==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-JAN-08 3BV2 . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.S.SACK . 337 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16691.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 214 63.5 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 . 38 11.3 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 . 28 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 12.8 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 . 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 2 1 0 1 1 0 1 0 1 1 1 0 1 0 0 1 0 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 3 2 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 182 0, 0.0 2,-0.2 0, 0.0 89,-0.0 0.000 360.0 360.0 360.0 174.5 -24.0 -2.8 7.3 2 6 A P - 0 0 82 0, 0.0 2,-0.5 0, 0.0 0, 0.0 -0.534 360.0 -80.6-118.7-161.2 -23.9 -4.3 10.8 3 7 A T - 0 0 81 -2,-0.2 15,-2.5 2,-0.0 16,-0.3 -0.902 40.6-164.1-112.2 129.4 -25.5 -3.2 14.1 4 8 A F E -A 17 0A 44 -2,-0.5 2,-0.3 13,-0.3 11,-0.1 -0.404 5.4-161.3-101.6 178.8 -24.2 -0.5 16.3 5 9 A Y E -A 16 0A 52 11,-0.7 11,-1.4 -2,-0.1 2,-0.0 -0.840 14.4-133.8-165.7 121.7 -24.8 0.6 19.9 6 10 A R + 0 0 159 -2,-0.3 2,-0.2 9,-0.2 9,-0.2 -0.275 33.7 147.8 -74.6 164.7 -24.1 3.9 21.7 7 11 A Q - 0 0 61 2,-0.0 7,-4.1 -2,-0.0 2,-0.4 -0.807 34.7-124.8 170.8 148.9 -22.4 4.3 25.1 8 12 A E E +B 13 0B 145 5,-0.3 2,-0.4 -2,-0.2 5,-0.2 -0.912 21.5 179.7-117.2 141.2 -20.1 6.8 26.8 9 13 A L E > S-B 12 0B 26 3,-2.9 2,-3.6 -2,-0.4 3,-3.1 -0.999 71.0 -13.7-138.3 137.2 -16.8 6.3 28.5 10 14 A N T 3 S- 0 0 100 -2,-0.4 3,-0.1 1,-0.3 -2,-0.0 -0.168 130.0 -52.8 69.2 -51.1 -14.5 8.8 30.2 11 15 A K T 3 S+ 0 0 203 -2,-3.6 2,-0.4 1,-0.3 -1,-0.3 0.218 119.0 101.4 157.4 13.5 -16.6 11.5 28.6 12 16 A T E < -B 9 0B 36 -3,-3.1 -3,-2.9 2,-0.0 -1,-0.3 -0.968 68.6-125.3-121.5 134.5 -16.4 10.4 25.0 13 17 A I E -B 8 0B 41 -2,-0.4 2,-0.5 -5,-0.2 -5,-0.3 -0.561 16.8-151.4 -82.4 145.7 -19.2 8.5 23.2 14 18 A W - 0 0 1 -7,-4.1 2,-0.9 -2,-0.2 -9,-0.1 -0.943 11.2-174.6-122.9 109.8 -18.6 5.1 21.6 15 19 A E + 0 0 49 -2,-0.5 -9,-0.2 -9,-0.2 84,-0.0 -0.833 29.2 157.4-102.2 93.1 -20.6 4.0 18.6 16 20 A V E -A 5 0A 1 -11,-1.4 -11,-0.7 -2,-0.9 -2,-0.1 -0.856 44.7 -96.5-122.3 158.2 -19.5 0.5 17.9 17 21 A P E > -A 4 0A 5 0, 0.0 3,-1.9 0, 0.0 -13,-0.3 -0.261 38.7-113.4 -63.9 151.0 -20.7 -2.7 16.2 18 22 A E T 3 S+ 0 0 103 -15,-2.5 -14,-0.1 1,-0.3 22,-0.1 0.702 108.5 79.1 -60.8 -20.6 -22.3 -5.4 18.4 19 23 A R T 3 S+ 0 0 52 -16,-0.3 21,-3.1 20,-0.1 2,-0.5 0.682 85.5 69.7 -62.7 -17.0 -19.3 -7.7 17.6 20 24 A Y E < +C 39 0C 1 -3,-1.9 2,-0.3 19,-0.2 19,-0.2 -0.911 66.7 171.2-107.3 122.8 -17.3 -5.7 20.2 21 25 A Q E +C 38 0C 71 17,-2.0 17,-3.1 -2,-0.5 -2,-0.0 -0.878 49.3 36.3-126.7 161.3 -18.3 -6.1 23.9 22 26 A N E - 0 0 122 -2,-0.3 2,-0.8 15,-0.2 -1,-0.2 0.928 66.4-163.9 67.7 46.8 -16.8 -5.1 27.2 23 27 A L E + 0 0 14 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.514 13.4 176.2 -67.1 108.4 -15.5 -1.7 26.1 24 28 A S E -C 36 0C 51 12,-2.9 12,-3.1 -2,-0.8 -15,-0.0 -0.969 32.5-113.7-115.9 123.7 -13.0 -0.8 28.9 25 29 A P E +C 35 0C 55 0, 0.0 10,-0.2 0, 0.0 3,-0.1 -0.091 31.4 178.6 -54.0 155.2 -11.0 2.4 28.5 26 30 A V E - 0 0 39 8,-2.3 2,-0.3 1,-0.4 9,-0.2 0.631 60.4 -35.9-122.8 -47.9 -7.3 2.1 28.1 27 31 A G E -C 34 0C 17 7,-1.4 7,-3.4 2,-0.0 -1,-0.4 -0.913 52.4-160.0-177.0 151.2 -6.0 5.7 27.6 28 32 A S + 0 0 49 5,-0.3 5,-0.2 -2,-0.3 3,-0.1 -0.362 41.8 80.1-122.1-156.6 -7.1 8.9 26.0 29 33 A G >> + 0 0 49 1,-0.2 4,-1.1 -2,-0.1 3,-0.7 0.193 64.8 62.2 72.2 164.0 -5.4 12.1 24.8 30 34 A A T 34 S- 0 0 80 1,-0.2 -1,-0.2 2,-0.2 -2,-0.0 -0.782 120.8 -44.1 89.5-121.3 -3.6 12.8 21.6 31 35 A Y T 34 S+ 0 0 91 -2,-0.5 21,-2.0 -3,-0.1 -1,-0.2 -0.016 131.4 33.7-127.5 21.1 -5.7 12.3 18.5 32 36 A G T <4 - 0 0 4 -3,-0.7 18,-0.3 19,-0.3 -2,-0.2 0.658 57.8-159.4-139.0 -71.4 -7.3 9.1 19.8 33 37 A S < - 0 0 8 -4,-1.1 17,-1.5 -5,-0.2 2,-0.3 0.655 30.9-148.7 68.9 119.4 -8.3 7.6 23.1 34 38 A V E -CD 27 49C 23 -7,-3.4 -8,-2.3 15,-0.2 -7,-1.4 -0.912 12.1-155.3-127.3 156.4 -8.5 3.8 23.0 35 39 A C E -CD 25 48C 1 13,-3.0 13,-3.2 -2,-0.3 2,-0.4 -0.935 16.4-130.1-126.9 153.0 -10.5 1.0 24.6 36 40 A A E +CD 24 47C 10 -12,-3.1 -12,-2.9 -2,-0.3 2,-0.3 -0.815 39.5 163.4 -97.5 136.3 -10.0 -2.7 25.1 37 41 A A E - D 0 46C 0 9,-2.5 9,-2.7 -2,-0.4 2,-0.5 -0.914 38.8-103.2-145.8 173.3 -12.8 -4.9 24.0 38 42 A F E -CD 21 45C 71 -17,-3.1 -17,-2.0 -2,-0.3 2,-0.9 -0.914 25.1-142.1-106.7 126.1 -13.8 -8.5 23.2 39 43 A D E >>> -CD 20 44C 2 5,-3.5 4,-2.5 -2,-0.5 3,-0.8 -0.774 14.0-171.7 -88.4 106.1 -14.1 -9.5 19.6 40 44 A T T 345S+ 0 0 77 -21,-3.1 -1,-0.2 -2,-0.9 -20,-0.1 0.798 82.4 60.8 -70.3 -28.0 -17.1 -11.9 19.4 41 45 A K T 345S+ 0 0 150 -22,-0.3 -1,-0.2 1,-0.2 -21,-0.1 0.737 123.8 21.0 -71.0 -19.3 -16.4 -12.8 15.8 42 46 A T T <45S- 0 0 66 -3,-0.8 -2,-0.2 2,-0.2 -1,-0.2 0.529 94.3-127.1-123.2 -16.0 -13.0 -14.2 16.8 43 47 A G T <5S+ 0 0 40 -4,-2.5 2,-0.2 1,-0.3 -3,-0.2 0.554 73.7 119.9 74.6 7.4 -13.2 -14.8 20.5 44 48 A L E < -D 39 0C 87 -5,-0.7 -5,-3.5 -6,-0.0 2,-0.3 -0.648 69.3-110.9-104.3 159.9 -10.1 -12.7 20.8 45 49 A R E -D 38 0C 109 -7,-0.2 59,-1.9 -2,-0.2 2,-0.3 -0.715 39.7-171.0 -89.9 138.2 -9.4 -9.4 22.7 46 50 A V E -DE 37 103C 0 -9,-2.7 -9,-2.5 -2,-0.3 2,-0.5 -0.874 24.2-126.4-129.5 161.4 -8.9 -6.3 20.6 47 51 A A E -DE 36 102C 18 55,-3.5 55,-2.6 -2,-0.3 2,-0.5 -0.919 24.6-164.1-107.4 129.2 -7.9 -2.7 20.9 48 52 A V E -DE 35 101C 1 -13,-3.2 -13,-3.0 -2,-0.5 2,-0.6 -0.974 1.4-163.8-119.4 122.7 -10.3 -0.2 19.4 49 53 A K E -DE 34 100C 33 51,-3.6 51,-2.3 -2,-0.5 2,-0.7 -0.921 4.3-162.2-108.7 118.0 -9.2 3.4 18.8 50 54 A K E - E 0 99C 23 -17,-1.5 49,-0.2 -2,-0.6 2,-0.1 -0.880 24.7-133.5 -96.6 114.6 -11.8 6.1 18.2 51 55 A L - 0 0 10 47,-2.4 2,-0.5 -2,-0.7 47,-0.3 -0.443 17.4-119.0 -68.1 145.1 -10.1 9.0 16.6 52 56 A S S S- 0 0 45 -21,-2.0 4,-0.2 1,-0.2 -1,-0.1 -0.751 82.7 -24.0 -89.6 125.6 -10.8 12.4 18.0 53 57 A R S > S- 0 0 171 -2,-0.5 3,-1.7 1,-0.1 4,-0.4 0.897 76.2-169.0 39.1 58.7 -12.4 14.9 15.6 54 58 A P T 3 S+ 0 0 3 0, 0.0 10,-0.3 0, 0.0 9,-0.1 0.756 80.3 25.3 -45.7 -38.1 -11.0 12.9 12.6 55 59 A F T 3 S+ 0 0 17 41,-0.4 -2,-0.1 1,-0.1 270,-0.1 -0.073 83.7 114.2-125.6 33.5 -11.8 15.6 10.1 56 60 A Q S < S+ 0 0 111 -3,-1.7 2,-0.2 -4,-0.2 -1,-0.1 0.883 87.0 11.8 -72.3 -39.5 -11.9 18.8 12.2 57 61 A S S > S- 0 0 39 -4,-0.4 4,-2.8 -3,-0.1 5,-0.1 -0.778 81.8-104.0-130.8 174.8 -8.9 20.3 10.4 58 62 A I H > S+ 0 0 76 -2,-0.2 4,-2.2 2,-0.2 5,-0.2 0.821 122.7 50.7 -70.3 -32.2 -6.8 19.7 7.3 59 63 A I H > S+ 0 0 99 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.889 113.8 46.0 -71.0 -38.1 -4.0 18.3 9.4 60 64 A H H > S+ 0 0 30 2,-0.2 4,-2.0 3,-0.2 -2,-0.2 0.915 112.7 48.8 -69.0 -46.2 -6.5 16.0 11.1 61 65 A A H X S+ 0 0 0 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.946 117.6 40.8 -58.4 -49.7 -8.2 15.0 7.9 62 66 A K H X S+ 0 0 31 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.806 114.3 51.4 -72.1 -32.3 -4.8 14.1 6.2 63 67 A R H X S+ 0 0 61 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.830 110.4 51.1 -73.7 -26.6 -3.4 12.5 9.4 64 68 A T H X S+ 0 0 6 -4,-2.0 4,-1.7 -10,-0.3 -2,-0.2 0.877 112.5 45.6 -72.6 -40.5 -6.6 10.4 9.5 65 69 A Y H X S+ 0 0 10 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.951 111.3 53.4 -66.1 -48.6 -6.0 9.4 5.9 66 70 A R H X S+ 0 0 73 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.876 110.9 44.4 -51.7 -50.9 -2.3 8.7 6.4 67 71 A E H X S+ 0 0 29 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.904 113.2 50.1 -66.0 -43.4 -2.9 6.4 9.3 68 72 A L H X S+ 0 0 1 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.934 113.6 45.5 -60.6 -46.1 -5.7 4.5 7.6 69 73 A R H X S+ 0 0 36 -4,-2.7 4,-1.5 2,-0.2 -1,-0.2 0.873 114.3 50.0 -63.0 -41.1 -3.7 4.0 4.5 70 74 A L H >X S+ 0 0 46 -4,-2.1 4,-2.0 -5,-0.3 3,-0.6 0.972 112.2 44.6 -61.7 -59.1 -0.6 2.9 6.5 71 75 A L H 3< S+ 0 0 23 -4,-3.0 11,-0.7 1,-0.2 -1,-0.2 0.825 111.1 56.6 -56.9 -32.1 -2.5 0.4 8.7 72 76 A K H 3< S+ 0 0 33 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.865 110.1 44.0 -68.4 -34.7 -4.2 -0.9 5.5 73 77 A H H << S+ 0 0 41 -4,-1.5 2,-0.7 -3,-0.6 235,-0.2 0.831 89.1 99.1 -80.0 -35.7 -0.8 -1.6 3.8 74 78 A M < + 0 0 17 -4,-2.0 2,-0.5 -5,-0.1 8,-0.4 -0.407 35.8 158.7 -65.4 104.7 1.0 -3.2 6.8 75 79 A K + 0 0 157 -2,-0.7 2,-0.3 6,-0.1 -1,-0.1 -0.762 32.6 111.3-126.0 83.2 1.0 -7.0 6.5 76 80 A H > - 0 0 19 -2,-0.5 3,-1.0 3,-0.4 57,-0.1 -0.986 67.9-121.5-154.8 151.1 3.8 -8.2 8.7 77 81 A E T 3 S+ 0 0 118 -2,-0.3 4,-0.1 1,-0.2 56,-0.1 0.690 110.6 43.8 -68.3 -28.1 4.2 -10.2 12.0 78 82 A N T 3 S+ 0 0 5 83,-0.1 84,-2.6 2,-0.1 2,-0.4 0.211 102.7 79.5-105.7 14.8 6.2 -7.5 13.8 79 83 A V B < S-g 162 0D 5 -3,-1.0 -3,-0.4 82,-0.3 84,-0.2 -0.992 93.0-100.7-125.2 129.4 4.1 -4.6 12.7 80 84 A I - 0 0 21 82,-3.2 2,-0.3 -2,-0.4 -4,-0.1 -0.102 43.6-140.9 -42.5 136.4 0.7 -3.8 14.3 81 85 A G - 0 0 21 -4,-0.1 2,-0.9 -6,-0.1 22,-0.4 -0.850 8.1-124.2-112.3 145.9 -2.1 -5.1 12.1 82 86 A L + 0 0 13 -11,-0.7 20,-0.2 -8,-0.4 3,-0.1 -0.760 27.3 175.6 -90.0 106.8 -5.5 -3.6 11.2 83 87 A L - 0 0 32 18,-2.4 2,-0.3 -2,-0.9 19,-0.2 0.848 67.5 -17.2 -75.9 -38.2 -8.2 -6.1 12.1 84 88 A D E -F 101 0C 21 17,-1.4 17,-2.7 253,-0.1 2,-0.4 -0.960 49.1-156.5-168.9 149.5 -11.0 -3.7 11.2 85 89 A V E +F 100 0C 7 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.996 28.4 164.1-130.2 134.8 -12.0 -0.1 10.5 86 90 A F E -F 99 0C 15 13,-2.1 13,-2.4 -2,-0.4 -2,-0.0 -0.955 23.5-161.9-147.9 169.2 -15.5 1.1 10.9 87 91 A T - 0 0 10 -2,-0.3 11,-0.1 11,-0.2 8,-0.1 -0.989 27.3-132.6-149.1 146.6 -17.8 4.1 11.2 88 92 A P S S+ 0 0 46 0, 0.0 2,-0.4 0, 0.0 -84,-0.1 0.227 78.3 107.2 -85.9 18.1 -21.4 4.5 12.4 89 93 A A - 0 0 6 8,-0.2 -2,-0.2 1,-0.1 6,-0.1 -0.787 55.1-162.5 -97.6 139.4 -22.2 6.5 9.2 90 94 A R S S+ 0 0 177 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.539 76.3 26.7 -96.3 -9.1 -24.2 5.0 6.4 91 95 A S S >> S- 0 0 20 1,-0.1 4,-0.7 0, 0.0 3,-0.5 -0.959 81.3-110.3-147.5 163.4 -23.1 7.6 3.8 92 96 A L G >4 S+ 0 0 50 -2,-0.3 3,-0.9 1,-0.2 -1,-0.1 0.880 115.7 61.7 -61.9 -38.9 -20.2 9.8 3.1 93 97 A E G 34 S+ 0 0 149 1,-0.3 -1,-0.2 -3,-0.0 -4,-0.0 0.834 110.2 38.6 -57.0 -36.9 -22.3 12.8 3.9 94 98 A E G <4 S+ 0 0 135 -3,-0.5 2,-0.5 2,-0.0 -1,-0.3 0.477 85.8 127.4 -92.4 -5.8 -22.8 11.6 7.5 95 99 A F << + 0 0 0 -3,-0.9 3,-0.1 -4,-0.7 234,-0.1 -0.365 17.8 130.0 -58.7 106.9 -19.2 10.4 7.7 96 100 A N + 0 0 100 -2,-0.5 -41,-0.4 1,-0.2 2,-0.3 0.550 54.4 56.4-132.5 -23.8 -17.7 12.0 10.9 97 101 A D - 0 0 35 -3,-0.2 2,-0.4 -43,-0.1 -8,-0.2 -0.855 52.3-166.8-120.4 155.7 -16.1 9.3 13.0 98 102 A V - 0 0 0 -47,-0.3 -47,-2.4 -2,-0.3 2,-0.4 -0.985 2.8-171.7-142.9 124.7 -13.4 6.6 12.4 99 103 A Y E -EF 50 86C 0 -13,-2.4 -13,-2.1 -2,-0.4 2,-0.4 -0.960 5.7-163.2-119.4 135.8 -12.7 3.6 14.6 100 104 A L E -EF 49 85C 6 -51,-2.3 -51,-3.6 -2,-0.4 2,-0.4 -0.961 5.6-158.5-121.1 137.1 -9.6 1.4 14.1 101 105 A V E +EF 48 84C 0 -17,-2.7 -18,-2.4 -2,-0.4 -17,-1.4 -0.964 16.9 161.5-122.1 135.1 -9.2 -2.0 15.6 102 106 A T E -E 47 0C 25 -55,-2.6 -55,-3.5 -2,-0.4 -20,-0.1 -0.830 48.8 -73.4-136.9 174.0 -6.1 -4.1 16.3 103 107 A H E -E 46 0C 78 -22,-0.4 -57,-0.3 -57,-0.3 2,-0.3 -0.469 50.0-118.4 -68.1 145.0 -5.1 -7.1 18.4 104 108 A L - 0 0 63 -59,-1.9 2,-0.2 -67,-0.1 -59,-0.1 -0.631 35.2-145.1 -81.3 143.5 -4.9 -6.2 22.1 105 109 A M - 0 0 44 -2,-0.3 50,-0.2 1,-0.1 3,-0.1 -0.620 16.7-118.8-108.6 171.9 -1.3 -6.9 23.4 106 110 A G S S- 0 0 14 1,-0.3 2,-0.3 48,-0.3 49,-0.2 0.938 80.8 -29.5 -73.5 -51.1 0.2 -8.1 26.6 107 111 A A E -H 154 0D 15 47,-1.6 47,-1.9 62,-0.0 -1,-0.3 -0.982 58.9 -92.3-169.4 156.3 2.3 -5.1 27.5 108 112 A D E >> -H 153 0D 29 -2,-0.3 4,-1.4 45,-0.2 3,-1.0 -0.369 42.0-119.1 -64.9 148.8 4.3 -2.0 26.4 109 113 A L H 3> S+ 0 0 0 43,-2.1 4,-1.7 40,-1.9 5,-0.2 0.775 114.8 66.6 -62.0 -22.2 8.0 -2.7 26.0 110 114 A N H 3> S+ 0 0 56 39,-0.4 4,-1.9 42,-0.2 -1,-0.3 0.861 98.2 48.8 -67.3 -36.3 8.3 -0.1 28.7 111 115 A N H <> S+ 0 0 57 -3,-1.0 