==== 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 SIGNALING PROTEIN, TRANSFERASE 19-DEC-08 3FLZ . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.KUGLSTATTER,M.GHATE . 347 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17264.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 229 66.0 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 . 42 12.1 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 . 28 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 98 28.2 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 2 2 1 0 1 0 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 . 0 1 2 0 1 1 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 . 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 4 A E 0 0 226 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-178.3 -3.5 1.1 39.2 2 5 A R - 0 0 85 1,-0.1 3,-0.1 89,-0.0 89,-0.0 -0.604 360.0-129.0 -69.0 126.8 -1.2 3.6 41.0 3 6 A P - 0 0 61 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.257 28.5 -94.0 -67.9 167.0 2.0 1.8 42.2 4 7 A T - 0 0 85 -2,-0.0 15,-2.2 2,-0.0 2,-0.3 -0.716 41.1-152.6 -83.0 133.0 3.3 2.1 45.8 5 8 A F E -A 18 0A 24 -2,-0.4 2,-0.3 13,-0.2 11,-0.1 -0.761 6.8-161.4-103.0 150.9 5.9 4.8 46.3 6 9 A Y E -A 17 0A 62 11,-2.3 11,-1.7 -2,-0.3 2,-0.3 -0.971 15.3-127.6-129.8 151.8 8.6 4.9 48.9 7 10 A R E +A 16 0A 157 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.686 29.0 164.5-102.9 152.0 10.6 8.0 50.1 8 11 A Q E -A 15 0A 56 7,-1.4 7,-3.1 -2,-0.3 2,-0.6 -0.878 35.4-121.9-168.4 123.7 14.4 8.3 50.3 9 12 A E E +A 14 0A 143 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.651 39.9 166.4 -80.3 117.7 16.6 11.4 50.8 10 13 A L E > -A 13 0A 19 3,-2.3 3,-1.1 -2,-0.6 2,-0.9 -0.989 59.8 -15.6-135.2 145.1 19.1 11.7 47.9 11 14 A N T 3 S- 0 0 82 -2,-0.3 -2,-0.1 1,-0.2 3,-0.0 -0.601 128.3 -42.2 59.1-102.2 21.3 14.6 46.9 12 15 A K T 3 S+ 0 0 190 -2,-0.9 -1,-0.2 2,-0.0 2,-0.1 0.531 124.4 67.3-122.9 -20.4 19.6 17.3 49.0 13 16 A T E < S-A 10 0A 56 -3,-1.1 -3,-2.3 -5,-0.0 2,-0.6 -0.456 84.8-100.8-103.7 170.2 15.9 16.5 48.4 14 17 A I E -A 9 0A 67 -5,-0.2 2,-0.5 -2,-0.1 -5,-0.3 -0.844 34.1-151.2 -91.8 118.7 13.5 13.6 49.2 15 18 A W E -A 8 0A 0 -7,-3.1 -7,-1.4 -2,-0.6 2,-0.6 -0.811 9.5-169.2 -91.8 125.8 13.0 11.3 46.3 16 19 A E E +A 7 0A 53 -2,-0.5 -9,-0.2 -9,-0.2 -11,-0.0 -0.917 22.4 157.9-118.3 102.6 9.6 9.5 46.1 17 20 A V E -A 6 0A 1 -11,-1.7 -11,-2.3 -2,-0.6 -2,-0.0 -0.849 45.7 -88.1-124.1 154.9 9.6 6.8 43.5 18 21 A P E > -A 5 0A 5 0, 0.0 3,-1.9 0, 0.0 -13,-0.2 -0.311 42.1-112.3 -57.5 147.9 7.7 3.5 42.7 19 22 A E T 3 S+ 0 0 108 -15,-2.2 22,-0.1 1,-0.3 -14,-0.1 0.754 109.7 76.4 -53.1 -32.5 9.0 0.3 44.4 20 23 A R T 3 S+ 0 0 61 -16,-0.2 21,-3.0 20,-0.1 2,-0.6 0.774 84.4 73.9 -52.2 -29.7 10.0 -1.1 41.0 21 24 A Y E < +B 40 0B 1 -3,-1.9 2,-0.2 19,-0.2 19,-0.2 -0.811 