==== 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 3FMH . 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) . 17216.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 227 65.4 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 . 29 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 0 2 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 2 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 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 0 234 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-174.6 -3.4 0.8 38.9 2 5 A R - 0 0 87 1,-0.1 3,-0.0 89,-0.0 89,-0.0 -0.580 360.0-130.6 -73.9 129.3 -1.1 3.1 40.8 3 6 A P - 0 0 64 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.296 28.5 -96.7 -70.0 165.3 2.2 1.5 42.0 4 7 A T - 0 0 86 -2,-0.0 15,-2.3 1,-0.0 2,-0.3 -0.730 40.4-150.0 -83.9 132.3 3.4 1.9 45.6 5 8 A F E -A 18 0A 26 -2,-0.4 2,-0.3 13,-0.2 11,-0.1 -0.727 8.5-161.7-102.0 151.2 6.0 4.6 46.1 6 9 A Y E -A 17 0A 62 11,-2.5 11,-1.9 -2,-0.3 2,-0.3 -0.964 15.1-124.6-132.2 154.5 8.8 4.8 48.6 7 10 A R E +A 16 0A 168 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.687 29.8 160.8-105.3 150.4 10.9 7.7 49.9 8 11 A Q E -A 15 0A 63 7,-1.4 7,-3.5 -2,-0.3 2,-0.5 -0.947 34.5-126.2-164.3 137.8 14.7 8.3 50.0 9 12 A E E +A 14 0A 146 -2,-0.3 5,-0.2 5,-0.3 3,-0.0 -0.835 48.0 138.6 -93.6 125.2 17.0 11.3 50.3 10 13 A L + 0 0 38 3,-2.2 2,-1.4 -2,-0.5 -1,-0.1 0.560 63.7 27.2-127.5 -83.5 19.5 11.5 47.5 11 14 A N S S- 0 0 48 2,-0.2 3,-0.1 1,-0.1 23,-0.1 -0.548 126.8 -69.1 -92.6 69.5 20.5 14.8 45.7 12 15 A K S S+ 0 0 201 -2,-1.4 2,-0.3 1,-0.2 -1,-0.1 0.457 121.0 79.9 61.1 3.4 19.7 17.1 48.7 13 16 A T S S- 0 0 64 -5,-0.1 -3,-2.2 0, 0.0 2,-0.7 -0.855 89.6 -98.6-133.7 164.7 16.0 16.3 48.1 14 17 A I E -A 9 0A 80 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.3 -0.802 34.3-155.9 -89.2 114.5 13.5 13.5 48.9 15 18 A W E -A 8 0A 2 -7,-3.5 -7,-1.4 -2,-0.7 2,-0.6 -0.821 6.6-167.6 -89.7 123.5 13.1 11.2 45.9 16 19 A E E +A 7 0A 35 -2,-0.5 -9,-0.2 -9,-0.2 -11,-0.0 -0.946 21.3 160.2-115.3 109.6 9.7 9.4 45.9 17 20 A V E -A 6 0A 3 -11,-1.9 -11,-2.5 -2,-0.6 -2,-0.0 -0.881 43.8 -87.5-130.4 155.1 9.7 6.5 43.3 18 21 A P E > -A 5 0A 2 0, 0.0 3,-2.0 0, 0.0 -13,-0.2 -0.314 42.6-112.7 -59.4 147.6 7.8 3.3 42.5 19 22 A E T 3 S+ 0 0 107 -15,-2.3 22,-0.1 1,-0.3 -14,-0.1 0.744 109.6 76.0 -52.1 -32.1 9.0 0.2 44.3 20 23 A R T 3 S+ 0 0 57 -16,-0.2 21,-2.9 20,-0.1 2,-0.7 0.787 83.1 75.7 -53.8 -31.2 10.1 -1.3 40.9 21 24 A Y E < +B 40 0B 3 -3,-2.0 2,-0.2 19,-0.2 19,-0.2 -0.776 68.0 171.4 -90.2 115.6 13.1 1.0 41.0 22 25 A Q E +B 39 0B 74 17,-2.6 17,-3.0 -2,-0.7 -2,-0.0 -0.755 46.4 29.4-122.0 164.3 15.8 -0.2 43.4 23 26 A N E S- 0 0 125 -2,-0.2 2,-0.2 15,-0.2 -1,-0.2 0.886 71.4-164.2 55.4 49.2 19.4 0.7 44.3 24 27 A L E + 0 0 12 