4,-1.5 2,-0.2 -2,-0.2 0.968 107.3 54.9 -67.6 -52.2 6.6 -2.3 31.3 112 116 A I H >X S+ 0 0 24 -4,-1.4 4,-1.5 1,-0.2 3,-0.6 0.904 115.6 37.1 -44.9 -56.9 8.8 -5.4 30.6 113 117 A V H 3< S+ 0 0 13 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.879 113.3 57.6 -64.8 -42.4 12.1 -3.5 31.1 114 118 A K H 3< S+ 0 0 168 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.683 108.5 50.7 -63.8 -18.9 10.7 -1.5 34.0 115 119 A C H << S- 0 0 89 -4,-1.5 2,-0.2 -3,-0.6 -2,-0.2 0.968 119.0 -17.9 -83.0 -70.5 9.8 -4.7 35.8 116 120 A Q S < S- 0 0 102 -4,-1.5 2,-0.8 0, 0.0 -1,-0.2 -0.684 72.1 -82.8-131.3-177.1 12.9 -6.9 35.8 117 121 A K - 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0 0 0 -2,-0.3 -1,-0.1 14,-0.3 14,-0.1 -0.102 27.0-114.6 -56.9 156.6 18.4 10.5 16.5 178 191 A P S > S+ 0 0 1 0, 0.0 4,-1.6 0, 0.0 3,-0.3 0.953 113.4 52.1 -63.0 -41.4 21.0 13.2 16.9 179 192 A E T 4 S+ 0 0 18 99,-0.3 2,-2.4 1,-0.2 6,-0.3 0.919 98.5 62.4 -58.4 -51.1 20.2 14.7 13.5 180 193 A I T 4 S+ 0 0 10 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 -0.330 110.3 39.5 -77.7 61.0 16.4 15.0 13.9 181 194 A M T 4 S+ 0 0 13 -2,-2.4 -1,-0.2 -3,-0.3 -2,-0.2 0.023 110.8 52.5-164.8 -53.4 16.7 17.4 16.8 182 195 A L S < S- 0 0 51 -4,-1.6 2,-1.0 1,-0.3 -2,-0.2 0.337 108.0-137.7 -73.5 7.3 19.6 19.6 15.6 183 196 A N + 0 0 119 -4,-0.2 2,-1.1 -5,-0.2 -1,-0.3 -0.585 48.4 158.7 73.0-102.5 17.3 19.8 12.6 184 197 A W - 0 0 61 -2,-1.0 -1,-0.2 -3,-0.1 54,-0.2 0.004 45.9-145.8 71.5 -32.4 19.7 19.4 9.7 185 198 A M S S+ 0 0 119 -2,-1.1 53,-0.1 -6,-0.3 -4,-0.0 -0.054 71.5 89.2 62.3-173.7 16.5 18.4 7.8 186 199 A H - 0 0 137 1,-0.1 2,-0.1 -6,-0.0 -1,-0.1 0.925 64.1-179.7 52.0 48.9 16.7 15.7 5.1 187 200 A Y - 0 0 101 -8,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.402 4.4-167.4 -75.8 155.3 16.2 13.0 7.7 188 201 A N > - 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0 0 117 1,-0.1 2,-0.1 -2,-0.1 -1,-0.1 -0.588 59.7-110.8 -66.5 121.6 34.2 21.4 23.9 251 264 A Q - 0 0 147 -2,-0.3 -1,-0.1 -4,-0.1 -4,-0.1 -0.412 37.4-157.1 -61.8 133.4 35.2 18.6 21.5 252 265 A M - 0 0 55 -2,-0.1 -24,-2.7 -23,-0.0 2,-0.2 -0.893 8.6-129.4-118.6 146.1 34.5 15.1 22.8 253 266 A P - 0 0 94 0, 0.0 -26,-0.3 0, 0.0 2,-0.1 -0.557 31.2-102.7 -88.9 154.7 36.0 11.7 21.9 254 267 A K - 0 0 122 -28,-0.2 -28,-0.2 -2,-0.2 2,-0.2 -0.486 43.1-127.4 -68.4 143.7 34.1 8.6 21.1 255 268 A M - 0 0 51 -30,-2.4 