69.0 167.6 -93.9 117.7 13.0 1.3 41.1 22 25 A Q E +B 39 0B 75 17,-2.4 17,-3.2 -2,-0.6 -2,-0.0 -0.783 44.8 33.7-126.7 167.6 15.7 0.1 43.6 23 26 A N E S- 0 0 128 -2,-0.2 2,-0.2 15,-0.2 -1,-0.2 0.914 72.0-165.5 52.7 52.0 19.3 0.8 44.6 24 27 A L E + 0 0 14 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.499 9.9 179.9 -71.6 132.7 19.1 4.5 43.8 25 28 A S E -B 37 0B 66 12,-2.6 12,-2.9 -2,-0.2 -15,-0.1 -0.973 31.6-115.2-142.3 119.2 22.5 6.2 43.5 26 29 A P E +B 36 0B 58 0, 0.0 10,-0.2 0, 0.0 -15,-0.0 -0.317 39.6 167.2 -50.7 125.6 23.3 9.9 42.8 27 30 A V E - 0 0 97 8,-2.4 2,-0.3 1,-0.3 9,-0.2 0.799 43.0 -63.1-111.1 -56.9 25.2 10.1 39.5 28 31 A G E -B 35 0B 39 7,-0.9 7,-2.2 0, 0.0 2,-0.5 -0.890 58.3 -47.9-171.0-163.3 25.4 13.6 38.1 29 32 A S E -B 34 0B 127 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.845 48.6-178.8-100.5 127.7 23.9 16.8 36.8 30 33 A G E > -B 33 0B 26 3,-2.4 3,-1.3 -2,-0.5 2,-0.6 -0.622 45.7 -59.6-114.9 177.8 21.3 16.6 34.0 31 34 A A T 3 S- 0 0 20 1,-0.3 -1,-0.0 -2,-0.2 134,-0.0 -0.478 118.7 -20.1 -62.6 107.8 19.3 19.2 32.0 32 35 A Y T 3 S+ 0 0 79 -2,-0.6 21,-1.6 20,-0.1 2,-0.3 0.701 134.0 39.0 65.6 26.9 17.3 21.1 34.6 33 36 A G E < S-BC 30 52B 9 -3,-1.3 -3,-2.4 19,-0.3 2,-0.3 -0.949 85.8 -85.5 175.6 167.4 17.6 18.5 37.4 34 37 A S E -BC 29 51B 32 17,-1.1 17,-1.8 -2,-0.3 2,-0.3 -0.697 37.6-137.9 -94.2 145.5 19.7 15.8 39.1 35 38 A V E -BC 28 50B 25 -7,-2.2 -8,-2.4 -2,-0.3 -7,-0.9 -0.776 13.6-167.9-107.3 143.7 20.1 12.2 37.9 36 39 A C E -BC 26 49B 0 13,-2.1 13,-3.4 -2,-0.3 2,-0.3 -0.985 17.6-136.1-124.5 139.7 20.2 8.9 39.8 37 40 A A E +BC 25 48B 17 -12,-2.9 -12,-2.6 -2,-0.4 2,-0.3 -0.706 37.2 162.5 -82.8 146.2 21.2 5.5 38.6 38 41 A A E - C 0 47B 7 9,-1.8 9,-2.7 -2,-0.3 2,-0.6 -0.971 40.8-108.9-156.0 163.2 18.8 2.7 39.7 39 42 A F E -BC 22 46B 77 -17,-3.2 -17,-2.4 -2,-0.3 2,-0.9 -0.920 24.3-147.6-101.4 118.8 17.7 -0.9 39.0 40 43 A D E >> -B 21 0B 1 5,-2.7 4,-2.9 -2,-0.6 3,-0.7 -0.776 9.9-168.0 -84.5 103.9 14.3 -1.2 37.3 41 44 A T T 34 S+ 0 0 79 -21,-3.0 -1,-0.2 -2,-0.9 -20,-0.1 0.701 82.0 59.0 -68.7 -21.3 13.0 -4.6 38.7 42 45 A K T 34 S+ 0 0 149 -22,-0.2 -1,-0.2 1,-0.1 -21,-0.1 0.825 122.7 19.9 -74.5 -33.2 10.1 -4.7 36.1 43 46 A T T <4 S- 0 0 73 -3,-0.7 -2,-0.2 2,-0.2 -1,-0.1 0.632 95.0-125.9-111.4 -22.1 12.4 -4.6 33.0 44 47 A G < + 0 0 44 -4,-2.9 2,-0.2 1,-0.3 -3,-0.2 0.504 66.8 133.4 82.6 6.2 15.7 -5.7 34.4 45 48 A L - 0 0 63 -5,-0.5 -5,-2.7 -6,-0.0 2,-0.5 -0.596 61.3-125.3 -90.2 146.3 17.3 -2.5 32.9 46 49 A R E -C 39 0B 176 -2,-0.2 59,-2.3 -7,-0.2 2,-0.3 -0.816 43.1-166.1 -84.2 131.6 19.7 -0.1 34.7 47 50 A V E -CD 38 104B 0 -9,-2.7 -9,-1.8 -2,-0.5 2,-0.5 -0.836 26.9-131.6-126.4 154.3 18.0 3.2 34.4 48 51 A A E -CD 37 103B 14 55,-3.0 55,-2.5 -2,-0.3 2,-0.5 -0.950 24.5-163.4-102.8 128.2 18.7 6.9 34.8 49 52 A V E -CD 36 102B 1 -13,-3.4 -13,-2.1 -2,-0.5 2,-0.5 -0.956 2.6-165.9-116.0 113.9 16.1 8.7 36.9 50 53 A K E -CD 35 101B 24 51,-2.9 51,-2.7 -2,-0.5 2,-0.6 -0.890 6.9-161.6-103.7 124.0 15.9 12.5 36.8 51 54 A K E -CD 34 100B 21 -17,-1.8 -17,-1.1 -2,-0.5 49,-0.2 -0.921 23.3-132.8 -96.6 119.1 14.0 14.6 39.3 52 55 A L E -C 33 0B 6 47,-2.0 2,-0.5 -2,-0.6 47,-0.3 -0.484 15.7-127.4 -71.1 138.5 13.3 18.1 37.9 53 56 A S S S- 0 0 61 -21,-1.6 -1,-0.1 1,-0.3 45,-0.0 -0.801 80.5 -21.5 -90.9 129.0 14.1 21.0 40.3 54 57 A R S > S- 0 0 168 -2,-0.5 3,-0.9 1,-0.1 -1,-0.3 0.900 72.9-177.8 31.4 72.4 11.2 23.4 40.7 55 58 A P T 3 S+ 0 0 2 0, 0.0 10,-0.4 0, 0.0 11,-0.2 0.700 78.7 33.1 -66.4 -21.1 9.5 22.4 37.4 56 59 A F T 3 S+ 0 0 21 41,-0.2 -2,-0.1 1,-0.1 278,-0.1 -0.065 77.5 114.2-129.1 33.5 6.7 25.0 37.9 57 60 A Q S < S+ 0 0 114 -3,-0.9 2,-0.3 1,-0.1 -1,-0.1 0.656 88.1 6.2 -81.3 -16.4 8.4 28.0 39.7 58 61 A S S > S- 0 0 33 -4,-0.2 4,-3.0 -3,-0.1 5,-0.2 -0.952 77.8-103.7-151.3 170.7 7.9 30.3 36.7 59 62 A I H > S+ 0 0 82 -2,-0.3 4,-2.8 2,-0.2 5,-0.3 0.935 124.1 52.3 -61.4 -45.9 6.3 30.5 33.3 60 63 A I H > S+ 0 0 128 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.904 114.9 41.6 -54.0 -46.4 9.8 30.0 31.8 61 64 A H H > S+ 0 0 40 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.898 114.0 51.5 -68.3 -45.0 10.3 26.9 34.0 62 65 A A H X S+ 0 0 0 -4,-3.0 4,-2.1 2,-0.2 -2,-0.2 0.905 112.8 44.7 -62.2 -44.9 6.7 25.6 33.5 63 66 A K H X S+ 0 0 36 -4,-2.8 4,-3.0 2,-0.2 -1,-0.2 0.885 111.5 54.6 -64.4 -41.1 7.0 25.8 29.7 64 67 A R H X S+ 0 0 48 -4,-1.6 4,-2.6 -5,-0.3 -2,-0.2 0.882 108.2 48.9 -59.1 -43.6 10.5 24.3 29.8 65 68 A T H X S+ 0 0 6 -4,-2.2 4,-2.4 -10,-0.4 -2,-0.2 0.935 112.6 47.6 -61.8 -48.4 9.2 21.3 31.8 66 69 A Y H X S+ 0 0 11 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.916 111.8 51.8 -59.4 -44.2 6.3 20.8 29.3 67 70 A R H X S+ 0 0 46 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.924 110.7 45.5 -58.8 -51.8 8.8 21.1 26.4 68 71 A E H X S+ 0 0 11 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.931 115.1 48.1 -59.6 -47.2 11.2 18.5 27.7 69 72 A L H X S+ 0 0 1 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.929 113.1 47.9 -58.9 -47.2 8.3 16.1 28.5 70 73 A R H X S+ 0 0 40 -4,-2.9 4,-1.0 -5,-0.2 -2,-0.2 0.916 114.4 46.8 -58.6 -45.5 6.8 16.6 25.0 71 74 A L H X S+ 0 0 4 -4,-2.7 4,-1.3 1,-0.2 3,-0.3 0.911 113.4 46.4 -64.3 -46.8 10.2 16.1 23.3 72 75 A L H < S+ 0 0 17 -4,-2.8 11,-0.8 1,-0.2 -1,-0.2 0.852 109.7 54.8 -67.1 -35.8 11.1 12.9 25.3 73 76 A K H < S+ 0 0 40 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.748 109.1 49.5 -67.4 -26.4 7.7 11.4 24.7 74 77 A H H < S+ 0 0 36 -4,-1.0 2,-0.7 -3,-0.3 243,-0.2 0.818 86.6 94.5 -81.1 -33.3 8.0 11.8 21.0 75 78 A M < + 0 0 4 -4,-1.3 2,-0.4 6,-0.1 8,-0.4 -0.509 36.4 159.3 -79.2 108.5 11.4 10.3 20.4 76 79 A K + 0 0 168 -2,-0.7 