==== 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 22-DEC-08 3FMM . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.KUGLSTATTER,M.GHATE . 346 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17473.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 222 64.2 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 . 35 10.1 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 . 1 0.3 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 . 29 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 98 28.3 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+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 1 0 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 1 3 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 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 0 241 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 160.8 -3.6 0.9 38.4 2 5 A R - 0 0 92 1,-0.1 3,-0.1 3,-0.0 89,-0.0 -0.725 360.0-128.0 -84.4 126.5 -1.2 3.2 40.3 3 6 A P - 0 0 63 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.207 28.6 -97.9 -65.1 163.3 2.0 1.5 41.4 4 7 A T - 0 0 87 2,-0.0 15,-2.3 1,-0.0 2,-0.3 -0.711 40.5-149.9 -80.9 135.1 3.2 1.8 45.1 5 8 A F E -A 18 0A 26 -2,-0.4 2,-0.3 13,-0.3 11,-0.0 -0.810 7.5-159.0-105.4 147.8 5.8 4.5 45.6 6 9 A Y E -A 17 0A 62 11,-2.6 11,-1.9 -2,-0.3 2,-0.3 -0.956 15.0-125.8-126.0 151.3 8.6 4.5 48.1 7 10 A R E +A 16 0A 160 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.690 31.0 160.5-100.8 147.0 10.6 7.5 49.5 8 11 A Q E -A 15 0A 62 7,-1.7 7,-3.5 -2,-0.3 2,-0.5 -0.969 33.9-127.9-160.1 142.0 14.4 8.0 49.6 9 12 A E E +A 14 0A 146 -2,-0.3 5,-0.2 5,-0.3 -2,-0.0 -0.880 46.0 139.1 -99.2 126.1 16.7 11.0 50.0 10 13 A L + 0 0 37 3,-1.9 2,-0.7 -2,-0.5 -1,-0.1 0.662 67.1 25.4-127.9 -71.1 19.4 11.2 47.2 11 14 A N S S- 0 0 60 2,-0.3 3,-0.1 23,-0.1 25,-0.0 -0.587 124.8 -71.7-106.6 66.5 20.3 14.6 45.7 12 15 A K S S+ 0 0 208 -2,-0.7 2,-0.3 1,-0.2 -3,-0.1 0.511 118.8 85.3 56.0 8.6 19.4 16.8 48.7 13 16 A T S S- 0 0 51 -5,-0.0 -3,-1.9 0, 0.0 2,-0.7 -0.898 87.9-104.4-131.2 160.6 15.7 16.1 47.8 14 17 A I E -A 9 0A 78 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.3 -0.797 33.6-153.9 -88.4 113.1 13.3 13.3 48.6 15 18 A W E -A 8 0A 1 -7,-3.5 -7,-1.7 -2,-0.7 2,-0.5 -0.776 8.3-168.6 -88.3 126.5 12.8 11.0 45.6 16 19 A E E +A 7 0A 45 -2,-0.5 -9,-0.2 -9,-0.2 -11,-0.0 -0.953 21.6 159.6-119.0 107.4 9.5 9.2 45.5 17 20 A V E -A 6 0A 3 -11,-1.9 -11,-2.6 -2,-0.5 -2,-0.0 -0.896 44.4 -87.6-130.1 154.6 9.5 6.5 42.9 18 21 A P E > -A 5 0A 2 0, 0.0 3,-2.0 0, 0.0 -13,-0.3 -0.307 41.7-113.8 -58.0 145.7 7.6 3.3 42.0 19 22 A E T 3 S+ 0 0 109 -15,-2.3 22,-0.1 1,-0.3 -14,-0.1 0.758 109.6 76.1 -50.6 -33.3 8.8 0.0 43.7 20 23 A R T 3 S+ 0 0 53 -16,-0.2 21,-2.9 20,-0.1 2,-0.7 0.803 83.4 75.7 -51.3 -31.4 9.9 -1.3 