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.463 12.7 174.9 -68.2 129.5 19.2 4.4 43.4 25 28 A S E -B 37 0B 68 12,-2.5 12,-3.4 -2,-0.2 -15,-0.1 -0.983 33.0-111.6-142.9 124.4 22.6 6.0 43.1 26 29 A P E +B 36 0B 61 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.260 32.2 172.6 -54.3 134.2 23.5 9.6 42.1 27 30 A V E - 0 0 83 8,-2.5 2,-0.2 1,-0.4 9,-0.2 0.223 51.7 -88.9-128.6 10.4 25.3 9.9 38.7 28 31 A G E -B 35 0B 41 7,-0.7 7,-3.2 2,-0.0 -1,-0.4 -0.675 58.3 -38.3 116.9-168.5 25.4 13.6 38.2 29 32 A S E -B 34 0B 113 5,-0.3 5,-0.3 -2,-0.2 2,-0.2 -0.676 43.5-174.4-100.0 149.1 23.3 16.4 36.7 30 33 A G E > -B 33 0B 29 3,-3.6 3,-1.2 -2,-0.3 2,-0.5 -0.581 52.1 -48.8-119.6-171.1 21.2 16.4 33.5 31 34 A A T 3 S- 0 0 18 1,-0.3 134,-0.1 -2,-0.2 -1,-0.0 -0.523 123.7 -15.3 -65.7 114.9 19.3 19.1 31.7 32 35 A Y T 3 S+ 0 0 75 -2,-0.5 21,-1.9 20,-0.1 2,-0.3 0.646 133.4 37.8 66.0 21.0 17.2 20.9 34.3 33 36 A G E < S-BC 30 52B 9 -3,-1.2 -3,-3.6 19,-0.3 2,-0.3 -0.978 83.6 -88.8-178.2 171.9 17.6 18.2 37.0 34 37 A S E -BC 29 51B 29 17,-1.2 17,-1.8 -2,-0.3 2,-0.4 -0.723 35.9-137.3 -98.2 151.5 19.8 15.6 38.7 35 38 A V E -BC 28 50B 24 -7,-3.2 -8,-2.5 -2,-0.3 -7,-0.7 -0.886 13.6-169.0-114.3 135.4 20.1 12.0 37.5 36 39 A C E -BC 26 49B 0 13,-2.8 13,-3.4 -2,-0.4 2,-0.3 -0.962 19.2-134.0-114.9 140.8 20.2 8.8 39.6 37 40 A A E +BC 25 48B 14 -12,-3.4 -12,-2.5 -2,-0.4 2,-0.3 -0.667 36.2 168.9 -81.6 148.8 21.2 5.3 38.2 38 41 A A E - C 0 47B 7 9,-2.1 9,-2.9 -2,-0.3 2,-0.6 -0.980 37.9-113.7-155.1 162.0 18.8 2.6 39.3 39 42 A F E -BC 22 46B 78 -17,-3.0 -17,-2.6 -2,-0.3 2,-1.0 -0.931 24.5-148.1-102.7 119.4 17.8 -1.1 38.7 40 43 A D E >>> -BC 21 45B 2 5,-2.8 4,-2.6 -2,-0.6 5,-0.6 -0.776 8.7-167.1 -87.2 104.2 14.4 -1.5 37.2 41 44 A T T 345S+ 0 0 77 -21,-2.9 -1,-0.2 -2,-1.0 -20,-0.1 0.669 83.1 57.8 -68.1 -17.3 13.1 -4.8 38.6 42 45 A K T 345S+ 0 0 151 -22,-0.2 -1,-0.2 1,-0.1 -21,-0.1 0.860 122.5 20.9 -79.2 -36.8 10.2 -4.9 36.1 43 46 A T T <45S- 0 0 72 -3,-0.5 -2,-0.2 2,-0.2 -1,-0.1 0.588 96.1-126.3-106.7 -17.0 12.4 -4.8 32.9 44 47 A G T <5 + 0 0 46 -4,-2.6 2,-0.2 1,-0.3 -3,-0.2 0.565 65.8 135.2 77.2 10.4 15.8 -5.9 34.3 45 48 A L E < -C 40 0B 62 -5,-0.6 -5,-2.8 -6,-0.0 2,-0.5 -0.595 61.9-124.0 -91.8 149.1 17.4 -2.8 32.8 46 49 A R E -C 39 0B 174 -2,-0.2 59,-2.1 -7,-0.2 2,-0.3 -0.836 45.0-168.9 -83.2 126.7 19.8 -0.4 34.4 47 50 A V E -CD 38 104B 0 -9,-2.9 -9,-2.1 -2,-0.5 2,-0.5 -0.828 27.2-133.4-123.7 156.4 18.1 3.0 34.1 48 51 A A E -CD 37 103B 13 55,-3.2 55,-2.6 -2,-0.3 2,-0.5 -0.962 22.4-164.2-106.6 124.7 18.7 6.7 34.5 49 52 A V E -CD 36 102B 1 -13,-3.4 -13,-2.8 -2,-0.5 2,-0.5 -0.950 2.0-165.1-111.9 120.1 16.1 8.5 36.5 50 53 A K E -CD 35 101B 20 51,-3.3 51,-2.9 -2,-0.5 2,-0.6 -0.924 5.6-161.2-108.8 122.0 16.0 12.4 36.3 51 54 A K E -CD 34 100B 16 -17,-1.8 -17,-1.2 -2,-0.5 49,-0.2 -0.912 23.0-131.4 -97.6 118.3 14.0 14.4 38.9 52 55 A L E -C 33 0B 4 47,-2.1 2,-0.5 -2,-0.6 47,-0.3 -0.469 17.5-128.7 -67.9 135.5 13.3 17.9 37.5 53 56 A S S S- 0 0 61 -21,-1.9 4,-0.2 1,-0.3 -1,-0.1 -0.791 81.2 -17.7 -90.3 129.1 14.2 20.7 39.9 54 57 A R S > S- 0 0 165 -2,-0.5 3,-1.1 1,-0.1 -1,-0.3 0.923 75.0-179.0 37.9 68.8 11.4 23.3 40.4 55 58 A P T 3 S+ 0 0 2 0, 0.0 10,-0.4 0, 0.0 11,-0.2 0.717 78.9 33.3 -69.3 -21.0 9.5 22.2 37.3 56 59 A F T 3 S+ 0 0 18 41,-0.3 -2,-0.1 1,-0.1 278,-0.1 -0.122 78.1 121.8-127.0 36.0 6.8 24.8 37.7 57 60 A Q S < S- 0 0 119 -3,-1.1 2,-0.2 -4,-0.2 -1,-0.1 0.885 85.0 -9.5 -65.3 -43.5 8.7 27.7 39.4 58 61 A S S > S- 0 0 39 -4,-0.2 4,-2.7 -3,-0.1 5,-0.2 -0.816 81.1 -88.3-142.0-179.4 7.8 30.2 36.7 59 62 A I H > S+ 0 0 82 -2,-0.2 4,-2.6 2,-0.2 5,-0.3 0.931 127.9 50.9 -59.5 -46.2 6.2 30.3 33.2 60 63 A I H > S+ 0 0 124 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.911 113.7 44.2 -57.6 -46.4 9.6 29.7 31.6 61 64 A H H > S+ 0 0 39 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.905 114.0 49.2 -65.4 -45.2 10.2 26.7 33.9 62 65 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.885 113.4 46.0 -63.2 -40.6 6.7 25.3 33.4 63 66 A K H X S+ 0 0 36 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.881 111.7 52.6 -69.8 -39.3 6.9 25.6 29.6 64 67 A R H X S+ 0 0 40 -4,-1.9 4,-2.3 -5,-0.3 -2,-0.2 0.844 108.3 50.8 -61.4 -39.9 10.4 24.0 29.6 65 68 A T H X S+ 0 0 5 -4,-2.0 4,-2.1 -10,-0.4 -2,-0.2 0.923 112.0 46.5 -66.4 -46.1 9.0 21.1 31.6 66 69 A Y H X S+ 0 0 11 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.920 111.8 53.1 -60.1 -45.7 6.2 20.6 29.1 67 70 A R H X S+ 0 0 45 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.920 109.8 45.7 -55.5 -51.1 8.7 20.9 26.2 68 71 A E H X S+ 0 0 9 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.928 113.9 48.8 -62.9 -44.0 11.1 18.2 27.5 69 72 A L H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.919 112.4 48.6 -61.8 -44.3 8.3 15.8 28.3 70 73 A R H X S+ 0 0 39 -4,-2.7 4,-1.4 2,-0.2 -2,-0.2 0.919 113.5 47.5 -59.5 -45.9 6.7 16.4 24.8 71 74 A L H X S+ 0 0 5 -4,-2.6 4,-1.5 -5,-0.2 3,-0.4 0.960 114.1 45.3 -60.7 -53.1 10.1 15.8 23.1 72 75 A L H < S+ 0 0 21 -4,-2.9 11,-0.8 1,-0.2 -2,-0.2 0.854 110.9 53.6 -61.0 -38.1 11.0 12.6 25.1 73 76 A K H < S+ 0 0 39 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.827 110.1 48.8 -66.3 -31.6 7.5 11.1 24.6 74 77 A H H < S+ 0 0 36 -4,-1.4 2,-0.6 -3,-0.4 243,-0.2 0.822 87.7 95.2 -76.4 -34.1 7.8 11.6 20.8 75 78 A M < + 0 0 4 -4,-1.5 8,-0.4 6,-0.1 2,-0.3 -0.494 36.1 157.9 -75.7 110.6 11.2 10.1 20.3 76 79 A K + 0 0 172 -2,-0.6 2,-0.3 6,-0.1 -1,-0.1 -0.726 31.6 116.3-129.4 79.9 11.1 6.4 19.3 77 80 A H > - 0 0 18 3,-0.5 3,-1.8 -2,-0.3 57,-0.0 -0.994 67.2-124.8-150.5 140.0 14.4 5.7 17.5 78 81 A E T 3 