2,-0.3 6,-0.1 -1,-0.1 -0.722 31.6 117.3-125.1 79.7 11.3 6.6 19.4 77 80 A H > - 0 0 18 3,-0.4 3,-1.4 -2,-0.4 57,-0.0 -0.994 66.0-126.4-146.6 142.3 14.6 5.9 17.7 78 81 A E T 3 S+ 0 0 127 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.801 111.9 44.5 -55.7 -36.2 17.6 3.6 18.5 79 82 A N T 3 S+ 0 0 7 83,-0.1 84,-1.8 51,-0.1 2,-0.4 0.192 105.4 73.9-100.5 13.8 20.1 6.4 18.3 80 83 A V B < S-f 163 0C 1 -3,-1.4 -3,-0.4 82,-0.3 84,-0.2 -0.986 90.6-102.4-130.1 137.5 18.1 8.9 20.3 81 84 A I - 0 0 15 82,-2.5 2,-0.3 -2,-0.4 -6,-0.1 -0.350 45.4-166.1 -55.6 127.8 17.4 9.0 24.0 82 85 A G - 0 0 16 -4,-0.1 2,-0.7 -2,-0.1 22,-0.4 -0.786 23.3-105.9-117.8 164.8 13.9 7.8 24.8 83 86 A L + 0 0 14 -11,-0.8 20,-0.2 -8,-0.4 3,-0.1 -0.817 28.0 176.5 -95.2 113.8 11.5 7.8 27.7 84 87 A L S S- 0 0 22 18,-2.2 2,-0.3 -2,-0.7 19,-0.2 0.828 72.6 -13.0 -74.9 -37.9 11.1 4.5 29.6 85 88 A D E -E 102 0B 23 17,-1.3 17,-2.7 261,-0.1 2,-0.3 -0.984 50.6-165.0-160.9 154.9 8.9 6.0 32.2 86 89 A V E +E 101 0B 7 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.957 25.4 164.3-143.7 136.7 7.6 9.3 33.7 87 90 A F E -E 100 0B 15 13,-1.8 13,-1.9 -2,-0.3 255,-0.0 -0.983 25.3-159.5-151.2 160.4 5.8 9.6 37.1 88 91 A T - 0 0 14 -2,-0.3 11,-0.1 2,-0.2 -71,-0.1 -0.991 23.6-138.1-136.2 139.8 4.6 11.8 39.9 89 92 A P S S+ 0 0 18 0, 0.0 -84,-0.1 0, 0.0 7,-0.1 0.728 75.4 110.3 -63.6 -21.1 3.7 10.8 43.5 90 93 A A - 0 0 11 8,-0.3 -2,-0.2 1,-0.1 6,-0.1 -0.204 56.4-160.3 -56.7 143.4 0.7 13.2 43.2 91 94 A R S S+ 0 0 173 1,-0.1 2,-0.3 -89,-0.0 -1,-0.1 0.493 75.5 17.0-100.9 -9.1 -2.8 11.6 43.0 92 95 A S S > S- 0 0 33 1,-0.1 3,-0.6 0, 0.0 4,-0.2 -0.962 82.3-101.6-154.3 165.8 -4.4 14.7 41.4 93 96 A L G > S+ 0 0 50 -2,-0.3 3,-0.9 1,-0.2 -1,-0.1 0.819 117.4 61.1 -58.0 -35.2 -3.6 18.0 39.6 94 97 A E G 3 S+ 0 0 162 1,-0.2 -1,-0.2 -3,-0.0 -4,-0.0 0.801 111.8 35.8 -69.3 -29.5 -4.1 19.9 42.8 95 98 A E G < S+ 0 0 103 -3,-0.6 2,-0.6 -6,-0.0 -1,-0.2 0.270 89.2 123.2-104.3 11.9 -1.3 18.1 44.6 96 99 A F < + 0 0 2 -3,-0.9 3,-0.1 -4,-0.2 242,-0.1 -0.624 17.7 129.4 -78.9 114.0 0.9 17.8 41.5 97 100 A N + 0 0 104 -2,-0.6 2,-0.3 1,-0.2 -41,-0.2 0.524 53.6 61.4-138.1 -21.3 4.3 19.4 42.1 98 101 A D - 0 0 48 -44,-0.1 2,-0.4 -43,-0.1 -8,-0.3 -0.901 51.7-165.7-123.5 147.2 7.1 17.0 41.1 99 102 A V - 0 0 1 -2,-0.3 -47,-2.0 -47,-0.3 2,-0.4 -0.995 3.9-169.4-130.6 128.7 8.1 15.3 37.8 100 103 A Y E -DE 51 87B 2 -13,-1.9 -13,-1.8 -2,-0.4 2,-0.4 -0.973 5.3-161.3-119.2 135.7 10.4 12.3 37.4 101 104 A L E -DE 50 86B 8 -51,-2.7 -51,-2.9 -2,-0.4 2,-0.4 -0.926 3.3-159.6-117.3 141.0 11.8 11.1 34.1 102 105 A V E +DE 49 85B 0 -17,-2.7 -18,-2.2 -2,-0.4 -17,-1.3 -0.975 19.8 152.8-125.6 130.2 13.3 7.7 33.4 103 106 A T E -D 48 0B 25 -55,-2.5 -55,-3.0 -2,-0.4 -20,-0.1 -0.854 50.6 -64.3-140.0 177.3 15.6 6.6 30.6 104 107 A H E -D 47 0B 61 -22,-0.4 2,-0.5 -2,-0.3 -57,-0.3 -0.392 49.5-119.1 -62.9 139.6 18.3 4.0 29.9 105 108 A L - 0 0 60 -59,-2.3 2,-0.3 -67,-0.1 -59,-0.2 -0.705 31.6-149.8 -76.5 128.5 21.5 4.3 32.0 106 109 A M - 0 0 44 -2,-0.5 50,-0.1 1,-0.1 3,-0.1 -0.784 8.8-139.5-103.5 150.2 24.4 4.9 29.6 107 110 A G S S- 0 0 60 48,-0.3 2,-0.3 -2,-0.3 49,-0.2 0.951 71.8 -19.9 -75.1 -55.2 28.0 3.7 30.3 108 111 A A E -G 155 0C 35 47,-1.6 47,-2.6 3,-0.0 -1,-0.2 -0.902 60.3-120.9-143.9 170.4 30.1 6.6 29.1 109 112 A D E > -G 154 0C 37 -2,-0.3 4,-0.9 45,-0.3 3,-0.3 -0.521 41.8 -92.9-104.7-175.6 29.9 9.6 26.8 110 113 A L H > S+ 0 0 1 40,-1.9 4,-2.2 43,-1.5 5,-0.2 0.731 118.5 65.7 -74.5 -23.8 32.0 10.4 23.8 111 114 A N H > S+ 0 0 67 39,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.935 101.0 48.8 -56.5 -50.0 34.5 12.5 25.8 112 115 A N H 4 S+ 0 0 91 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.822 111.6 50.8 -64.0 -33.4 35.7 9.4 27.8 113 116 A I H < S+ 0 0 42 -4,-0.9 -1,-0.2 1,-0.1 -2,-0.2 0.957 109.6 46.9 -69.8 -53.7 36.2 7.5 24.6 114 117 A V H >< S+ 0 0 5 -4,-2.2 3,-2.7 2,-0.1 -2,-0.2 0.934 76.3 171.3 -53.6 -52.5 38.3 10.0 22.7 115 118 A K T 3< S- 0 0 129 -4,-2.2 -3,-0.1 1,-0.3 3,-0.1 0.861 77.8 -57.3 39.0 59.3 40.5 10.5 25.7 116 119 A C T 3 S+ 0 0 97 -5,-0.2 -1,-0.3 1,-0.2 2,-0.3 0.396 116.6 113.3 60.7 -3.0 43.1 12.7 23.9 117 120 A Q S < S- 0 0 101 -3,-2.7 2,-0.2 -4,-0.1 98,-0.2 -0.672 70.6-113.6-107.3 152.0 43.6 9.8 21.5 118 121 A K - 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0 0 36 -2,-0.3 -9,-0.1 1,-0.1 -33,-0.0 -0.367 29.7-146.4 -56.7 129.6 39.5 19.9 19.4 218 222 A L S S+ 0 0 33 -11,-0.4 -1,-0.1 1,-0.2 -34,-0.1 0.951 90.7 15.7 -65.2 -51.6 39.0 21.3 15.9 219 223 A F + 0 0 5 -36,-0.3 2,-2.4 2,-0.1 -1,-0.2 -0.639 69.0 175.0-124.6 74.1 38.3 25.0 17.1 220 224 A P - 0 0 39 0, 0.0 -40,-0.1 0, 0.0 -3,-0.0 -0.345 20.1-176.7 -78.0 62.0 39.5 25.4 20.7 221 225 A G - 0 0 0 -2,-2.4 -42,-0.3 1,-0.1 -39,-0.1 -0.260 29.8-145.5 -60.3 143.6 38.8 29.1 20.8 222 226 A T S S- 0 0 70 1,-0.2 2,-0.3 -44,-0.2 -44,-0.2 0.490 83.6 -13.3 -86.3 -7.0 39.8 31.0 23.9 223 227 A D S > S- 0 0 64 -47,-0.1 4,-2.5 -46,-0.1 5,-0.2 -0.929 90.2 -74.9-174.5 177.5 36.7 33.2 23.4 224 228 A H H > S+ 0 0 57 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.867 127.0 43.8 -53.7 -45.4 34.1 34.1 20.7 225 229 A I H > S+ 0 0 62 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.937 113.4 49.0 -72.1 -49.3 36.5 36.2 18.6 226 230 A D H > S+ 0 0 51 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.916 112.6 50.1 -54.6 -45.9 39.5 33.8 18.8 227 231 A Q H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.889 108.2 51.7 -62.9 -43.0 37.3 30.9 17.8 228 232 A L H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.905 109.6 50.5 -58.5 -43.0 35.8 32.8 14.8 229 233 A K H X S+ 0 0 113 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.903 