40.3 21 24 A Y E < +B 40 0B 1 -3,-2.0 2,-0.3 19,-0.2 19,-0.2 -0.774 67.9 170.2 -91.1 116.5 12.9 1.0 40.4 22 25 A Q E +B 39 0B 72 17,-2.4 17,-2.9 -2,-0.7 -2,-0.0 -0.795 46.8 29.3-124.0 161.9 15.5 -0.3 42.8 23 26 A N E S- 0 0 127 -2,-0.3 -1,-0.2 15,-0.2 2,-0.2 0.886 70.9-167.7 56.8 46.7 19.2 0.5 43.7 24 27 A L E + 0 0 12 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.458 11.3 172.9 -67.2 134.3 19.0 4.2 42.9 25 28 A S E -B 37 0B 63 12,-2.1 12,-3.2 -2,-0.2 -15,-0.1 -0.951 33.7-113.8-150.0 120.7 22.4 5.8 42.8 26 29 A P E -B 36 0B 59 0, 0.0 2,-0.3 0, 0.0 10,-0.3 -0.243 38.2-169.1 -55.4 138.5 23.3 9.4 41.7 27 30 A V > + 0 0 48 8,-2.1 3,-0.7 6,-0.1 8,-0.4 -0.924 52.9 32.0-129.8 157.4 25.5 9.6 38.6 28 31 A G G > S- 0 0 29 -2,-0.3 3,-2.3 1,-0.2 5,-0.1 0.427 98.5 -99.9 85.0 1.6 27.5 12.2 36.7 29 32 A S G 3 S- 0 0 136 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 0.821 83.6 -52.3 51.4 36.8 28.6 14.2 39.7 30 33 A G G X S+ 0 0 59 -3,-0.7 3,-0.8 3,-0.3 -1,-0.3 0.255 115.8 115.1 88.3 -10.5 25.8 16.8 38.9 31 34 A A T < S+ 0 0 82 -3,-2.3 -2,-0.1 1,-0.2 -3,-0.1 0.747 80.8 37.8 -64.7 -29.1 26.9 17.2 35.3 32 35 A Y T 3 S- 0 0 80 1,-0.5 2,-0.3 -5,-0.3 -1,-0.2 0.431 119.1-105.1-102.5 -1.3 23.8 15.7 33.8 33 36 A G S < S- 0 0 35 -3,-0.8 2,-1.7 -5,-0.1 -1,-0.5 -0.749 74.2 -20.2 108.4-161.5 21.3 17.2 36.3 34 37 A S S S+ 0 0 33 17,-0.4 17,-2.5 -2,-0.3 2,-0.4 -0.616 90.8 153.5 -82.6 80.6 19.5 15.5 39.1 35 38 A V E - C 0 50B 14 -2,-1.7 -8,-2.1 -8,-0.4 2,-0.4 -0.927 26.6-168.9-121.3 133.8 20.0 12.0 37.6 36 39 A C E -BC 26 49B 0 13,-2.8 13,-3.5 -2,-0.4 2,-0.2 -0.969 19.7-132.5-120.0 140.1 20.1 8.6 39.2 37 40 A A E +BC 25 48B 16 -12,-3.2 -12,-2.1 -2,-0.4 2,-0.3 -0.580 38.9 168.2 -74.8 150.3 21.1 5.2 37.8 38 41 A A E - C 0 47B 7 9,-2.0 9,-2.7 -14,-0.2 2,-0.6 -0.982 38.0-115.5-158.5 162.4 18.6 2.4 38.7 39 42 A F E -BC 22 46B 83 -17,-2.9 -17,-2.4 -2,-0.3 2,-1.0 -0.946 23.2-147.5-105.0 120.9 17.6 -1.1 38.0 40 43 A D E > -B 21 0B 3 5,-2.7 4,-2.7 -2,-0.6 5,-0.5 -0.792 9.8-167.8 -88.6 103.2 14.1 -1.5 36.5 41 44 A T T 4 S+ 0 0 72 -21,-2.9 -1,-0.2 -2,-1.0 -20,-0.1 0.707 82.1 57.9 -65.9 -21.7 12.8 -4.8 37.9 42 45 A K T 4 S+ 0 0 147 -22,-0.2 -1,-0.2 1,-0.1 -21,-0.1 0.892 122.7 19.6 -74.9 -40.4 9.9 -4.9 35.4 43 46 A T T 4 S- 0 0 76 -3,-0.4 -2,-0.2 2,-0.2 -1,-0.1 0.621 95.9-124.6-105.5 -19.3 12.0 -4.7 32.2 44 47 A G < + 0 0 47 -4,-2.7 2,-0.3 1,-0.3 -3,-0.2 0.517 65.1 138.4 81.9 7.4 15.4 -5.8 33.4 45 48 A L - 0 0 63 -5,-0.5 -5,-2.7 -6,-0.0 2,-0.5 -0.601 58.4-128.0 -87.6 142.6 16.9 -2.6 32.0 46 49 A R E -C 39 0B 187 -2,-0.3 59,-2.2 -7,-0.2 2,-0.3 -0.812 44.8-172.6 -80.9 127.1 19.5 -0.5 33.7 47 50 A V E -CD 38 104B 0 -9,-2.7 -9,-2.0 -2,-0.5 2,-0.5 -0.808 29.4-131.7-127.7 160.4 17.9 3.0 33.6 48 51 A A E -CD 37 103B 15 55,-3.0 55,-2.4 -2,-0.3 2,-0.5 -0.975 