 3< S+ 0 0 0 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.748 103.6 51.4 -67.0 -29.1 -19.3 8.7 11.7 289 304 A A T << S+ 0 0 65 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.443 85.5 119.6 -83.1 -3.2 -22.3 10.5 10.3 290 305 A H S X S- 0 0 20 -3,-1.4 3,-2.3 -4,-0.4 7,-0.1 -0.345 78.1-117.2 -64.4 144.5 -24.5 9.4 13.2 291 306 A A G > S+ 0 0 56 1,-0.3 3,-2.4 2,-0.2 4,-0.2 0.790 108.1 75.0 -55.0 -31.4 -25.9 12.2 15.3 292 307 A Y G 3 S+ 0 0 4 1,-0.3 -1,-0.3 -27,-0.2 3,-0.3 0.723 96.7 48.2 -55.4 -22.4 -23.9 11.0 18.4 293 308 A F G X> S+ 0 0 0 -3,-2.3 4,-2.9 -6,-0.2 3,-2.1 0.149 73.4 127.9-107.5 21.7 -20.7 12.4 16.8 294 309 A A T <4 S+ 0 0 83 -3,-2.4 -1,-0.2 1,-0.3 -2,-0.1 0.837 72.1 48.5 -41.7 -48.9 -22.3 15.8 16.0 295 310 A Q T 34 S+ 0 0 117 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.701 123.9 28.8 -71.8 -17.1 -19.6 17.8 17.6 296 311 A Y T <4 S+ 0 0 73 -3,-2.1 2,-0.3 -8,-0.1 -2,-0.2 0.656 85.6 109.4-115.8 -26.7 -16.7 15.9 16.0 297 312 A H < + 0 0 60 -4,-2.9 5,-0.1 -7,-0.1 -8,-0.0 -0.441 33.5 169.7 -71.9 119.9 -17.8 14.6 12.6 298 313 A D > - 0 0 70 -2,-0.3 3,-2.7 3,-0.1 -1,-0.1 -0.887 21.0-159.7-131.2 101.2 -16.2 16.5 9.7 299 314 A P G > S+ 0 0 81 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.681 91.6 54.0 -56.4 -23.6 -16.8 14.8 6.3 300 315 A D G 3 S+ 0 0 150 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.353 109.6 48.3 -94.6 5.6 -13.9 16.5 4.6 301 316 A D G < S+ 0 0 80 -3,-2.7 -1,-0.2 1,-0.1 -3,-0.1 -0.113 83.8 89.5-134.7 38.0 -11.4 15.3 7.3 302 317 A E < - 0 0 10 -3,-0.6 -1,-0.1 -5,-0.1 -14,-0.0 -0.637 69.2-166.4-126.6 73.0 -12.3 11.6 7.5 303 318 A P - 0 0 53 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.059 12.8-134.5 -70.2 158.9 -9.9 10.3 4.8 304 319 A V - 0 0 91 -165,-0.1 -168,-0.2 -166,-0.1 2,-0.2 -0.723 27.5-103.2-104.5 162.2 -9.7 7.0 3.1 305 320 A A - 0 0 13 -169,-0.7 3,-0.1 -2,-0.3 -231,-0.1 -0.476 30.2-103.2 -85.2 153.7 -6.6 4.9 2.5 306 321 A D - 0 0 112 -233,-0.2 -1,-0.1 -2,-0.2 -233,-0.0 -0.425 61.7 -80.9 -60.6 150.0 -4.6 4.3 -0.6 307 322 A P - 0 0 119 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.210 48.1-139.7 -62.2 148.4 -5.5 0.9 -2.1 308 323 A Y - 0 0 20 -168,-0.4 2,-1.1 -3,-0.1 -238,-0.0 -0.953 0.7-141.8-123.3 123.3 -3.7 -1.9 -0.4 309 324 A D + 0 0 92 -2,-0.5 3,-0.3 1,-0.1 -169,-0.0 -0.653 32.5 158.4 -84.8 98.8 -2.2 -4.9 -2.2 310 325 A Q > + 0 0 63 -2,-1.1 3,-1.6 1,-0.2 4,-0.3 0.009 32.5 120.4-110.6 32.5 -2.7 -8.0 -0.2 311 326 A S G > + 0 0 42 1,-0.3 3,-2.1 2,-0.2 4,-0.3 0.871 64.8 74.3 -58.0 -31.9 -2.4 -10.4 -3.0 312 327 A F G > S+ 0 0 2 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