==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-DEC-11 4AAC . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.GERHARDT,D.HARGREAVES . 350 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17339.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 216 61.7 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 12.0 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 . 3 0.9 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 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 27.4 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 3 1 0 0 0 1 1 0 1 0 1 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 . 1 1 2 0 2 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 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 5 A R 0 0 151 0, 0.0 3,-0.1 0, 0.0 89,-0.0 0.000 360.0 360.0 360.0 141.2 -25.4 -2.9 8.9 2 6 A P - 0 0 72 0, 0.0 2,-0.5 0, 0.0 0, 0.0 -0.110 360.0-109.4 -50.6 150.9 -24.3 -3.7 12.5 3 7 A T - 0 0 88 2,-0.0 15,-2.8 0, 0.0 2,-0.3 -0.797 41.4-152.9 -79.5 125.7 -26.5 -2.9 15.5 4 8 A F E -A 17 0A 25 -2,-0.5 2,-0.3 13,-0.3 11,-0.0 -0.709 12.8-169.5-100.8 152.6 -24.8 -0.0 17.3 5 9 A Y E -A 16 0A 58 11,-2.1 11,-2.3 -2,-0.3 2,-0.3 -0.981 10.7-134.4-143.8 161.1 -24.9 0.9 21.0 6 10 A R E +A 15 0A 159 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.763 23.7 157.8-122.9 147.7 -23.8 3.8 23.0 7 11 A Q E -A 14 0A 66 7,-1.7 7,-3.0 -2,-0.3 2,-0.5 -0.955 36.2-117.7-160.4 154.2 -22.0 4.7 26.3 8 12 A E E -A 13 0A 141 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.839 29.2-176.5 -95.8 127.4 -20.1 7.6 27.9 9 13 A L - 0 0 26 3,-2.6 3,-0.3 -2,-0.5 4,-0.0 -0.834 69.2 -26.9-133.4 96.8 -16.5 6.8 28.7 10 14 A N S S- 0 0 139 -2,-0.5 -1,-0.2 1,-0.2 3,-0.1 1.000 128.4 -42.9 56.5 68.7 -14.5 9.5 30.5 11 15 A K S S+ 0 0 198 1,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.471 121.7 104.3 60.6 4.6 -16.5 12.4 29.2 12 16 A T - 0 0 27 -3,-0.3 -3,-2.6 2,-0.0 2,-0.5 -0.793 66.5-131.0-109.0 157.7 -16.7 10.9 25.6 13 17 A I E -A 8 0A 89 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.948 20.3-164.2-106.1 122.1 -19.5 9.1 23.8 14 18 A W E -A 7 0A 2 -7,-3.0 -7,-1.7 -2,-0.5 2,-0.5 -0.918 7.9-173.9-103.6 127.6 -18.7 5.8 22.1 15 19 A E E +A 6 0A 33 -2,-0.5 -9,-0.2 -9,-0.2 -11,-0.0 -0.978 23.4 160.7-116.7 115.1 -21.1 4.3 19.5 16 20 A V E -A 5 0A 1 -11,-2.3 -11,-2.1 -2,-0.5 -2,-0.0 -0.948 45.3 -87.1-139.4 150.1 -19.9 0.8 18.5 17 21 A P E > -A 4 0A 4 0, 0.0 3,-1.7 0, 0.0 -13,-0.3 -0.215 42.1-118.0 -50.4 143.5 -21.2 -2.4 16.9 18 22 A E T 3 S+ 0 0 109 -15,-2.8 22,-0.1 1,-0.3 -14,-0.1 0.791 106.9 79.2 -60.7 -21.6 -22.7 -4.7 19.4 19 23 A R T 3 S+ 0 0 59 -16,-0.2 21,-2.5 20,-0.1 2,-0.5 0.764 83.3 68.2 -59.5 -27.8 -20.0 -7.3 18.5 20 24 A Y E < S+B 39 0B 1 -3,-1.7 2,-0.2 