S+ 0 0 126 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.781 112.8 43.7 -54.3 -33.7 17.4 3.4 18.2 79 82 A N T 3 S+ 0 0 6 83,-0.1 84,-1.8 2,-0.1 2,-0.4 0.181 104.7 74.4-102.8 15.6 19.9 6.3 18.1 80 83 A V B < S-f 163 0C 2 -3,-1.8 -3,-0.5 82,-0.3 84,-0.2 -0.990 89.5-104.7-131.0 135.9 17.8 8.8 20.1 81 84 A I - 0 0 5 82,-2.5 2,-0.2 -2,-0.4 -6,-0.1 -0.383 45.4-165.8 -59.7 130.2 17.2 8.8 23.9 82 85 A G - 0 0 16 -2,-0.1 2,-0.7 -4,-0.1 22,-0.3 -0.713 23.7-102.6-117.9 168.9 13.7 7.6 24.6 83 86 A L + 0 0 15 -11,-0.8 20,-0.2 -8,-0.4 3,-0.1 -0.827 29.6 174.1 -97.8 112.2 11.3 7.6 27.5 84 87 A L S S- 0 0 28 18,-2.4 2,-0.3 -2,-0.7 19,-0.2 0.799 73.5 -13.1 -78.6 -33.8 11.0 4.3 29.4 85 88 A D E -E 102 0B 23 17,-1.3 17,-2.7 261,-0.1 -1,-0.3 -0.978 51.2-164.4-163.4 152.9 8.8 5.8 32.1 86 89 A V E +E 101 0B 7 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.961 25.3 167.1-142.2 132.8 7.5 9.0 33.5 87 90 A F E -E 100 0B 14 13,-1.8 13,-2.1 -2,-0.3 255,-0.1 -0.963 24.4-163.4-144.7 160.6 5.9 9.3 36.9 88 91 A T - 0 0 13 -2,-0.3 11,-0.1 2,-0.2 -71,-0.1 -0.989 23.1-140.7-138.2 140.7 4.6 11.5 39.7 89 92 A P S S+ 0 0 22 0, 0.0 -84,-0.1 0, 0.0 7,-0.1 0.691 74.4 110.6 -68.4 -18.4 3.8 10.5 43.3 90 93 A A - 0 0 17 8,-0.3 -2,-0.2 1,-0.1 6,-0.1 -0.263 56.3-160.3 -58.5 141.4 0.9 13.0 43.0 91 94 A R S S+ 0 0 187 1,-0.1 2,-0.3 -89,-0.0 -1,-0.1 0.523 73.9 18.0-101.1 -11.1 -2.6 11.5 42.9 92 95 A S S >> S- 0 0 32 1,-0.1 4,-0.8 0, 0.0 3,-0.5 -0.945 83.6-100.9-150.0 168.9 -4.3 14.5 41.4 93 96 A L T 34 S+ 0 0 52 -2,-0.3 3,-0.4 1,-0.2 -1,-0.1 0.859 118.7 58.7 -59.2 -38.1 -3.5 17.7 39.5 94 97 A E T 34 S+ 0 0 147 1,-0.2 -1,-0.2 -3,-0.0 -4,-0.0 0.778 111.9 38.6 -66.5 -28.4 -3.9 19.8 42.7 95 98 A E T <4 S+ 0 0 139 -3,-0.5 2,-0.4 -6,-0.0 -1,-0.2 0.524 89.6 118.0 -96.4 -9.5 -1.1 17.8 44.5 96 99 A F < + 0 0 1 -4,-0.8 3,-0.1 -3,-0.4 242,-0.1 -0.444 20.3 127.9 -67.4 115.4 1.1 17.5 41.3 97 100 A N + 0 0 96 -2,-0.4 2,-0.4 1,-0.2 -41,-0.3 0.466 54.6 63.0-142.8 -15.8 4.4 19.2 41.8 98 101 A D - 0 0 50 -44,-0.1 2,-0.4 -43,-0.1 -8,-0.3 -0.941 53.5-164.6-123.4 143.6 7.2 16.8 40.9 99 102 A V - 0 0 1 -2,-0.4 -47,-2.1 -47,-0.3 2,-0.4 -0.992 3.5-167.6-127.8 126.4 8.1 15.1 37.6 100 103 A Y E -DE 51 87B 1 -13,-2.1 -13,-1.8 -2,-0.4 2,-0.4 -0.952 4.8-161.8-115.4 130.9 10.5 12.1 37.2 101 104 A L E -DE 50 86B 9 -51,-2.9 -51,-3.3 -2,-0.4 2,-0.4 -0.928 3.8-161.1-116.0 134.6 11.8 10.9 33.8 102 105 A V E +DE 49 85B 1 -17,-2.7 -18,-2.4 -2,-0.4 -17,-1.3 -0.957 20.1 150.2-121.3 129.7 13.3 7.5 33.2 103 106 A T E -D 48 0B 23 -55,-2.6 -55,-3.2 -2,-0.4 2,-0.2 -0.827 52.0 -62.4-139.2 179.8 15.6 6.4 30.3 104 107 A H E -D 47 0B 60 -22,-0.3 2,-0.5 -57,-0.2 -57,-0.3 -0.455 48.6-123.7 -63.8 135.3 18.4 3.8 29.6 105 108 A L - 0 0 57 -59,-2.1 2,-0.3 -2,-0.2 -59,-0.2 -0.739 29.1-149.5 -78.2 124.6 