109.7 50.6 -61.6 -40.8 39.3 33.5 13.6 230 234 A L H X S+ 0 0 62 -4,-2.1 4,-1.1 1,-0.2 -1,-0.2 0.877 112.5 47.8 -62.9 -40.1 40.2 29.8 14.0 231 235 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.920 111.4 48.2 -65.7 -47.3 37.1 28.9 12.0 232 236 A L H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.785 103.7 61.1 -72.0 -26.9 37.8 31.4 9.1 233 237 A R H < S+ 0 0 159 -4,-1.9 -1,-0.2 -5,-0.2 31,-0.2 0.905 113.9 37.0 -62.0 -40.9 41.4 30.3 8.8 234 238 A L H < S+ 0 0 11 -4,-1.1 30,-2.7 -3,-0.3 -2,-0.2 0.954 130.3 26.6 -74.8 -53.2 40.1 26.8 7.9 235 239 A V H < S- 0 0 19 -4,-2.6 28,-0.3 28,-0.2 52,-0.2 0.561 108.9-116.4 -94.3 -7.1 37.0 27.5 5.9 236 240 A G < - 0 0 4 -4,-1.8 -1,-0.2 26,-0.4 -3,-0.1 0.018 38.7 -62.5 89.4 158.5 37.9 31.0 4.5 237 241 A T - 0 0 27 24,-2.3 26,-0.1 1,-0.1 50,-0.1 -0.423 67.1 -89.9 -73.6 152.1 36.2 34.3 5.0 238 242 A P - 0 0 13 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.249 38.3-132.4 -65.3 152.1 32.6 34.7 3.8 239 243 A G > - 0 0 43 -3,-0.1 4,-2.2 1,-0.0 5,-0.1 -0.339 34.5 -90.9 -90.3 179.3 31.8 35.9 0.3 240 244 A A H > S+ 0 0 76 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.876 123.7 61.1 -58.2 -40.1 29.2 38.5 -0.8 241 245 A E H > S+ 0 0 100 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.938 109.5 37.6 -55.3 -55.7 26.6 35.9 -1.0 242 246 A L H >> S+ 0 0 10 1,-0.2 3,-0.7 2,-0.2 4,-0.7 0.862 110.8 62.4 -66.6 -35.9 26.7 34.8 2.6 243 247 A L H >< S+ 0 0 29 -4,-2.2 3,-1.4 1,-0.3 -2,-0.2 0.913 98.4 55.4 -54.9 -47.6 27.2 38.4 3.8 244 248 A K H 3< S+ 0 0 156 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.793 105.5 54.4 -51.0 -34.2 23.8 39.4 2.3 245 249 A K H << S+ 0 0 65 -3,-0.7 2,-1.3 -4,-0.7 -1,-0.3 0.588 80.4 96.7 -83.9 -12.5 22.3 36.7 4.5 246 250 A I << - 0 0 0 -3,-1.4 -52,-0.2 -4,-0.7 6,-0.2 -0.678 56.0-174.4 -77.5 96.9 23.8 38.0 7.7 247 251 A S + 0 0 86 -2,-1.3 2,-0.7 -54,-0.6 -1,-0.2 0.712 58.9 91.2 -72.4 -23.7 20.7 40.0 8.8 248 252 A S > - 0 0 39 -55,-1.5 4,-2.0 1,-0.2 5,-0.2 -0.668 63.4-161.6 -70.5 111.8 22.5 41.5 11.8 249 253 A E H > S+ 0 0 149 -2,-0.7 4,-1.7 2,-0.2 -1,-0.2 0.822 89.6 56.2 -63.4 -30.7 23.9 44.8 10.4 250 254 A S H > S+ 0 0 94 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.964 109.8 40.5 -65.9 -56.9 26.3 44.8 13.4 251 255 A A H > S+ 0 0 16 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.877 113.3 54.9 -60.1 -42.3 27.9 41.4 12.8 252 256 A R H X S+ 0 0 73 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.908 107.6 50.6 -59.7 -44.5 28.1 41.9 9.0 253 257 A N H X S+ 0 0 114 -4,-1.7 4,-0.5 2,-0.2 -1,-0.2 0.858 111.0 48.3 -60.5 -40.9 30.0 45.1 9.6 254 258 A Y H >< S+ 0 0 72 -4,-1.8 3,-1.6 1,-0.2 4,-0.4 0.949 107.7 54.9 -65.8 -48.2 32.5 43.3 11.9 255 259 A I H >< S+ 0 0 9 -4,-2.9 3,-1.6 1,-0.3 -2,-0.2 0.882 102.2 58.4 -48.6 -44.4 33.0 40.4 9.4 256 260 