19,-0.2 19,-0.2 -0.856 71.2 172.3 -94.8 127.7 -17.5 -5.4 20.7 21 25 A Q E +B 38 0B 73 17,-2.4 17,-2.2 -2,-0.5 -2,-0.0 -0.708 46.1 39.0-126.1 174.5 -18.3 -5.7 24.4 22 26 A N E - 0 0 113 -2,-0.2 -1,-0.1 15,-0.2 14,-0.1 0.800 69.1-162.0 51.0 37.9 -16.8 -4.8 27.8 23 27 A L E + 0 0 14 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.280 14.0 177.8 -49.6 125.8 -15.3 -1.5 26.6 24 28 A S E -B 36 0B 66 12,-2.3 12,-2.8 -15,-0.0 -15,-0.0 -0.964 26.5-124.1-142.6 110.3 -12.6 -0.5 29.2 25 29 A P E +B 35 0B 72 0, 0.0 10,-0.2 0, 0.0 3,-0.1 -0.300 27.7 174.1 -60.3 144.0 -10.5 2.6 28.9 26 30 A V E - 0 0 99 8,-2.0 2,-0.2 1,-0.5 9,-0.1 0.167 51.8 -92.6-131.4 13.0 -6.6 2.2 28.9 27 31 A G E - 0 0 44 7,-0.5 7,-1.6 2,-0.0 -1,-0.5 -0.467 64.1 -26.7 105.6-173.0 -5.4 5.8 28.1 28 32 A S E -B 33 0B 113 5,-0.2 5,-0.2 -2,-0.2 2,-0.2 -0.514 47.1-178.7 -80.9 139.0 -4.5 7.8 25.1 29 33 A G E > -B 32 0B 31 3,-2.8 3,-1.3 -2,-0.2 2,-0.9 -0.460 58.9 -43.9-110.3-163.9 -3.2 6.3 21.8 30 34 A A T 3 S- 0 0 12 1,-0.3 144,-0.1 -2,-0.2 130,-0.1 -0.521 125.1 -14.3 -77.7 108.1 -2.3 8.4 18.8 31 35 A Y T 3 S+ 0 0 28 -2,-0.9 21,-2.8 142,-0.1 2,-0.3 0.601 129.6 23.5 83.1 20.5 -5.0 11.1 18.2 32 36 A G E < S-BC 29 51B 13 -3,-1.3 -3,-2.8 19,-0.2 19,-0.2 -0.965 88.3 -65.0 173.0 174.0 -7.7 9.6 20.5 33 37 A S E -BC 28 50B 47 17,-0.6 17,-1.7 -2,-0.3 2,-0.4 -0.440 42.4-144.3 -75.0 153.2 -8.8 7.4 23.5 34 38 A V E - C 0 49B 25 -7,-1.6 -8,-2.0 15,-0.2 -7,-0.5 -0.967 11.6-166.2-122.4 136.2 -8.3 3.7 23.4 35 39 A C E -BC 25 48B 1 13,-2.7 13,-3.2 -2,-0.4 2,-0.3 -0.989 18.7-134.7-120.5 131.2 -10.6 1.0 24.9 36 40 A A E +BC 24 47B 7 -12,-2.8 -12,-2.3 -2,-0.4 2,-0.3 -0.642 37.5 171.0 -65.0 137.0 -10.0 -2.6 25.5 37 41 A A E - C 0 46B 0 9,-2.2 9,-3.0 -2,-0.3 2,-0.4 -0.975 34.1-118.8-144.0 156.5 -13.0 -4.6 24.2 38 42 A F E -BC 21 45B 69 -17,-2.2 -17,-2.4 -2,-0.3 2,-0.9 -0.836 24.0-138.6 -94.2 136.2 -13.8 -8.3 23.7 39 43 A D E > -B 20 0B 0 5,-3.2 4,-2.6 -2,-0.4 5,-0.5 -0.814 13.9-170.0-102.7 97.4 -14.7 -9.3 20.2 40 44 A T T 4 S+ 0 0 78 -21,-2.5 -1,-0.2 -2,-0.9 -20,-0.1 0.806 82.0 61.6 -58.0 -33.7 -17.6 -11.6 20.2 41 45 A K T 4 S+ 0 0 162 -22,-0.3 -1,-0.2 1,-0.2 -21,-0.1 0.970 124.8 14.4 -54.0 -52.9 -17.2 -12.5 16.5 42 46 A T T 4 S- 0 0 26 -3,-0.4 -2,-0.2 2,-0.1 -1,-0.2 0.503 94.4-120.9-107.6 -8.1 -13.8 -14.0 17.0 43 47 A G S < S+ 0 0 40 -4,-2.6 -3,-0.2 1,-0.3 -2,-0.1 0.369 70.5 137.7 77.1 -6.0 -13.4 -14.5 20.7 44 48 A L - 0 0 14 -5,-0.5 -5,-3.2 -6,-0.1 2,-0.4 -0.321 58.4-124.4 -72.2 151.6 -10.4 -12.1 20.4 45 49 A R E -C 38 0B 97 -7,-0.2 59,-1.5 59,-0.1 2,-0.3 -0.800 40.2-178.0 -89.3 139.4 -9.4 -9.3 22.7 46 50 A V E -CD 37 103B 0 -9,-3.0 -9,-2.2 -2,-0.4 2,-0.4 -0.901 28.8-129.5-138.3 160.9 -9.1 -6.1 20.8 47 51 A A E -CD 36 102B 14 55,-2.2 55,-2.1 -2,-0.3 2,-0.5 -0.957 21.8-161.4-110.8 132.8 -8.2 -2.4 21.2 48 52 A V E -CD 35 101B 0 -13,-3.2 -13,-2.7 -2,-0.4 2,-0.6 -0.972 2.5-159.6-115.4 125.0 -10.6 0.2 19.8 49 53 A K E -CD 34 100B 18 51,-2.9 51,-2.0 -2,-0.5 2,-0.7 -0.910 4.8-155.9-104.8 121.5 -9.5 3.7 19.1 50 54 A K E -CD 33 99B 32 -17,-1.7 -17,-0.6 -2,-0.6 2,-0.2 -0.800 23.5-132.0 -85.2 119.0 -12.0 6.6 18.9 51 55 A L E -C 32 0B 4 47,-2.5 2,-0.7 -2,-0.7 47,-0.3 -0.541 17.7-123.4 -71.1 138.7 -10.4 9.3 16.9 52 56 A S S S- 0 0 56 -21,-2.8 -1,-0.1 1,-0.2 45,-0.0 -0.753 80.1 -31.5 -86.3 109.9 -10.7 12.7 18.5 53 57 A R S > S- 0 0 168 -2,-0.7 3,-1.6 1,-0.1 -1,-0.2 0.904 72.6-168.2 46.9 56.2 -12.5 15.1 16.1 54 58 A P T 3 S+ 0 0 2 0, 0.0 10,-0.4 0, 0.0 3,-0.1 0.693 79.5 33.4 -50.6 -20.0 -11.0 13.4 13.0 55 59 A F T 3 S+ 0 0 19 41,-0.3 -2,-0.1 1,-0.1 3,-0.1 -0.210 72.6 112.9-135.6 45.0 -12.1 16.3 10.8 56 60 A Q S < S+ 0 0 114 -3,-1.6 2,-0.3 1,-0.1 -1,-0.1 0.516 92.3 4.6 -82.5 -6.7 -12.0 19.6 12.6 57 61 A S S > S- 0 0 34 -4,-0.2 4,-3.1 -3,-0.1 5,-0.1 -0.969 79.2 -98.6-163.1 167.0 -9.1 20.7 10.3 58 62 A I H > S+ 0 0 80 -2,-0.3 4,-3.3 2,-0.2 5,-0.3 0.872 125.3 56.3 -58.6 -40.5 -7.0 19.8 7.2 59 63 A I H > S+ 0 0 61 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.915 114.5 36.3 -54.7 -49.6 -4.4 18.6 9.8 60 64 A H H > S+ 0 0 20 2,-0.2 4,-2.1 3,-0.1 -2,-0.2 0.900 119.0 50.6 -71.2 -39.9 -7.0 16.3 11.4 61 65 A A H X S+ 0 0 0 -4,-3.1 4,-2.0 2,-0.2 -2,-0.2 0.961 113.3 42.3 -71.9 -50.8 -8.6 15.3 8.2 62 66 A K H X S+ 0 0 30 -4,-3.3 4,-3.1 1,-0.2 -1,-0.2 0.924 114.1 53.1 -57.2 -46.7 -5.4 14.4 6.3 63 67 A R H X S+ 0 0 20 -4,-1.7 4,-2.7 -5,-0.3 -1,-0.2 0.830 106.8 52.0 -57.4 -39.5 -4.0 12.6 9.4 64 68 A T H X S+ 0 0 3 -4,-2.1 4,-2.5 -10,-0.4 5,-0.2 0.952 111.7 47.1 -61.2 -49.7 -7.1 10.4 9.7 65 69 A Y H X S+ 0 0 19 -4,-2.0 4,-2.8 1,-0.2 5,-0.2 0.962 112.4 50.3 -55.2 -55.0 -6.7 9.5 6.0 66 70 A R H X S+ 0 0 9 -4,-3.1 4,-2.8 2,-0.2 -2,-0.2 0.925 110.5 48.9 -44.7 -56.3 -3.0 8.8 6.6 67 71 A E H X S+ 0 0 14 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.936 113.4 46.2 -56.8 -50.2 -3.7 6.5 9.6 68 72 A L H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.882 112.9 48.5 -63.3 -42.4 -6.4 4.5 7.8 69 73 A R H X S+ 0 0 36 -4,-2.8 4,-1.4 -5,-0.2 -1,-0.2 0.950 113.9 48.0 -58.9 -47.7 -4.3 4.0 4.6 70 74 A L H >X S+ 0 0 6 -4,-2.8 4,-1.1 -5,-0.2 3,-1.0 0.970 113.8 45.7 -57.7 -58.0 -1.3 2.9 6.7 71 75 A L H 3< S+ 0 0 13 -4,-2.8 11,-1.1 1,-0.2 3,-0.5 0.853 109.3 55.6 -52.7 -45.0 -3.3 0.5 8.8 72 76 A K H 3< S+ 0 0 46 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.802 110.4 45.2 -62.2 -28.2 -5.1 -1.0 5.8 73 77 A H H << S+ 0 0 35 -4,-1.4 2,-0.6 -3,-1.0 240,-0.2 0.647 86.5 99.9 -91.3 -19.0 -1.8 -1.9 4.0 74 78 A M < + 0 0 5 -4,-1.1 8,-0.4 -3,-0.5 2,-0.4 -0.593 