2,-0.8 -2,-0.1 3,-0.1 -0.566 19.3-104.2 -92.8 159.3 34.0 6.3 24.0 256 269 A N >> - 0 0 85 -2,-0.2 4,-1.6 1,-0.2 3,-1.5 -0.778 29.5-157.6 -80.0 108.9 34.9 2.6 24.1 257 270 A F H 3> S+ 0 0 1 -2,-0.8 4,-3.1 1,-0.3 -1,-0.2 0.810 90.6 63.7 -59.2 -34.0 31.5 0.9 24.1 258 271 A A H 34 S+ 0 0 47 1,-0.2 -1,-0.3 2,-0.2 5,-0.2 0.741 108.1 44.1 -61.9 -21.6 33.0 -2.2 25.6 259 272 A N H X4 S+ 0 0 113 -3,-1.5 3,-0.7 2,-0.1 -2,-0.2 0.830 115.2 48.0 -88.2 -37.4 33.9 -0.0 28.6 260 273 A V H 3< S+ 0 0 56 -4,-1.6 -2,-0.2 1,-0.2 -3,-0.2 0.800 120.6 34.2 -72.4 -36.1 30.5 1.6 28.6 261 274 A F T >< S+ 0 0 9 -4,-3.1 3,-1.5 -5,-0.1 -1,-0.2 -0.282 84.1 170.8-116.9 45.7 28.4 -1.6 28.4 262 275 A I T < + 0 0 124 -3,-0.7 3,-0.1 1,-0.2 -3,-0.1 -0.302 64.3 28.3 -62.9 139.0 30.6 -3.9 30.4 263 276 A G T 3 S+ 0 0 88 1,-0.5 -1,-0.2 -5,-0.2 2,-0.2 0.101 96.3 119.0 96.0 -18.4 29.2 -7.3 31.3 264 277 A A S < S- 0 0 24 -3,-1.5 -1,-0.5 1,-0.1 5,-0.1 -0.486 84.2 -83.8 -78.6 148.6 27.1 -7.1 28.2 265 278 A N >> - 0 0 49 1,-0.2 4,-1.9 -2,-0.2 3,-1.9 -0.313 36.3-133.4 -51.4 122.5 27.5 -9.7 25.4 266 279 A P H 3> S+ 0 0 106 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.727 108.8 57.2 -54.3 -20.1 30.5 -8.5 23.3 267 280 A L H 3> S+ 0 0 68 2,-0.2 4,-1.3 1,-0.2 27,-0.3 0.801 104.5 50.7 -79.8 -27.9 28.3 -9.2 20.3 268 281 A A H <> S+ 0 0 0 -3,-1.9 4,-2.9 2,-0.2 -1,-0.2 0.890 109.0 51.3 -73.5 -39.2 25.6 -6.9 21.7 269 282 A V H X S+ 0 0 9 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.898 107.1 53.3 -62.1 -42.5 28.2 -4.2 22.1 270 283 A D H X S+ 0 0 53 -4,-1.5 4,-1.3 2,-0.2 -1,-0.2 0.849 111.1 46.6 -63.1 -34.7 29.4 -4.6 18.6 271 284 A L H X S+ 0 0 0 -4,-1.3 4,-1.3 2,-0.2 3,-0.4 0.954 110.6 52.3 -71.9 -46.5 25.8 -4.2 17.4 272 285 A L H >X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.3 3,-0.7 0.894 107.2 54.1 -50.6 -47.5 25.4 -1.1 19.6 273 286 A E H 3< S+ 0 0 67 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.859 109.0 47.3 -57.6 -41.0 28.5 0.3 18.1 274 287 A K H 3< S+ 0 0 82 -4,-1.3 10,-2.1 -3,-0.4 -1,-0.2 0.671 118.0 41.5 -77.6 -16.8 27.1 -0.0 14.6 275 288 A M H << S+ 0 0 0 -4,-1.3 2,-1.2 -3,-0.7 -2,-0.2 0.802 103.2 63.8 -97.2 -39.4 23.8 1.5 15.5 276 289 A L S < S+ 0 0 4 -4,-2.8 2,-0.4 -5,-0.2 -1,-0.2 -0.382 71.5 137.9 -88.1 57.7 24.8 4.4 17.7 277 290 A V - 0 0 35 -2,-1.2 6,-0.1 -3,-0.2 -83,-0.0 -0.866 50.7-147.3-104.2 133.2 26.7 6.3 15.1 278 291 A L S