21.5 4.2 31.7 106 109 A M - 0 0 40 -2,-0.5 50,-0.2 1,-0.1 3,-0.1 -0.780 8.9-142.8-101.3 144.8 24.4 4.6 29.2 107 110 A G S S- 0 0 72 48,-0.4 2,-0.3 -2,-0.3 49,-0.2 0.857 73.6 -2.1 -74.6 -38.7 27.9 3.4 30.1 108 111 A A E -G 155 0C 32 47,-1.8 47,-3.5 3,-0.0 2,-0.2 -0.984 57.4-135.8-151.7 154.9 30.0 6.2 28.4 109 112 A D E >> -G 154 0C 39 -2,-0.3 4,-1.3 45,-0.3 3,-0.7 -0.634 42.7 -96.0-104.8 174.0 29.8 9.3 26.4 110 113 A L H 3> S+ 0 0 0 43,-1.9 4,-2.3 40,-1.5 41,-0.2 0.718 122.7 61.6 -64.2 -23.2 32.0 10.3 23.4 111 114 A N H 3> S+ 0 0 67 39,-0.4 4,-1.8 42,-0.2 -1,-0.2 0.897 104.2 48.8 -64.1 -42.5 34.3 12.3 25.7 112 115 A N H <4 S+ 0 0 84 -3,-0.7 -2,-0.2 1,-0.2 -1,-0.2 0.811 113.7 47.2 -66.2 -32.7 35.2 9.1 27.5 113 116 A I H < S+ 0 0 35 -4,-1.3 -2,-0.2 1,-0.1 -1,-0.2 0.916 109.9 50.6 -76.5 -45.5 35.8 7.3 24.2 114 117 A V H >< S+ 0 0 7 -4,-2.3 3,-2.8 2,-0.1 -2,-0.2 0.924 71.6 170.1 -57.9 -51.1 38.0 10.0 22.6 115 118 A K T 3< S- 0 0 129 -4,-1.8 -3,-0.1 1,-0.3 3,-0.1 0.824 78.5 -58.7 34.0 58.1 40.4 10.3 25.7 116 119 A C T 3 S+ 0 0 97 -5,-0.2 2,-0.3 1,-0.2 -1,-0.3 0.548 117.0 105.2 58.0 11.4 43.0 12.5 23.9 117 120 A Q S < S- 0 0 107 -3,-2.8 98,-0.2 -4,-0.1 -1,-0.2 -0.867 73.4-105.7-126.7 154.0 43.5 9.7 21.3 118 121 A K - 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0 0 36 -2,-0.3 -9,-0.1 1,-0.1 -33,-0.0 -0.392 28.9-146.8 -57.8 132.2 39.2 19.7 19.4 218 222 A L S S+ 0 0 33 -11,-0.4 -1,-0.1 1,-0.2 -34,-0.1 0.953 90.1 15.6 -67.7 -53.0 38.7 21.2 15.9 219 223 A F + 0 0 4 -36,-0.3 2,-2.3 2,-0.1 -1,-0.2 -0.628 69.9 173.5-122.2 72.0 38.0 24.8 17.0 220 224 A P - 0 0 39 0, 0.0 -40,-0.1 0, 0.0 -3,-0.0 -0.351 19.7-176.1 -79.7 66.6 39.1 25.1 20.7 221 225 A G - 0 0 0 -2,-2.3 -42,-0.4 1,-0.1 -39,-0.1 -0.273 30.8-144.3 -65.1 145.1 38.5 28.9 20.9 222 226 A T S S- 0 0 70 -44,-0.2 2,-0.3 1,-0.1 -44,-0.2 0.562 84.8 -12.6 -83.1 -11.9 39.5 30.8 24.0 223 227 A D S > S- 0 0 64 -46,-0.1 4,-2.6 -47,-0.1 5,-0.2 -0.935 89.8 -76.1-168.4 179.1 36.4 33.0 23.5 224 228 A H H > S+ 0 0 56 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.890 128.1 44.7 -54.1 -45.6 33.7 33.8 20.8 225 229 A I H > S+ 0 0 61 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.922 113.1 48.8 -69.5 -47.1 36.1 36.0 18.8 226 230 A D H > S+ 0 0 48 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.926 112.1 51.1 -57.4 -44.8 39.1 33.6 18.9 227 231 A Q H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.870 107.6 51.6 -61.3 -40.7 36.8 30.7 17.9 228 232 A L H X S+ 0 0 0 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.925 108.9 51.3 -61.5 -44.4 35.5 32.7 14.9 229 233 A K H X S+ 0 0 111 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.913 109.6 49.7 -59.7 -42.5 39.0 33.4 13.8 230 234 A L H X S+ 0 0 61 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.895 112.9 