35.2 160.1 -85.0 117.8 0.2 -3.4 6.8 75 79 A K + 0 0 153 -2,-0.6 2,-0.3 6,-0.1 5,-0.1 -0.763 31.7 112.5-133.5 84.2 0.1 -7.3 6.7 76 80 A H B > -F 79 0C 15 3,-0.6 3,-1.6 -2,-0.4 53,-0.0 -0.968 68.6-122.8-161.0 138.0 3.1 -8.5 8.8 77 81 A E T 3 S+ 0 0 104 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.714 111.7 43.4 -59.6 -27.9 3.3 -10.3 12.1 78 82 A N T 3 S+ 0 0 11 79,-0.1 80,-2.6 47,-0.1 2,-0.4 0.279 103.3 74.7-107.3 9.0 5.5 -7.6 13.7 79 83 A V B < S-Fg 76 158C 1 -3,-1.6 -3,-0.6 78,-0.3 80,-0.1 -0.992 89.1-110.9-123.7 128.1 3.5 -4.6 12.5 80 84 A I - 0 0 7 78,-2.4 2,-0.2 -2,-0.4 -6,-0.1 -0.299 42.4-165.0 -59.4 137.6 0.2 -3.6 13.9 81 85 A G - 0 0 16 -4,-0.1 2,-0.7 -8,-0.1 22,-0.3 -0.762 25.5 -90.6-126.6 168.9 -2.6 -4.2 11.3 82 86 A L + 0 0 14 -11,-1.1 20,-0.2 -8,-0.4 3,-0.1 -0.722 35.2 171.0 -89.0 115.7 -6.2 -3.3 10.8 83 87 A L S S- 0 0 25 18,-2.9 2,-0.3 -2,-0.7 19,-0.2 0.787 70.8 -19.4 -89.7 -36.3 -8.7 -5.7 12.3 84 88 A D E -E 101 0B 21 17,-1.6 17,-2.9 258,-0.1 -1,-0.4 -0.954 52.0-159.5-167.0 153.2 -11.8 -3.5 11.6 85 89 A V E +E 100 0B 8 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.986 24.4 161.2-138.1 136.6 -12.8 0.1 10.9 86 90 A F E -E 99 0B 14 13,-1.9 13,-2.0 -2,-0.3 -2,-0.0 -0.956 23.2-167.9-150.8 164.1 -16.3 1.5 11.5 87 91 A T - 0 0 15 -2,-0.3 11,-0.1 11,-0.2 8,-0.1 -0.964 28.0-132.8-145.7 150.2 -18.5 4.6 12.0 88 92 A P S S+ 0 0 25 0, 0.0 2,-0.1 0, 0.0 -84,-0.1 0.728 75.5 109.3 -76.7 -16.9 -22.1 4.9 13.1 89 93 A A - 0 0 15 8,-0.2 -2,-0.1 1,-0.1 6,-0.1 -0.371 55.9-159.2 -63.6 128.4 -22.9 7.3 10.2 90 94 A R S S+ 0 0 188 -2,-0.1 2,-0.3 4,-0.0 -1,-0.1 0.396 74.6 21.8 -88.0 2.8 -25.1 5.8 7.5 91 95 A S S > S- 0 0 46 1,-0.0 3,-0.9 0, 0.0 -2,-0.0 -0.970 84.9-100.6-159.4 166.5 -24.0 8.3 4.8 92 96 A L G > S+ 0 0 70 -2,-0.3 3,-1.2 1,-0.2 242,-0.1 0.780 110.4 69.2 -62.2 -28.1 -21.2 10.8 3.9 93 97 A E G 3 S+ 0 0 179 1,-0.3 -1,-0.2 3,-0.0 -4,-0.0 0.738 109.6 29.4 -68.5 -29.6 -23.2 13.7 5.2 94 98 A E G < S+ 0 0 121 -3,-0.9 2,-0.9 3,-0.0 -1,-0.3 -0.004 81.9 136.3-123.6 25.5 -23.0 12.9 8.8 95 99 A F < + 0 0 0 -3,-1.2 3,-0.1 1,-0.2 239,-0.1 -0.686 17.2 135.3 -72.5 107.4 -19.8 11.1 8.7 96 100 A N + 0 0 94 -2,-0.9 2,-0.4 1,-0.2 -41,-0.3 0.508 50.4 56.7-135.0 -14.1 -18.1 12.6 11.8 97 101 A D - 0 0 46 -3,-0.2 2,-0.4 -44,-0.1 -8,-0.2 -0.958 49.3-170.6-128.0 147.1 -16.5 9.7 13.7 98 102 A V - 0 0 1 -2,-0.4 -47,-2.5 -47,-0.3 2,-0.4 -0.997 4.2-171.4-131.2 130.1 -13.9 7.0 12.9 99 103 A Y E -DE 50 86B 3 -13,-2.0 -13,-1.9 -2,-0.4 2,-0.4 -0.999 9.7-156.0-119.5 127.6 -13.1 4.0 15.2 100 104 A L E -DE 49 85B 5 -51,-2.0 -51,-2.9 -2,-0.4 2,-0.5 -0.864 3.9-154.6-107.4 138.9 -10.1 1.8 14.4 101 105 A V E +DE 48 84B 0 -17,-2.9 -18,-2.9 -2,-0.4 -17,-1.6 -0.950 21.9 156.9-120.0 125.6 -9.8 -1.8 15.7 