21.2-159.9-112.9 126.1 18.6 6.7 34.2 49 52 A V E -CD 36 102B 0 -13,-3.5 -13,-2.8 -2,-0.5 2,-0.5 -0.929 4.1-165.2-109.8 123.0 16.0 8.5 36.3 50 53 A K E -CD 35 101B 45 51,-3.2 51,-2.9 -2,-0.5 2,-0.6 -0.934 4.4-159.1-112.2 120.6 15.9 12.3 36.1 51 54 A K E - D 0 100B 11 -17,-2.5 -17,-0.4 -2,-0.5 2,-0.2 -0.880 23.4-125.6 -97.8 124.0 14.0 14.4 38.6 52 55 A L - 0 0 15 47,-2.5 2,-0.6 -2,-0.6 47,-0.3 -0.488 20.8-124.2 -72.5 132.0 13.1 17.9 37.4 53 56 A S S S- 0 0 99 1,-0.2 -1,-0.1 -2,-0.2 45,-0.0 -0.689 77.1 -34.1 -80.7 119.0 14.2 20.7 39.6 54 57 A R S > S- 0 0 157 -2,-0.6 3,-1.0 1,-0.1 -1,-0.2 0.861 75.8-172.3 33.9 71.8 11.4 23.0 40.7 55 58 A P T 3 S+ 0 0 2 0, 0.0 10,-0.4 0, 0.0 11,-0.2 0.638 73.0 37.1 -75.3 -16.2 9.6 22.5 37.3 56 59 A F T 3 S+ 0 0 18 41,-0.2 -2,-0.1 1,-0.1 277,-0.1 -0.077 74.3 118.3-126.1 34.9 6.8 25.1 37.8 57 60 A Q S < S+ 0 0 87 -3,-1.0 2,-0.3 1,-0.0 -1,-0.1 0.758 84.6 5.2 -75.3 -26.8 8.5 28.0 39.7 58 61 A S S > S- 0 0 34 -3,-0.1 4,-2.7 1,-0.1 5,-0.2 -0.907 80.0-100.1-145.1 171.9 7.9 30.5 36.9 59 62 A I H > S+ 0 0 82 -2,-0.3 4,-2.2 2,-0.2 5,-0.2 0.932 123.9 50.0 -58.3 -46.8 6.2 30.9 33.5 60 63 A I H > S+ 0 0 131 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.897 114.4 43.5 -60.6 -44.4 9.6 30.3 31.8 61 64 A H H > S+ 0 0 65 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.895 111.6 52.9 -70.1 -41.7 10.4 27.2 33.8 62 65 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.885 112.1 46.0 -61.0 -40.0 6.8 25.7 33.5 63 66 A K H X S+ 0 0 34 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.875 111.1 52.3 -68.8 -39.9 7.0 26.1 29.7 64 67 A R H X S+ 0 0 129 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.863 108.9 51.0 -62.6 -39.3 10.5 24.6 29.7 65 68 A T H X S+ 0 0 9 -4,-2.3 4,-2.1 -10,-0.4 -2,-0.2 0.941 112.0 46.1 -63.6 -48.9 9.2 21.6 31.7 66 69 A Y H X S+ 0 0 10 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.912 112.2 52.7 -57.5 -46.5 6.4 21.1 29.2 67 70 A R H X S+ 0 0 43 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.925 109.0 47.4 -56.1 -52.9 8.8 21.5 26.3 68 71 A E H X S+ 0 0 13 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.904 114.0 47.6 -58.4 -43.4 11.3 18.8 27.6 69 72 A L H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.931 112.3 48.9 -65.1 -45.3 8.4 16.4 28.2 70 73 A R H X S+ 0 0 37 -4,-2.8 4,-1.3 2,-0.2 -2,-0.2 0.918 114.1 47.2 -56.1 -46.7 6.9 17.0 24.8 71 74 A L H X S+ 0 0 4 -4,-2.7 4,-1.6 1,-0.2 3,-0.4 0.946 113.8 45.5 -62.6 -51.2 10.3 16.5 23.2 72 75 A L H < S+ 0 0 20 -4,-2.8 11,-0.8 1,-0.2 -1,-0.2 0.861 111.1 53.9 -62.7 -37.1 11.2 13.3 25.1 73 76 A K H < S+ 0 0 39 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.791 110.0 48.3 -66.7 -29.2 7.7 11.8 24.5 74 77 A H H < S+ 0 0 33 -4,-1.3 2,-0.7 -3,-0.4 242,-0.2 0.839 88.3 93.1 -78.7 -35.3 8.0 12.3 