A Q H 3< S+ 0 0 131 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.692 94.1 66.3 -62.9 -22.0 33.9 42.9 6.6 257 261 A S T << S+ 0 0 82 -3,-1.6 -1,-0.3 -4,-0.5 2,-0.3 0.625 83.2 96.1 -74.9 -13.7 36.8 44.3 8.8 258 262 A L S < S- 0 0 33 -3,-1.6 2,-0.1 -4,-0.4 3,-0.1 -0.580 86.0-106.9 -86.2 140.0 38.7 41.0 8.6 259 263 A T - 0 0 124 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.1 -0.431 46.8-104.7 -61.3 128.6 41.5 40.4 6.0 260 264 A Q - 0 0 161 -2,-0.1 -1,-0.1 -4,-0.1 -4,-0.0 -0.319 41.5-171.2 -62.3 137.2 40.1 38.0 3.4 261 265 A M - 0 0 65 -29,-0.1 -24,-2.3 -3,-0.1 2,-0.1 -0.994 16.7-128.7-131.0 137.4 41.4 34.5 3.7 262 266 A P - 0 0 110 0, 0.0 -26,-0.4 0, 0.0 2,-0.1 -0.487 38.0 -88.7 -80.8 157.0 40.9 31.6 1.3 263 267 A K - 0 0 99 -28,-0.3 -28,-0.2 -2,-0.1 -29,-0.1 -0.400 48.0-123.3 -57.4 135.8 39.6 28.1 2.3 264 268 A M - 0 0 60 -30,-2.7 2,-0.7 -31,-0.2 -1,-0.1 -0.378 26.1 -97.0 -78.5 161.9 42.5 25.8 3.4 265 269 A N >> - 0 0 94 1,-0.1 3,-0.9 -2,-0.1 4,-0.7 -0.734 29.6-156.7 -80.0 115.3 43.2 22.4 1.8 266 270 A F H 3> S+ 0 0 2 -2,-0.7 4,-3.2 1,-0.3 3,-0.3 0.785 89.8 62.7 -69.4 -30.2 41.6 19.8 4.1 267 271 A A H 34 S+ 0 0 52 1,-0.2 -1,-0.3 2,-0.2 5,-0.2 0.766 106.2 46.6 -63.6 -28.3 43.9 17.0 2.9 268 272 A N H <4 S+ 0 0 117 -3,-0.9 3,-0.3 3,-0.1 -1,-0.2 0.636 114.5 47.4 -85.1 -16.0 46.8 19.1 4.4 269 273 A V H < S+ 0 0 52 -4,-0.7 2,-0.8 -3,-0.3 -2,-0.2 0.876 116.3 42.6 -86.2 -44.0 44.9 19.7 7.6 270 274 A F S >< S- 0 0 11 -4,-3.2 3,-1.7 -5,-0.1 -1,-0.2 -0.534 84.8-168.9-105.7 66.4 43.8 16.1 8.1 271 275 A I T 3 + 0 0 132 -2,-0.8 3,-0.1 -3,-0.3 -3,-0.1 -0.311 69.4 10.2 -61.8 126.7 47.0 14.2 7.2 272 276 A G T 3 S+ 0 0 82 1,-0.3 -1,-0.2 -5,-0.2 2,-0.2 0.359 95.2 135.6 89.7 -3.4 46.7 10.5 6.9 273 277 A A < - 0 0 26 -3,-1.7 -1,-0.3 -6,-0.2 -3,-0.1 -0.474 68.9 -87.8 -82.6 147.8 42.9 10.5 7.0 274 278 A N >> - 0 0 40 -2,-0.2 4,-2.3 1,-0.2 3,-0.9 -0.292 34.8-132.5 -45.5 121.2 40.6 8.6 4.6 275 279 A P H 3> S+ 0 0 103 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.812 108.9 55.9 -52.3 -32.4 40.1 10.8 1.5 276 280 A L H 3> S+ 0 0 74 2,-0.2 4,-2.1 1,-0.2 27,-0.3 0.830 105.8 50.1 -68.8 -34.6 36.3 10.0 1.9 277 281 A A H <> S+ 0 0 0 -3,-0.9 4,-2.7 2,-0.2 -1,-0.2 0.918 110.4 51.0 -66.3 -44.3 36.4 11.3 5.5 278 282 A V H X S+ 0 0 14 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.931 109.6 50.2 -54.9 -49.3 38.1 14.5 4.2 279 283 A D H X S+ 0 0 55 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.922 110.9 48.0 -58.4 -48.3 35.5 14.9 1.5 280 284 A L H >X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 3,-0.7 0.939 108.8 54.0 -59.1 -48.9 32.6 14.6 4.0 281 285 A L H 3X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.886 106.1 53.8 -51.6 -42.6 34.2 17.1 6.4 282 286 A E H 3< S+ 0 0 60 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.829 110.3 