102 106 A T E -D 47 0B 28 -55,-2.1 -55,-2.2 -2,-0.5 -20,-0.1 -0.773 49.2 -75.2-132.4 175.6 -6.6 -3.8 16.2 103 107 A H E -D 46 0B 58 -22,-0.3 2,-0.8 -2,-0.2 -57,-0.3 -0.411 46.3-123.0 -67.1 153.0 -5.4 -6.7 18.3 104 108 A L - 0 0 40 -59,-1.5 2,-0.3 -2,-0.1 -59,-0.1 -0.873 25.9-161.3-102.9 102.7 -4.9 -6.0 22.0 105 109 A M - 0 0 23 -2,-0.8 46,-0.2 1,-0.1 45,-0.1 -0.637 28.0-114.0 -82.3 140.3 -1.3 -6.8 23.0 106 110 A G S S- 0 0 62 -2,-0.3 45,-0.2 43,-0.1 2,-0.2 0.877 77.6 -41.2 -30.0 -66.4 -0.7 -7.3 26.7 107 111 A A E -H 150 0C 29 43,-2.5 43,-1.5 44,-0.1 2,-0.3 -0.507 61.4-100.6-146.7-157.5 1.5 -4.3 27.2 108 112 A D E >> -H 149 0C 43 41,-0.3 4,-1.8 -2,-0.2 3,-1.5 -0.928 38.4 -95.5-141.0 172.5 4.4 -2.3 25.6 109 113 A L T 34 S+ 0 0 8 39,-2.0 37,-0.2 36,-0.9 40,-0.1 0.741 120.6 66.3 -60.8 -19.6 8.1 -2.0 26.0 110 114 A N T 34 S+ 0 0 101 35,-1.1 -1,-0.3 1,-0.2 36,-0.1 0.876 108.2 38.8 -66.9 -36.6 7.5 1.0 28.2 111 115 A N T <4 0 0 108 -3,-1.5 -2,-0.2 34,-0.2 -1,-0.2 0.943 360.0 360.0 -69.7 -54.4 5.9 -1.4 30.8 112 116 A I < 0 0 89 -4,-1.8 -1,-0.0 38,-0.0 -5,-0.0 -0.475 360.0 360.0 -88.4 360.0 8.2 -4.4 30.5 113 ! 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 0.0 114 122 A L 0 0 94 0, 0.0 2,-0.0 0, 0.0 97,-0.0 0.000 360.0 360.0 360.0 125.3 15.7 -8.7 30.5 115 123 A T > - 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0 0 42 -2,-0.3 -9,-0.1 1,-0.2 -10,-0.0 -0.592 27.0-146.8 -67.3 125.6 17.7 5.6 29.3 214 222 A L S S+ 0 0 34 -2,-0.4 -1,-0.2 -11,-0.4 -34,-0.1 0.952 86.0 14.2 -62.1 -50.7 20.8 6.1 27.1 215 223 A F + 0 0 5 -36,-0.4 2,-1.3 -3,-0.1 -1,-0.3 -0.807 62.4 174.9-132.9 90.6 20.1 9.8 26.4 216 224 A P - 0 0 57 0, 0.0 2,-0.0 0, 0.0 -37,-0.0 -0.548 22.6-177.1 -90.8 67.4 17.7 11.5 28.8 217 225 A G - 0 0 1 -2,-1.3 -38,-0.1 1,-0.1 3,-0.1 -0.344 27.5-148.8 -68.7 146.3 18.2 15.0 27.3 218 226 A T S S- 0 0 102 1,-0.1 2,-0.3 -40,-0.0 -1,-0.1 0.532 79.8 -10.4 -92.1 -7.9 16.4 17.9 29.0 219 227 A D S > S- 0 0 76 -41,-0.0 4,-2.2 1,-0.0 5,-0.2 -0.919 90.7 -74.4-170.3-176.5 16.2 19.9 25.6 220 228 A H H > S+ 0 0 91 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.894 127.9 41.8 -63.8 -39.0 17.7 19.7 22.1 221 229 A I H > S+ 0 0 46 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.910 114.3 48.9 -76.9 -46.6 21.1 20.9 23.0 222 230 A D H > S+ 0 0 46 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.898 112.5 51.0 -58.5 -43.6 21.5 18.9 26.3 223 231 A Q H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.975 108.6 50.4 -54.0 -57.1 20.4 15.8 24.3 224 232 A L H X S+ 0 0 2 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.843 110.2 53.1 -49.9 -35.0 23.0 16.6 21.6 225 233 A K H X S+ 0 0 100 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.955 107.4 47.9 -68.3 -48.5 25.5 16.8 24.5 226 