20.7 75 78 A M < + 0 0 3 -4,-1.6 8,-0.5 6,-0.1 2,-0.4 -0.493 39.1 159.9 -76.3 109.2 11.5 10.8 20.2 76 79 A K + 0 0 162 -2,-0.7 2,-0.3 6,-0.1 -1,-0.1 -0.750 32.1 115.0-128.0 81.1 11.3 7.1 19.3 77 80 A H > - 0 0 21 3,-0.5 3,-1.6 -2,-0.4 57,-0.0 -0.992 68.0-123.6-154.1 141.2 14.6 6.3 17.7 78 81 A E T 3 S+ 0 0 129 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.787 112.2 43.9 -53.6 -36.4 17.6 4.1 18.4 79 82 A N T 3 S+ 0 0 6 83,-0.1 84,-2.1 51,-0.1 2,-0.4 0.207 104.9 73.4-100.8 15.0 20.1 7.0 18.3 80 83 A V B < S-f 163 0C 2 -3,-1.6 -3,-0.5 82,-0.3 2,-0.2 -0.996 87.6-109.1-133.2 131.6 18.1 9.5 20.3 81 84 A I + 0 0 9 82,-2.3 2,-0.2 -2,-0.4 -6,-0.1 -0.414 50.4 172.9 -57.2 121.7 17.3 9.6 24.0 82 85 A G - 0 0 14 -2,-0.2 2,-0.6 -4,-0.1 22,-0.2 -0.644 33.7 -83.6-125.7-174.7 13.7 8.7 24.5 83 86 A L + 0 0 20 -11,-0.8 20,-0.2 -8,-0.5 3,-0.1 -0.835 31.6 169.0-105.6 114.7 11.2 7.9 27.3 84 87 A L S S- 0 0 26 18,-2.9 2,-0.3 -2,-0.6 19,-0.2 0.748 80.1 -10.3 -80.4 -31.9 10.9 4.5 28.8 85 88 A D E -E 102 0B 23 17,-1.3 17,-2.8 260,-0.1 -1,-0.4 -0.979 52.9-166.5-162.5 152.9 8.7 5.9 31.6 86 89 A V E +E 101 0B 7 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.957 24.9 165.1-143.2 135.6 7.5 9.2 33.1 87 90 A F E -E 100 0B 14 13,-1.8 13,-1.9 -2,-0.3 254,-0.1 -0.970 26.0-162.5-148.8 161.7 5.7 9.4 36.5 88 91 A T - 0 0 13 -2,-0.3 11,-0.1 2,-0.2 8,-0.1 -0.981 24.6-137.9-140.1 139.8 4.6 11.6 39.4 89 92 A P S S+ 0 0 20 0, 0.0 2,-0.1 0, 0.0 -84,-0.1 0.548 74.0 113.6 -69.4 -7.7 3.6 10.4 42.9 90 93 A A - 0 0 14 8,-0.2 -2,-0.2 1,-0.1 3,-0.1 -0.388 54.6-161.9 -70.8 141.6 0.7 12.8 42.7 91 94 A R S S+ 0 0 170 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.560 75.1 20.1 -97.0 -13.4 -2.9 11.5 42.5 92 95 A S S > S- 0 0 31 1,-0.1 4,-1.2 0, 0.0 3,-0.5 -0.952 82.5-102.5-149.0 166.2 -4.4 14.7 41.1 93 96 A L T 4 S+ 0 0 51 -2,-0.3 3,-0.3 1,-0.2 -1,-0.1 0.875 119.9 56.6 -57.5 -40.3 -3.5 17.9 39.3 94 97 A E T 4 S+ 0 0 161 1,-0.2 -1,-0.2 -3,-0.0 -4,-0.0 0.817 110.5 43.6 -64.4 -31.3 -3.6 19.9 42.6 95 98 A E T 4 S+ 0 0 113 -3,-0.5 -1,-0.2 2,-0.0 -2,-0.2 0.681 89.1 114.5 -80.7 -22.8 -1.0 17.6 44.1 96 99 A F < + 0 0 2 -4,-1.2 3,-0.1 -3,-0.3 241,-0.1 -0.317 21.7 124.7 -62.7 119.4 1.2 17.6 41.0 97 100 A N + 0 0 95 1,-0.3 2,-0.4 -2,-0.2 -41,-0.2 0.368 57.3 60.9-152.9 -4.3 4.6 19.3 41.6 98 101 A D - 0 0 47 -44,-0.1 2,-0.4 -43,-0.1 -1,-0.3 -0.990 54.5-162.6-133.6 143.4 7.3 16.8 40.6 99 102 A V - 0 0 0 -2,-0.4 -47,-2.5 -47,-0.3 2,-0.4 -0.991 3.7-166.5-125.9 130.0 8.2 15.1 37.3 100 103 A Y E -DE 51 87B 1 -13,-1.9 -13,-1.8 -2,-0.4 2,-0.4 -0.971 5.6-162.0-118.3 130.4 10.4 12.1 36.9 101 104 A L E -DE 50 86B 8 -51,-2.9 -51,-3.2 -2,-0.4 2,-0.5 -0.924 2.3-159.4-116.5 134.3 11.8 11.0 33.5 102 105 A V E +DE 49 85B 1 -17,-2.8 -18,-2.9 -2,-0.4 -17,-1.3 -0.944 21.1 149.9-120.1 