47.6 -61.9 -41.2 39.9 29.6 14.1 231 235 A I H >X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 3,-0.5 0.956 112.5 47.3 -63.0 -51.3 36.8 28.7 12.0 232 236 A L H 3X S+ 0 0 0 -4,-2.9 4,-1.7 1,-0.2 -2,-0.2 0.781 104.9 60.6 -67.7 -27.5 37.4 31.3 9.3 233 237 A R H 3< S+ 0 0 157 -4,-1.9 -1,-0.2 -5,-0.2 31,-0.2 0.898 114.5 36.1 -63.5 -39.4 41.0 30.3 9.0 234 238 A L H << S+ 0 0 10 -4,-1.2 30,-2.7 -3,-0.5 -2,-0.2 0.947 130.0 28.4 -76.3 -51.7 39.9 26.8 8.0 235 239 A V H < S- 0 0 19 -4,-2.7 28,-0.4 28,-0.2 52,-0.3 0.479 109.4-112.3 -96.7 -2.5 36.7 27.5 6.0 236 240 A G < - 0 0 6 -4,-1.7 -1,-0.2 26,-0.4 -3,-0.1 0.078 38.8 -68.8 86.3 154.8 37.6 30.9 4.5 237 241 A T - 0 0 27 24,-2.2 26,-0.1 1,-0.1 50,-0.1 -0.439 68.3 -84.7 -73.3 154.0 36.0 34.3 5.3 238 242 A P - 0 0 13 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.236 39.0-132.4 -65.1 150.7 32.4 34.7 4.0 239 243 A G > - 0 0 45 -3,-0.1 4,-2.3 1,-0.0 3,-0.3 -0.370 34.5 -93.1 -89.5 176.3 31.5 35.8 0.5 240 244 A A H > S+ 0 0 75 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.833 123.3 59.8 -59.1 -35.8 29.0 38.5 -0.6 241 245 A E H > S+ 0 0 106 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.912 110.2 39.0 -59.9 -49.3 26.3 35.9 -0.9 242 246 A L H >> S+ 0 0 8 -3,-0.3 3,-0.8 2,-0.2 4,-0.8 0.887 109.9 61.1 -71.0 -39.9 26.5 34.8 2.7 243 247 A L H >< S+ 0 0 23 -4,-2.3 3,-1.5 1,-0.3 -2,-0.2 0.917 99.5 55.7 -52.4 -48.7 27.0 38.4 4.0 244 248 A K H 3< S+ 0 0 165 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.818 103.9 56.0 -51.0 -35.1 23.6 39.4 2.6 245 249 A K H << S+ 0 0 61 -3,-0.8 2,-1.4 -4,-0.7 -1,-0.3 0.645 80.1 95.5 -78.6 -17.3 22.0 36.6 4.6 246 250 A I << - 0 0 0 -3,-1.5 -52,-0.2 -4,-0.8 6,-0.2 -0.646 56.3-175.1 -74.5 94.9 23.5 37.9 7.9 247 251 A S + 0 0 88 -2,-1.4 2,-0.7 -54,-0.5 -1,-0.2 0.709 58.4 93.7 -68.8 -23.0 20.4 39.9 8.9 248 252 A S > - 0 0 33 -55,-1.7 4,-2.0 1,-0.2 5,-0.2 -0.652 63.7-161.2 -71.4 113.1 22.2 41.3 11.9 249 253 A E H > S+ 0 0 150 -2,-0.7 4,-1.8 2,-0.2 -1,-0.2 0.885 89.2 48.2 -64.0 -41.0 23.7 44.6 10.8 250 254 A S H > S+ 0 0 93 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.923 112.4 46.8 -67.1 -46.6 26.2 44.7 13.6 251 255 A A H > S+ 0 0 15 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.874 113.3 49.6 -63.4 -39.4 27.5 41.2 13.1 252 256 A R H X S+ 0 0 73 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.862 109.4 52.2 -67.1 -37.8 27.8 41.7 9.3 253 257 A N H < S+ 0 0 115 -4,-1.8 4,-0.4 2,-0.2 -2,-0.2 0.855 109.3 49.5 -67.6 -37.1 29.7 44.9 9.9 254 258 A Y H >< S+ 0 0 73 -4,-2.0 3,-1.5 1,-0.2 4,-0.4 0.935 107.0 55.5 -64.1 -47.4 32.2 43.1 12.2 255 259 A I H >< S+ 0 0 8 -4,-2.1 3,-1.5 1,-0.3 -2,-0.2 0.888 103.0 55.2 -51.3 -44.7 32.7 40.3 9.7 256 260 A Q T 3< S+ 0 0 126 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.600 