234 A L H X S+ 0 0 29 -4,-2.4 4,-0.9 1,-0.2 -2,-0.2 0.879 113.0 50.3 -59.8 -42.3 24.6 13.4 25.9 227 235 A I H >X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 3,-0.6 0.888 109.0 49.2 -58.8 -47.9 24.9 11.8 22.4 228 236 A L H 3X S+ 0 0 3 -4,-1.8 4,-0.7 1,-0.3 5,-0.3 0.722 101.7 63.3 -74.7 -22.1 28.3 13.3 21.6 229 237 A R H 3< S+ 0 0 132 -4,-1.5 -1,-0.3 3,-0.2 -2,-0.2 0.830 115.9 32.7 -65.7 -31.8 29.7 12.2 24.9 230 238 A L H << S+ 0 0 5 -4,-0.9 30,-2.5 -3,-0.6 -2,-0.2 0.943 130.8 28.4 -85.1 -65.3 29.0 8.6 23.7 231 239 A V H < S- 0 0 19 -4,-2.6 28,-0.3 28,-0.2 -3,-0.2 0.764 108.8-127.0 -75.2 -20.7 29.5 8.6 19.9 232 240 A G < - 0 0 7 -4,-0.7 -3,-0.2 -5,-0.5 3,-0.1 0.276 35.7 -55.6 86.8 140.5 32.0 11.5 20.1 233 241 A T - 0 0 24 24,-1.8 26,-0.2 -5,-0.3 18,-0.0 -0.212 68.1 -99.5 -47.4 134.1 32.1 14.7 18.2 234 242 A P - 0 0 13 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.109 35.2-132.1 -51.1 151.8 32.0 14.3 14.3 235 243 A G > - 0 0 45 -3,-0.1 4,-2.6 1,-0.0 3,-0.5 -0.287 41.0 -80.2 -91.0-176.5 35.2 14.5 12.3 236 244 A A H > S+ 0 0 71 1,-0.2 4,-1.9 2,-0.2 -1,-0.0 0.899 128.4 63.6 -44.0 -41.7 35.8 16.5 9.2 237 245 A E H 4 S+ 0 0 133 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.839 111.4 31.8 -66.9 -35.9 34.0 13.7 7.3 238 246 A L H >4 S+ 0 0 13 -3,-0.5 3,-2.4 2,-0.1 -1,-0.2 0.894 112.5 63.1 -80.8 -44.1 30.6 14.1 9.0 239 247 A L H >< S+ 0 0 29 -4,-2.6 3,-1.9 1,-0.3 -2,-0.2 0.822 94.4 61.7 -47.1 -41.2 31.0 17.9 9.4 240 248 A K T 3< S+ 0 0 151 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.1 0.584 97.9 60.0 -65.9 -13.8 31.1 18.5 5.6 241 249 A K T < S+ 0 0 62 -3,-2.4 2,-0.6 -4,-0.1 -50,-0.3 0.386 81.6 101.9 -92.5 2.4 27.6 17.0 5.4 242 250 A I < - 0 0 8 -3,-1.9 -52,-0.2 -4,-0.2 -53,-0.1 -0.807 44.8-177.8-100.6 116.8 26.0 19.6 7.6 243 251 A S + 0 0 93 -54,-0.7 -1,-0.2 -2,-0.6 -54,-0.1 0.982 63.5 79.0 -73.2 -65.0 24.1 22.3 5.8 244 252 A S > - 0 0 41 -56,-0.2 4,-0.6 1,-0.1 -2,-0.0 -0.264 66.1-156.8 -44.6 116.5 23.0 24.5 8.8 245 253 A E H > S+ 0 0 133 2,-0.2 4,-2.0 1,-0.2 -1,-0.1 0.805 93.3 53.9 -70.6 -31.9 26.0 26.7 9.9 246 254 A S H > S+ 0 0 74 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.865 102.3 57.7 -72.5 -35.9 24.6 27.0 13.4 247 255 A A H > S+ 0 0 9 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.784 108.1 48.3 -60.7 -28.1 24.4 23.3 13.8 248 256 A R H >X S+ 0 0 60 -4,-0.6 4,-2.7 2,-0.2 3,-0.8 0.922 105.7 56.7 -78.2 -45.2 28.1 23.2 13.0 249 257 A N H 3X S+ 0 0 80 -4,-2.0 4,-1.5 1,-0.3 5,-0.3 0.909 104.2 52.7 -51.1 -49.5 28.9 25.9 15.6 250 258 A Y H 3X S+ 0 0 113 -4,-2.2 4,-1.5 2,-0.2 -1,-0.3 0.833 114.9 43.9 -53.9 -34.6 27.3 23.9 18.4 251 259 A I H << S+ 0 0 1 -3,-0.8 -2,-0.2 -4,-0.7 -1,-0.2 0.971 115.2 42.6 -77.7 -56.2 29.5 20.9 17.4 252 260 A Q H < S+ 0 0 115 -4,-2.7 4,-0.2 1,-0.2 -2,-0.2 0.646 120.6 46.5 -63.9 -17.1 32.9 22.6 16.9 253 261 A S H < S+ 0 0 85 -4,-1.5 2,-1.2 -5,-0.3 -1,-0.2 0.812 85.6 87.5 -97.7 -41.5 32.3 24.7 20.0 254 262 A L S < S- 0 0 37 -4,-1.5 3,-0.4 -5,-0.3 -21,-0.1 -0.530 109.2 -88.3 -65.4 96.9 31.1 22.1 22.6 255 263 A T - 0 0 116 -2,-1.2 -1,-0.1 1,-0.2 -2,-0.1 0.362 58.6 -88.1 -14.1 110.7 34.5 21.0 23.9 256 264 A Q - 0 0 118 -4,-0.2 -1,-0.2 1,-0.1 -4,-0.1 0.045 47.3-150.9 -42.9 108.1 35.6 18.1 21.6 257 265 A M - 0 0 62 -3,-0.4 -24,-1.8 -23,-0.0 2,-0.2 -0.697 7.6-133.7 -86.9 124.6 34.2 14.8 23.0 258 266 A P - 0 0 99 0, 0.0 -26,-0.3 0, 0.0 2,-0.1 -0.592 27.6-106.4 -75.6 139.3 36.1 11.5 22.4 259 267 A K - 0 0 112 -28,-0.3 -28,-0.2 -2,-0.2 2,-0.1 -0.374 41.4-130.4 -54.2 135.5 34.1 8.5 21.2 260 268 A M - 0 0 67 -30,-2.5 2,-0.7 -2,-0.1 -1,-0.1 -0.466 18.4-100.0 -91.7 163.3 33.8 6.0 24.1 261 269 A N >> - 0 0 108 1,-0.2 4,-1.5 -2,-0.1 3,-0.8 -0.781 27.6-151.7 -78.8 116.1 34.5 2.3 24.2 262 270 A F H 3> S+ 0 0 3 -2,-0.7 4,-3.1 1,-0.3 -1,-0.2 0.789 92.7 64.0 -64.7 -30.2 31.1 0.7 23.9 263 271 A A H 34 S+ 0 0 59 1,-0.2 -1,-0.3 2,-0.2 6,-0.2 0.879 105.0 45.9 -57.7 -39.5 32.4 -2.4 25.9 264 272 A N H X4 S+ 0 0 101 -3,-0.8 3,-0.6 1,-0.1 -1,-0.2 0.833 114.7 48.2 -71.2 -34.2 32.9 -0.1 29.0 265 273 A V H 3< S+ 0 0 50 -4,-1.5 2,-0.5 1,-0.2 -2,-0.2 0.943 121.5 32.4 -73.8 -46.4 29.6 1.5 28.5 266 274 A F T >< S- 0 0 6 -4,-3.1 3,-1.7 -5,-0.1 -1,-0.2 -0.408 89.5-179.2-105.1 56.2 27.5 -1.7 28.1 267 275 A I T < + 0 0 139 -3,-0.6 -3,-0.1 -2,-0.5 3,-0.1 -0.230 63.6 17.2 -67.4 141.9 29.7 -3.8 30.4 268 276 A G T 3 S+ 0 0 86 1,-0.3 -1,-0.3 -5,-0.2 2,-0.1 0.328 96.0 127.6 82.1 -8.2 28.7 -7.5 30.9 269 277 A A S < S- 0 0 27 -3,-1.7 -1,-0.3 -6,-0.2 5,-0.1 -0.396 76.9 -81.8 -72.2 153.9 26.5 -7.4 27.8 270 278 A N > - 0 0 54 1,-0.1 4,-1.5 -3,-0.1 -1,-0.1 -0.363 38.2-134.4 -49.4 130.5 26.9 -9.9 24.9 271 279 A P H > S+ 0 0 100 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.811 108.3 53.2 -62.1 -35.4 29.9 -8.7 22.8 272 280 A L H > S+ 0 0 74 2,-0.2 4,-1.5 1,-0.2 27,-0.3 0.874 107.1 54.0 -64.6 -37.5 27.9 -9.3 19.6 273 281 A A H > S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.865 107.7 49.9 -58.3 -39.5 25.2 -7.2 21.2 274 282 A V H X S+ 0 0 16 -4,-1.5 4,-1.7 1,-0.2 -2,-0.2 0.898 108.0 53.3 -66.1 -40.9 27.8 -4.4 21.7 275 283 A D H X S+ 0 0 61 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.798 107.0 50.6 -66.4 -33.9 28.9 -4.7 18.0 276 284 A L H X S+ 0 0 0 -4,-1.5 4,-1.1 2,-0.2 -1,-0.2 0.880 108.4 52.7 -71.6 -38.1 25.4 -4.2 16.7 277 285 A L H X S+ 0 0 0 -4,-1.5 4,-3.2 2,-0.2 -2,-0.2 0.870 107.0 53.5 -59.2 -38.8 24.9 -1.1 18.9 278 286 A E H < S+ 0 0 57 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.875 110.9 45.1 -70.4 -35.7 28.2 0.3 17.4 279 287 A K H < S+ 0 0 95 -4,-1.4 10,-1.8 1,-0.1 -1,-0.2 0.669 119.1 44.2 -74.2 -19.4 26.8 -0.2 13.9 280 288 A M H < S+ 0 0 0 -4,-1.1 2,-1.1 8,-0.2 -2,-0.2 0.829 104.5 61.4 -92.9 -38.7 23.5 1.4 15.0 281 289 A L S < S+ 0 0 4 -4,-3.2 2,-0.4 -5,-0.1 -1,-0.2 -0.410 72.6 123.6 -94.4 57.5 24.7 4.3 17.0 282 290 A V - 0 0 41 -2,-1.1 6,-0.1 -3,-0.2 -83,-0.0 -0.939 56.9-140.2-115.8 143.9 26.6 6.3 14.4 283 291 A L S S+ 0 0 13 -2,-0.4 2,-0.8 -52,-0.1 -99,-0.2 0.897 81.8 85.4 -68.1 -42.3 25.9 10.0 13.5 284 292 A D >> - 0 0 16 1,-0.2 3,-1.8 2,-0.1 4,-1.2 -0.519 62.9-162.7 -67.3 105.6 26.4 9.6 9.8 285 293 A S T 34 S+ 0 0 2 -2,-0.8 -90,-0.2 1,-0.3 -1,-0.2 0.573 88.3 62.1 -68.8 -12.6 23.1 8.5 8.5 286 294 A D T 34 S+ 0 0 79 1,-0.1 -1,-0.3 -93,-0.0 -2,-0.1 0.715 110.9 38.0 -78.9 -22.9 24.7 7.4 5.3 287 295 A K T <4 S+ 0 0 159 -3,-1.8 -2,-0.2 2,-0.1 -1,-0.1 0.546 87.6 114.8-108.5 -11.8 26.9 4.8 7.2 288 296 A R S < S- 0 0 7 -4,-1.2 -8,-0.2 -6,-0.1 2,-0.1 -0.299 76.5-103.4 -59.7 141.8 24.3 3.6 9.8 289 297 A I - 0 0 17 -10,-1.8 -1,-0.1 -13,-0.2 -91,-0.1 -0.409 37.4-128.2 -67.4 140.2 23.3 -0.0 9.4 290 298 A T > - 0 0 48 -2,-0.1 4,-1.9 1,-0.1 5,-0.1 -0.309 21.5-106.1 -79.1 172.3 19.9 -0.7 7.7 291 299 A A H > S+ 0 0 2 2,-0.2 4,-1.5 3,-0.1 -160,-0.1 0.936 121.7 46.0 -56.0 -50.8 17.0 -2.8 9.0 292 300 A A H > S+ 0 0 47 1,-0.2 4,-0.7 2,-0.2 -1,-0.1 0.929 114.3 46.3 -66.8 -44.0 17.8 -5.5 6.4 293 301 A Q H >4 S+ 0 0 119 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.847 109.9 54.9 -64.3 -34.1 21.6 -5.5 7.1 294 302 A A H >< S+ 0 0 0 -4,-1.9 3,-1.9 1,-0.2 -1,-0.2 0.861 98.2 64.2 -67.0 -31.6 21.0 -5.6 10.8 295 303 A L H 3< S+ 0 0 1 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.789 103.0 48.6 -60.3 -28.7 18.9 -8.7 10.3 296 304 A A T << S+ 0 0 64 -4,-0.7 -1,-0.3 -3,-0.7 2,-0.2 0.172 83.2 122.1 -98.3 11.0 22.0 -10.5 9.1 297 305 A H S X S- 0 0 22 -3,-1.9 3,-2.8 1,-0.1 7,-0.1 -0.535 75.5-114.6 -80.7 148.2 24.3 -9.5 12.0 298 306 A A G > S+ 0 0 52 1,-0.3 3,-2.7 -2,-0.2 4,-0.2 0.804 109.2 73.7 -55.8 -30.3 25.9 -12.3 13.9 299 307 A Y G 3 S+ 0 0 6 1,-0.3 3,-0.3 -27,-0.3 -1,-0.3 0.712 98.7 46.1 -59.1 -21.3 23.9 -11.2 17.0 300 308 A F G <> S+ 0 0 0 -3,-2.8 4,-1.9 -6,-0.2 3,-0.4 0.164 70.8 122.5-108.6 19.3 20.8 -12.6 15.6 301 309 A A T <4 S+ 0 0 74 -3,-2.7 -1,-0.2 1,-0.2 -2,-0.1 0.779 76.3 53.8 -48.6 -30.5 22.2 -15.9 14.4 302 310 A Q T 4 S+ 0 0 153 -3,-0.3 -1,-0.2 -4,-0.2 -2,-0.1 0.930 119.2 27.2 -74.8 -46.2 19.6 -17.7 16.5 303 311 A Y T 4 S+ 0 0 65 -3,-0.4 -2,-0.2 -183,-0.0 -1,-0.2 0.498 94.8 117.4 -95.7 -1.4 16.5 -16.0 15.2 304 312 A H < + 0 0 64 -4,-1.9 -8,-0.1 -7,-0.1 5,-0.0 -0.398 25.8 159.8 -81.3 137.2 17.6 -15.2 11.6 305 313 A D > - 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