126.8 13.2 7.5 32.8 103 106 A T E -D 48 0B 19 -55,-2.4 -55,-3.0 -2,-0.5 -20,-0.1 -0.798 51.6 -62.7-136.4 179.6 15.5 6.5 29.9 104 107 A H E -D 47 0B 63 -57,-0.2 2,-0.6 -2,-0.2 -57,-0.3 -0.404 49.3-120.7 -63.8 141.0 18.3 4.0 29.2 105 108 A L - 0 0 59 -59,-2.2 2,-0.4 -67,-0.1 -59,-0.1 -0.779 29.4-163.7 -83.4 121.3 21.4 4.1 31.3 106 109 A M - 0 0 30 -2,-0.6 50,-0.2 1,-0.1 49,-0.1 -0.882 20.3-129.8-108.7 141.5 24.4 4.7 29.0 107 110 A G S S- 0 0 64 -2,-0.4 2,-0.3 47,-0.1 49,-0.2 0.796 74.2 -19.2 -62.8 -36.3 27.9 4.1 30.4 108 111 A A E -G 155 0C 34 47,-1.8 47,-3.0 3,-0.0 2,-0.3 -0.937 62.5-101.2-158.2 172.4 29.6 7.3 29.4 109 112 A D E > -G 154 0C 10 -2,-0.3 4,-0.7 45,-0.3 3,-0.4 -0.745 39.2-110.5-102.0 161.9 29.6 10.4 27.2 110 113 A L H >> S+ 0 0 0 43,-2.4 4,-2.7 40,-1.2 3,-0.9 0.854 114.2 61.3 -60.0 -37.4 31.7 10.8 24.1 111 114 A N H 3> S+ 0 0 63 39,-0.5 4,-1.1 1,-0.3 -1,-0.2 0.911 103.5 48.3 -55.8 -48.2 33.9 13.5 25.8 112 115 A N H 34 S+ 0 0 107 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.655 115.8 47.5 -69.1 -14.9 35.1 11.1 28.5 113 116 A I H << S+ 0 0 58 -3,-0.9 -2,-0.2 -4,-0.7 -1,-0.2 0.889 101.3 58.2 -89.5 -47.9 35.9 8.5 25.8 114 117 A V H >< S+ 0 0 4 -4,-2.7 3,-2.6 2,-0.1 -2,-0.2 0.781 76.6 179.1 -60.5 -32.0 37.8 10.4 23.2 115 118 A K T 3< - 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0 0 36 -2,-0.4 -9,-0.1 1,-0.1 -33,-0.0 -0.371 29.8-145.7 -53.0 131.9 39.6 20.3 19.4 217 222 A L S S+ 0 0 33 -11,-0.3 -1,-0.1 1,-0.2 -34,-0.1 0.952 89.8 15.2 -69.9 -52.5 39.0 21.7 15.9 218 223 A F + 0 0 4 -36,-0.3 2,-2.2 2,-0.1 -1,-0.2 -0.605 69.9 172.9-123.5 72.2 38.3 25.4 17.0 219 224 A P - 0 0 39 0, 0.0 -40,-0.1 0, 0.0 -3,-0.0 -0.373 19.4-176.7 -78.9 66.6 39.5 25.8 20.6 220 225 A G - 0 0 0 -2,-2.2 -42,-0.4 1,-0.1 -39,-0.1 -0.290 31.0-143.8 -67.2 145.5 38.9 29.6 20.8 221 226 A T S S- 0 0 72 -44,-0.2 2,-0.3 1,-0.1 -44,-0.1 0.613 85.0 -11.2 -81.1 -15.1 39.9 31.5 23.9 222 227 A D S > S- 0 0 64 -47,-0.1 4,-2.6 -46,-0.1 5,-0.2 -0.928 89.5 -77.1-165.4 179.3 36.8 33.7 23.3 223 228 A H H > S+ 0 0 57 -2,-0.3 4,-2.0 2,-0.2 5,-0.1 0.898 128.3 44.2 -54.6 -45.9 34.1 34.5 20.6 224 229 A I H > S+ 0 0 62 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.925 113.3 48.9 -69.8 -48.0 36.5 36.6 18.5 225 230 A D H > S+ 0 0 51 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.904 112.1 51.1 -56.5 -43.0 39.5 34.2 18.8 226 231 A Q H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.902 106.9 52.4 -62.7 -42.8 37.2 31.4 17.8 227 232 A L H X S+ 0 0 0 -4,-2.0 4,-3.0 1,-0.2 -1,-0.2 0.906 108.6 51.5 -59.4 -41.0 35.8 33.2 14.8 228 233 A K H X S+ 0 0 109 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.874 109.3 49.5 -65.5 -37.7 39.4 33.8 13.6 229 234 A L H X S+ 0 0 63 -4,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.921 113.4 