95.9 67.0 -70.0 -12.7 33.7 42.7 6.9 257 261 A S T < S+ 0 0 79 -3,-1.5 -1,-0.3 -4,-0.4 2,-0.2 0.638 83.5 94.7 -80.1 -15.7 36.5 44.2 9.1 258 262 A L S < S- 0 0 36 -3,-1.5 2,-0.1 -4,-0.4 3,-0.1 -0.554 87.3-106.3 -82.4 140.3 38.4 41.0 9.0 259 263 A T - 0 0 125 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.1 -0.425 46.3-105.7 -61.7 134.0 41.2 40.4 6.5 260 264 A Q - 0 0 162 -2,-0.1 -1,-0.1 -4,-0.1 -4,-0.0 -0.350 39.8-174.2 -68.5 143.3 40.0 38.0 3.8 261 265 A M - 0 0 63 -29,-0.1 -24,-2.2 -3,-0.1 2,-0.2 -0.997 19.5-125.7-138.7 140.0 41.2 34.4 3.9 262 266 A P - 0 0 113 0, 0.0 -26,-0.4 0, 0.0 2,-0.1 -0.494 39.4 -89.2 -82.3 155.9 40.7 31.5 1.4 263 267 A K - 0 0 98 -28,-0.4 -28,-0.2 -2,-0.2 -29,-0.1 -0.401 49.4-122.9 -56.6 135.2 39.4 28.1 2.4 264 268 A M - 0 0 61 -30,-2.7 2,-0.7 -31,-0.2 -1,-0.1 -0.368 25.6 -95.7 -78.8 162.4 42.2 25.8 3.4 265 269 A N >> - 0 0 90 1,-0.2 3,-1.1 -2,-0.1 4,-0.8 -0.729 30.4-157.8 -79.9 110.9 43.0 22.4 1.9 266 270 A F H 3> S+ 0 0 1 -2,-0.7 4,-3.0 1,-0.3 -1,-0.2 0.753 90.3 62.1 -65.8 -26.0 41.3 19.8 4.2 267 271 A A H 34 S+ 0 0 52 1,-0.2 5,-0.3 2,-0.2 -1,-0.3 0.780 106.5 45.9 -69.2 -27.7 43.7 17.1 2.9 268 272 A N H <4 S+ 0 0 117 -3,-1.1 3,-0.3 3,-0.1 -1,-0.2 0.630 115.2 47.8 -83.8 -17.7 46.6 19.1 4.4 269 273 A V H < S+ 0 0 49 -4,-0.8 2,-0.7 1,-0.2 -2,-0.2 0.875 116.4 41.0 -85.7 -44.4 44.6 19.7 7.6 270 274 A F S >< S- 0 0 11 -4,-3.0 3,-1.8 -5,-0.1 -1,-0.2 -0.561 86.5-165.0-107.7 66.0 43.5 16.1 8.1 271 275 A I T 3 S+ 0 0 132 -2,-0.7 -3,-0.1 -3,-0.3 3,-0.1 -0.258 70.1 6.3 -58.9 126.5 46.8 14.3 7.2 272 276 A G T 3 S+ 0 0 82 -5,-0.3 -1,-0.3 1,-0.3 -4,-0.1 0.293 94.2 138.0 86.5 -9.1 46.4 10.6 6.6 273 277 A A < - 0 0 28 -3,-1.8 -1,-0.3 -6,-0.2 -3,-0.1 -0.328 68.9 -84.6 -69.7 149.7 42.6 10.6 6.9 274 278 A N >> - 0 0 45 1,-0.2 4,-2.1 -3,-0.1 3,-1.0 -0.335 36.2-131.4 -47.6 122.9 40.4 8.6 4.6 275 279 A P H 3> S+ 0 0 103 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.797 109.5 55.8 -51.9 -31.1 39.8 10.8 1.4 276 280 A L H 3> S+ 0 0 71 2,-0.2 4,-2.0 1,-0.2 27,-0.3 0.811 105.3 50.8 -71.7 -32.0 36.1 10.1 1.8 277 281 A A H <> S+ 0 0 0 -3,-1.0 4,-2.7 2,-0.2 -1,-0.2 0.895 109.8 50.9 -67.5 -42.1 36.1 11.4 5.4 278 282 A V H X S+ 0 0 13 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.930 109.9 49.9 -60.0 -47.4 37.9 14.6 4.1 279 283 A D H X S+ 0 0 53 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.913 111.6 48.2 -59.0 -45.9 35.2 15.0 1.4 280 284 A L H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 3,-0.5 0.927 109.9 51.7 -62.4 -46.0 32.4 14.6 3.9 281 285 A L H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.889 107.2 54.3 -55.7 -42.3 34.0 17.1 6.3 282 286 A E H < S+ 0 0 60 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.820 110.7 46.1 -59.9 -33.6 34.3 19.6 3.4 283 287 A K H < S+ 0 