S+ 0 0 30 -2,-0.4 2,-0.8 -52,-0.2 -99,-0.3 0.954 87.1 74.8 -61.3 -50.6 26.4 10.1 14.8 279 292 A D S >> S- 0 0 18 1,-0.2 3,-1.8 -3,-0.1 4,-0.8 -0.543 72.5-157.0 -70.6 108.2 26.8 9.9 11.0 280 293 A S T 34 S+ 0 0 11 -2,-0.8 3,-0.5 1,-0.3 -1,-0.2 0.800 88.4 63.8 -54.3 -34.4 23.6 8.6 9.6 281 294 A D T 34 S+ 0 0 98 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.1 0.710 105.4 44.9 -66.8 -19.6 25.3 7.3 6.5 282 295 A K T <4 S+ 0 0 109 -3,-1.8 -1,-0.2 2,-0.1 -2,-0.2 0.620 83.9 110.7-101.6 -14.0 27.4 4.9 8.5 283 296 A R S < S- 0 0 7 -4,-0.8 -8,-0.2 -3,-0.5 -9,-0.1 -0.216 78.3-103.3 -55.9 151.7 24.8 3.4 10.8 284 297 A I - 0 0 15 -10,-2.1 2,-0.2 -13,-0.2 -1,-0.1 -0.386 36.3-122.0 -71.8 155.4 24.0 -0.2 10.0 285 298 A T > - 0 0 54 1,-0.1 4,-2.3 -3,-0.1 5,-0.2 -0.566 21.5-110.4 -94.8 166.2 20.6 -0.8 8.2 286 299 A A H > S+ 0 0 3 1,-0.2 4,-1.4 2,-0.2 -151,-0.2 0.953 119.6 47.5 -58.9 -50.5 17.8 -2.9 9.6 287 300 A A H > S+ 0 0 47 1,-0.2 4,-0.7 2,-0.2 3,-0.3 0.895 114.1 45.0 -58.5 -47.1 18.5 -5.6 6.9 288 301 A Q H 4 S+ 0 0 108 1,-0.2 3,-0.4 2,-0.2 -1,-0.2 0.827 109.8 56.9 -71.3 -23.6 22.2 -5.6 7.4 289 302 A A H >< S+ 0 0 0 -4,-2.3 3,-1.5 1,-0.2 -1,-0.2 0.791 97.0 63.6 -73.0 -27.9 21.7 -5.7 11.2 290 303 A L H 3< S+ 0 0 1 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.807 99.7 52.9 -65.8 -30.1 19.6 -8.8 10.8 291 304 A A T 3< S+ 0 0 66 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.292 83.8 125.1 -88.3 9.3 22.6 -10.7 9.5 292 305 A H S X S- 0 0 20 -3,-1.5 3,-2.4 1,-0.1 7,-0.2 -0.459 74.3-119.8 -72.3 141.7 24.7 -9.7 12.6 293 306 A A G > S+ 0 0 58 1,-0.3 3,-2.0 2,-0.2 4,-0.3 0.806 109.3 73.3 -47.7 -34.5 26.3 -12.5 14.6 294 307 A Y G 3 S+ 0 0 4 -27,-0.3 -1,-0.3 1,-0.3 3,-0.3 0.758 101.2 40.7 -51.8 -32.4 24.2 -11.3 17.5 295 308 A F G X> S+ 0 0 0 -3,-2.4 4,-3.8 -6,-0.2 3,-1.2 0.018 74.1 121.8-109.3 27.6 21.1 -12.7 16.0 296 309 A A T <4 S+ 0 0 76 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.896 75.7 54.1 -54.6 -40.1 22.5 -16.0 14.7 297 310 A Q T 34 S+ 0 0 126 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.686 122.9 24.6 -67.9 -24.5 20.0 -17.9 16.8 298 311 A Y T <4 S+ 0 0 58 -3,-1.2 -2,-0.2 -8,-0.1 -1,-0.2 0.678 93.7 110.8-113.1 -29.0 17.0 -16.1 15.3 299 312 A H < + 0 0 56 -4,-3.8 5,-0.1 -7,-0.2 -8,-0.1 -0.202 30.4 165.2 -56.1 134.6 18.1 -14.9 11.9 300 313 A D > - 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