47.6 -64.9 -44.5 40.2 30.1 13.9 230 235 A I H >X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 3,-0.6 0.949 112.4 47.7 -58.0 -51.9 37.1 29.2 12.0 231 236 A L H 3X S+ 0 0 0 -4,-3.0 4,-1.8 1,-0.3 -1,-0.2 0.780 104.3 60.3 -69.3 -28.1 37.8 31.8 9.2 232 237 A R H 3< S+ 0 0 156 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.870 114.0 37.2 -64.1 -37.5 41.4 30.7 8.7 233 238 A L H << S+ 0 0 9 -4,-1.2 30,-2.8 -3,-0.6 -2,-0.2 0.948 130.2 27.2 -77.4 -51.3 40.2 27.2 7.9 234 239 A V H < S- 0 0 20 -4,-2.5 28,-0.3 28,-0.2 52,-0.2 0.507 109.5-115.1 -97.1 -4.0 37.1 27.9 5.8 235 240 A G < - 0 0 4 -4,-1.8 -1,-0.2 26,-0.4 -3,-0.1 0.095 38.1 -65.0 87.3 155.4 37.9 31.4 4.5 236 241 A T - 0 0 25 24,-2.0 26,-0.1 1,-0.1 50,-0.1 -0.414 69.5 -85.2 -70.5 152.6 36.3 34.8 5.1 237 242 A P - 0 0 10 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.261 40.6-135.0 -62.1 147.9 32.7 35.1 3.8 238 243 A G > - 0 0 44 -3,-0.1 4,-2.2 1,-0.0 5,-0.1 -0.334 35.8 -88.2 -88.9 179.7 32.0 36.1 0.2 239 244 A A H > S+ 0 0 75 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.855 123.0 57.6 -59.9 -39.8 29.5 38.7 -0.9 240 245 A E H > S+ 0 0 95 1,-0.2 4,-0.8 2,-0.2 3,-0.2 0.942 111.2 39.9 -58.5 -53.5 26.6 36.2 -1.1 241 246 A L H >> S+ 0 0 10 1,-0.2 3,-1.0 2,-0.2 4,-0.8 0.903 108.9 62.5 -63.1 -42.3 26.9 35.1 2.5 242 247 A L H >< S+ 0 0 37 -4,-2.2 3,-1.0 1,-0.3 -1,-0.2 0.867 99.9 54.2 -50.9 -43.3 27.5 38.7 3.6 243 248 A K H 3< S+ 0 0 167 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.831 103.2 57.8 -57.5 -34.8 24.1 39.8 2.3 244 249 A K H << S+ 0 0 59 -3,-1.0 2,-1.2 -4,-0.8 -1,-0.2 0.623 78.8 96.8 -77.6 -15.1 22.5 37.0 4.4 245 250 A I << - 0 0 0 -3,-1.0 -52,-0.2 -4,-0.8 6,-0.1 -0.668 54.7-175.7 -75.7 98.4 23.9 38.4 7.7 246 251 A S + 0 0 84 -2,-1.2 2,-1.0 -54,-0.7 -1,-0.2 0.745 59.8 90.1 -71.2 -25.8 20.8 40.4 8.8 247 252 A S > - 0 0 42 -55,-1.7 4,-2.8 1,-0.2 5,-0.2 -0.657 63.5-163.2 -74.8 103.2 22.6 41.8 11.8 248 253 A E H > S+ 0 0 143 -2,-1.0 4,-2.4 1,-0.2 -1,-0.2 0.858 89.2 54.9 -55.0 -39.9 24.1 45.1 10.4 249 254 A S H > S+ 0 0 97 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.933 111.7 41.7 -58.9 -51.1 26.5 45.2 13.4 250 255 A A H > S+ 0 0 14 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.899 113.5 53.4 -64.5 -43.2 27.9 41.7 12.8 251 256 A R H X S+ 0 0 71 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.900 108.3 50.8 -58.5 -43.9 28.1 42.2 9.0 252 257 A N H < S+ 0 0 112 -4,-2.4 4,-0.4 -5,-0.2 -1,-0.2 0.830 110.1 49.0 -65.2 -35.9 30.1 45.4 9.5 253 258 A Y H >< S+ 0 0 73 -4,-1.5 3,-1.5 2,-0.2 4,-0.3 0.920 106.9 55.2 -69.6 -44.7 32.6 43.7 11.8 254 259 A I H >< S+ 0 0 7 -4,-2.4 3,-1.4 1,-0.3 -2,-0.2 0.879 103.8 55.9 -53.0 -42.0 33.1 40.8 9.4 255 260 A Q T 3< S+ 0 0 126 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.650 96.1 