0 89 -4,-1.4 10,-2.1 -3,-0.5 3,-0.3 0.716 117.6 42.4 -84.0 -23.9 30.5 19.2 2.8 284 288 A M H < S+ 0 0 0 -4,-1.7 2,-1.3 8,-0.2 -2,-0.2 0.857 107.2 59.4 -85.5 -42.1 29.5 19.5 6.5 285 289 A L S < S+ 0 0 4 -4,-2.9 2,-0.4 -5,-0.2 -1,-0.2 -0.378 71.3 138.1 -91.2 56.2 31.9 22.4 7.5 286 290 A V - 0 0 40 -2,-1.3 6,-0.1 -3,-0.3 5,-0.1 -0.874 51.2-141.9 -99.4 134.0 30.5 24.9 5.0 287 291 A L S S+ 0 0 14 -2,-0.4 2,-0.7 -52,-0.3 -99,-0.2 0.922 87.7 70.8 -64.5 -46.9 30.1 28.4 6.4 288 292 A D S > S- 0 0 10 1,-0.2 3,-1.8 -3,-0.1 4,-0.4 -0.636 74.3-154.5 -74.0 112.4 26.8 29.2 4.5 289 293 A S G > S+ 0 0 6 -2,-0.7 3,-0.9 1,-0.3 -1,-0.2 0.788 89.3 66.9 -62.9 -30.6 24.3 27.0 6.3 290 294 A D G 3 S+ 0 0 104 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.1 0.743 104.8 46.3 -55.5 -26.1 22.0 26.9 3.1 291 295 A K G < S+ 0 0 115 -3,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.485 84.7 113.0-104.7 -4.9 24.8 24.9 1.4 292 296 A R S < S- 0 0 7 -3,-0.9 -8,-0.2 -4,-0.4 -9,-0.1 -0.378 76.5-102.0 -65.0 144.0 25.7 22.3 4.1 293 297 A I - 0 0 18 -10,-2.1 2,-0.2 -13,-0.2 -1,-0.1 -0.370 39.1-129.0 -57.5 142.9 24.9 18.7 3.5 294 298 A T > - 0 0 55 1,-0.1 4,-2.5 -3,-0.1 5,-0.2 -0.483 21.7-106.5 -88.8 169.3 21.8 17.5 5.3 295 299 A A H > S+ 0 0 2 2,-0.2 4,-1.9 1,-0.2 -159,-0.2 0.916 121.3 49.5 -60.9 -44.5 21.6 14.4 7.5 296 300 A A H > S+ 0 0 52 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.904 113.8 45.7 -62.9 -43.0 19.6 12.4 4.8 297 301 A Q H >4 S+ 0 0 110 1,-0.2 3,-0.6 2,-0.2 4,-0.3 0.889 110.5 53.7 -64.7 -41.8 22.1 13.4 2.1 298 302 A A H >< S+ 0 0 0 -4,-2.5 3,-1.5 1,-0.2 6,-0.3 0.843 99.7 60.8 -65.5 -34.9 25.1 12.5 4.4 299 303 A L H 3< S+ 0 0 0 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.824 104.5 51.4 -59.8 -30.4 23.8 9.0 5.1 300 304 A A T << S+ 0 0 63 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.484 85.0 116.0 -84.8 -5.9 24.0 8.4 1.3 301 305 A H S X S- 0 0 21 -3,-1.5 3,-2.1 -4,-0.3 7,-0.1 -0.393 78.6-116.5 -67.7 143.2 27.7 9.7 1.1 302 306 A A G > S+ 0 0 54 1,-0.3 3,-1.7 2,-0.2 4,-0.2 0.695 107.1 75.6 -56.3 -24.5 30.2 7.0 0.1 303 307 A Y G 3 S+ 0 0 4 -27,-0.3 3,-0.3 1,-0.3 -1,-0.3 0.817 100.3 43.1 -55.8 -32.3 32.0 7.2 3.5 304 308 A F G X> S+ 0 0 0 -3,-2.1 4,-2.9 -6,-0.3 3,-2.3 0.188 75.1 125.3-101.8 18.3 29.1 5.2 5.0 305 309 A A T <4 S+ 0 0 78 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.798 73.7 51.1 -45.4 -39.4 28.8 2.6 2.2 306 310 A Q T 34 S+ 0 0 119 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.651 121.6 30.9 -79.7 -14.1 29.2 -0.3 4.6 307 311 A Y T <4 S+ 0 0 58 -3,-2.3 -2,-0.2 -8,-0.1 -1,-0.2 0.669 89.7 110.5-111.2 -26.6 26.5 0.9 7.0 308 312 A H < + 0 0 61 -4,-2.9 -8,-0.1 -7,-0.1 5,-0.1 -0.305 30.4 163.5 -63.5 127.7 24.0 2.8 4.8 309 313 A D > - 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