46.4 -62.0 -34.3 34.5 19.6 3.6 283 287 A K H << S+ 0 0 89 -4,-1.4 10,-1.8 -3,-0.7 3,-0.3 0.744 117.0 44.2 -80.6 -26.7 30.7 19.2 2.9 284 288 A M H < S+ 0 0 0 -4,-2.0 2,-1.1 8,-0.2 -2,-0.2 0.848 106.8 58.2 -81.4 -40.7 29.8 19.5 6.6 285 289 A L S < S+ 0 0 4 -4,-2.9 2,-0.4 -5,-0.2 -1,-0.2 -0.409 71.7 139.2 -96.5 57.7 32.1 22.4 7.5 286 290 A V - 0 0 42 -2,-1.1 6,-0.1 -3,-0.3 -3,-0.1 -0.843 50.1-142.3-100.1 136.7 30.7 25.0 5.0 287 291 A L S S+ 0 0 15 -2,-0.4 2,-0.6 -52,-0.2 -99,-0.2 0.921 87.1 71.3 -68.6 -44.7 30.3 28.5 6.4 288 292 A D S > S- 0 0 12 1,-0.2 3,-1.5 -3,-0.1 4,-0.3 -0.648 73.8-154.4 -75.9 116.6 27.0 29.2 4.5 289 293 A S G > S+ 0 0 7 -2,-0.6 3,-0.8 1,-0.3 -1,-0.2 0.742 88.9 66.5 -68.8 -24.7 24.5 27.1 6.3 290 294 A D G 3 S+ 0 0 102 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.0 0.728 104.4 46.1 -62.3 -23.3 22.2 26.9 3.2 291 295 A K G < S+ 0 0 115 -3,-1.5 -1,-0.2 2,-0.1 -2,-0.2 0.408 84.9 116.1-106.9 -0.8 25.0 24.9 1.4 292 296 A R S < S- 0 0 7 -3,-0.8 -8,-0.2 -4,-0.3 2,-0.1 -0.370 74.4-102.8 -66.6 145.8 25.8 22.4 4.2 293 297 A I - 0 0 18 -10,-1.8 2,-0.2 -13,-0.2 -1,-0.1 -0.419 37.9-131.2 -61.6 143.5 25.1 18.7 3.6 294 298 A T > - 0 0 52 1,-0.1 4,-2.8 -2,-0.1 5,-0.2 -0.509 21.3-107.7 -90.4 168.3 22.0 17.5 5.4 295 299 A A H > S+ 0 0 2 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.939 120.6 49.7 -63.3 -47.3 21.8 14.3 7.6 296 300 A A H > S+ 0 0 51 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.925 114.7 45.5 -56.1 -45.5 19.8 12.4 5.0 297 301 A Q H >4 S+ 0 0 111 1,-0.2 3,-0.8 2,-0.2 4,-0.2 0.917 110.8 52.3 -64.1 -44.9 22.3 13.4 2.3 298 302 A A H >< S+ 0 0 0 -4,-2.8 3,-1.6 1,-0.2 6,-0.3 0.837 100.9 61.2 -63.1 -34.4 25.3 12.6 4.5 299 303 A L H 3< S+ 0 0 0 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.829 103.7 51.7 -59.7 -31.7 24.0 9.1 5.2 300 304 A A T << S+ 0 0 65 -4,-0.8 -1,-0.3 -3,-0.8 -2,-0.2 0.429 85.2 117.1 -84.2 -2.7 24.2 8.4 1.5 301 305 A H S X S- 0 0 22 -3,-1.6 3,-2.0 -4,-0.2 7,-0.1 -0.428 78.1-116.5 -70.3 143.6 27.8 9.6 1.3 302 306 A A G > S+ 0 0 56 1,-0.3 3,-1.9 2,-0.2 4,-0.2 0.725 107.4 74.6 -52.1 -29.1 30.4 6.9 0.2 303 307 A Y G 3 S+ 0 0 5 1,-0.3 3,-0.3 -27,-0.3 -1,-0.3 0.812 100.6 43.2 -55.4 -31.4 32.2 7.1 3.6 304 308 A F G X> S+ 0 0 0 -3,-2.0 4,-3.1 -6,-0.3 3,-2.4 0.171 75.1 125.2-102.5 18.4 29.3 5.1 5.2 305 309 A A T <4 S+ 0 0 77 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.820 73.2 51.5 -45.9 -42.1 29.0 2.5 2.4 306 310 A Q T 34 S+ 0 0 114 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.564 121.6 30.7 -79.7 -8.6 29.4 -0.4 4.8 307 311 A Y T <4 S+ 0 0 64 -3,-2.4 -2,-0.2 -8,-0.1 -1,-0.2 0.672 89.8 110.6-112.4 -30.7 26.7 0.9 7.2 308 312 A H < + 0 0 59 -4,-3.1 -8,-0.1 -7,-0.1 5,-0.1 -0.195 31.6 165.5 -58.5 130.5 24.2 2.7 5.0 309 313 A D > - 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