66.1 -66.2 -17.9 34.0 43.3 6.6 256 261 A S T < S+ 0 0 80 -3,-1.5 2,-0.3 -4,-0.4 -1,-0.3 0.553 84.7 93.4 -82.7 -9.0 36.8 44.7 8.9 257 262 A L S < S- 0 0 36 -3,-1.4 2,-0.1 -4,-0.3 3,-0.1 -0.641 87.1-105.3 -89.2 142.7 38.8 41.5 8.7 258 263 A T - 0 0 124 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.1 -0.437 45.8-105.5 -63.8 133.0 41.5 40.8 6.2 259 264 A Q - 0 0 162 -2,-0.1 -1,-0.1 -4,-0.1 -4,-0.0 -0.365 40.2-171.9 -66.7 138.9 40.2 38.4 3.5 260 265 A M - 0 0 66 -29,-0.1 -24,-2.0 -3,-0.1 2,-0.2 -0.993 18.0-126.4-133.0 139.2 41.6 34.8 3.7 261 266 A P - 0 0 111 0, 0.0 -26,-0.4 0, 0.0 2,-0.1 -0.503 38.4 -90.2 -81.6 155.6 41.1 31.9 1.3 262 267 A K - 0 0 102 -28,-0.3 -28,-0.2 -2,-0.2 -29,-0.1 -0.386 47.6-123.3 -56.6 135.5 39.8 28.5 2.3 263 268 A M - 0 0 63 -30,-2.8 2,-0.8 -31,-0.2 -1,-0.1 -0.364 25.7 -97.6 -78.9 164.0 42.6 26.2 3.4 264 269 A N >> - 0 0 90 1,-0.2 3,-1.2 -2,-0.1 4,-1.0 -0.767 29.7-156.8 -83.5 110.5 43.3 22.8 1.8 265 270 A F H 3> S+ 0 0 2 -2,-0.8 4,-3.1 1,-0.3 -1,-0.2 0.790 90.9 61.6 -63.4 -30.2 41.6 20.2 4.1 266 271 A A H 34 S+ 0 0 52 1,-0.2 -1,-0.3 2,-0.2 5,-0.2 0.815 107.1 45.8 -62.9 -31.5 44.0 17.4 3.0 267 272 A N H <4 S+ 0 0 115 -3,-1.2 3,-0.4 1,-0.1 -1,-0.2 0.683 114.6 48.5 -82.4 -19.2 46.9 19.5 4.3 268 273 A V H < S+ 0 0 48 -4,-1.0 2,-0.6 1,-0.2 -2,-0.2 0.874 116.8 40.0 -83.8 -42.5 44.9 20.2 7.5 269 274 A F S >< S- 0 0 12 -4,-3.1 3,-1.6 -5,-0.1 -1,-0.2 -0.535 86.0-166.7-109.1 64.6 43.9 16.6 8.2 270 275 A I T 3 + 0 0 136 -2,-0.6 -3,-0.1 -3,-0.4 3,-0.1 -0.258 69.7 7.6 -56.8 126.2 47.1 14.8 7.2 271 276 A G T 3 S+ 0 0 82 1,-0.3 -1,-0.2 -5,-0.2 -4,-0.1 0.190 93.6 135.5 90.9 -15.0 46.8 11.0 6.8 272 277 A A S < S- 0 0 27 -3,-1.6 -1,-0.3 -6,-0.2 -3,-0.1 -0.273 70.7 -84.0 -66.5 149.9 43.0 11.0 7.1 273 278 A N >> - 0 0 44 1,-0.1 4,-2.0 -3,-0.1 3,-0.8 -0.335 36.8-131.4 -48.3 123.9 40.7 8.9 4.8 274 279 A P H 3> S+ 0 0 103 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.769 108.7 56.1 -55.5 -28.0 40.2 11.1 1.7 275 280 A L H 3> S+ 0 0 72 2,-0.2 4,-2.1 1,-0.2 27,-0.3 0.834 105.2 50.7 -70.4 -36.5 36.4 10.3 2.0 276 281 A A H <> S+ 0 0 0 -3,-0.8 4,-2.7 2,-0.2 -1,-0.2 0.906 110.1 50.7 -64.7 -43.6 36.4 11.7 5.5 277 282 A V H X S+ 0 0 12 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.933 109.2 50.9 -58.1 -49.7 38.2 14.9 4.3 278 283 A D H X S+ 0 0 54 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.917 111.9 46.7 -55.1 -48.2 35.6 15.3 1.5 279 284 A L H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 3,-0.3 0.925 109.5 53.4 -62.8 -45.9 32.7 15.0 4.0 280 285 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.892 107.5 52.7 -54.5 -41.6 34.4 17.4 6.5 281 286 A E H < S+ 0 0 57 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.848 110.8 47.0 -61.7 -35.9 34.6 19.9 3.6 282 287 A K H < S+ 0 0 93 -4,-1.5 10,-1.9 -3,-0.3 3,-0.3 0.749 116.8 43.1 -80.2 -25.3 30.9 19.5 2.9 283 288 A M H < S+ 0 0 0 -4,-1.9 2,-1.0 8,-0.2 -2,-0.2 0.848 107.7 58.6 -84.2 -39.8 29.9 19.9 6.6 284 289 A L S < S+ 0 0 4 -4,-2.7 2,-0.4 -5,-0.2 -1,-0.2 -0.397 70.8 139.0 -95.5 55.9 32.2 22.8 7.4 285 290 A V - 0 0 43 -2,-1.0 6,-0.1 -3,-0.3 5,-0.1 -0.857 50.6-141.4 -99.0 134.4 30.8 25.3 4.9 286 291 A L S S+ 0 0 14 -2,-0.4 2,-0.6 -52,-0.2 -99,-0.2 0.923 88.0 71.5 -64.1 -47.5 30.5 28.8 6.2 287 292 A D S > S- 0 0 11 1,-0.2 3,-1.5 -3,-0.1 4,-0.4 -0.623 74.2-154.9 -71.4 113.3 27.2 29.6 4.4 288 293 A S G > S+ 0 0 4 -2,-0.6 3,-0.9 1,-0.3 -1,-0.2 0.778 89.5 65.2 -65.1 -30.0 24.7 27.4 6.2 289 294 A D G 3 S+ 0 0 100 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.1 0.723 105.7 46.6 -58.3 -23.8 22.4 27.3 3.1 290 295 A K G < S+ 0 0 118 -3,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.427 84.7 112.8-107.7 -1.9 25.1 25.3 1.4 291 296 A R S < S- 0 0 8 -3,-0.9 -8,-0.2 -4,-0.4 -9,-0.1 -0.377 76.5-100.7 -64.7 147.8 26.1 22.7 4.2 292 297 A I - 0 0 18 -10,-1.9 2,-0.2 -13,-0.2 -1,-0.1 -0.408 38.4-128.1 -63.1 145.6 25.3 19.1 3.6 293 298 A T > - 0 0 49 1,-0.1 4,-2.8 -2,-0.1 5,-0.2 -0.494 20.4-109.5 -89.9 168.3 22.1 17.8 5.3 294 299 A A H > S+ 0 0 2 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.937 120.3 50.3 -63.0 -47.5 21.9 14.8 7.6 295 300 A A H > S+ 0 0 52 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.907 114.6 44.5 -56.1 -45.0 19.9 12.8 5.0 296 301 A Q H >4 S+ 0 0 112 1,-0.2 3,-0.8 2,-0.2 -2,-0.2 0.908 110.7 53.9 -65.6 -43.5 22.5 13.7 2.3 297 302 A A H >< S+ 0 0 0 -4,-2.8 3,-1.6 1,-0.2 6,-0.2 0.830 99.7 61.5 -62.9 -34.2 25.5 12.9 4.6 298 303 A L H 3< S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.818 103.5 51.1 -60.5 -31.3 24.2 9.4 5.3 299 304 A A T << S+ 0 0 63 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.361 84.8 117.8 -88.1 2.0 24.4 8.6 1.6 300 305 A H S X S- 0 0 23 -3,-1.6 3,-2.3 -4,-0.2 7,-0.1 -0.484 78.7-115.7 -72.4 143.6 28.1 9.9 1.4 301 306 A A G > S+ 0 0 56 1,-0.3 3,-1.6 2,-0.2 4,-0.2 0.678 108.5 75.0 -55.3 -22.0 30.6 7.2 0.4 302 307 A Y G 3 S+ 0 0 3 1,-0.3 -1,-0.3 -27,-0.3 3,-0.3 0.782 99.0 45.4 -60.7 -28.3 32.3 7.5 3.8 303 308 A F G X> S+ 0 0 0 -3,-2.3 4,-3.3 -6,-0.2 3,-1.7 0.054 73.9 125.6-105.4 25.2 29.4 5.6 5.3 304 309 A A T <4 S+ 0 0 78 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.841 74.0 49.7 -52.0 -41.2 29.2 2.8 2.7 305 310 A Q T 34 S+ 0 0 120 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.572 122.9 30.6 -80.1 -8.1 29.5 -0.0 5.2 306 311 A Y T <4 S+ 0 0 58 -3,-1.7 -2,-0.2 -8,-0.1 -1,-0.2 0.675 89.4 109.0-115.2 -30.9 26.8 1.4 7.5 307 312 A H < + 0 0 64 -4,-3.3 -8,-0.1 -7,-0.1 5,-0.1 -0.239 30.3 162.3 -60.1 132.8 24.3 3.2 5.2 308 313 A D > - 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