==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 16-JAN-10 3LFC . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.GRUETTER,J.R.SIMARD,M.GETLIK,D.RAUH . 334 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17879.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 207 62.0 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 . 37 11.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 2 0.6 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 . 20 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 98 29.3 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 3 2 0 0 1 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 4 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 0 151 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 143.9 42.1 -16.5 -27.8 2 5 A R - 0 0 104 1,-0.1 2,-0.0 86,-0.0 3,-0.0 -0.487 360.0-127.4 -69.2 125.4 42.3 -13.6 -25.4 3 6 A P - 0 0 68 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.344 23.4-104.9 -69.0 154.3 41.8 -10.2 -27.0 4 7 A T - 0 0 93 -2,-0.0 15,-1.8 1,-0.0 16,-0.2 -0.686 40.7-148.9 -77.9 129.3 44.3 -7.3 -26.5 5 8 A F E -A 18 0A 29 -2,-0.4 2,-0.3 13,-0.2 11,-0.1 -0.479 6.8-151.7 -95.8 167.4 42.8 -4.7 -24.2 6 9 A Y E -A 17 0A 56 11,-1.9 11,-1.5 -2,-0.2 2,-0.4 -0.994 12.2-131.3-142.6 141.0 43.3 -1.0 -24.0 7 10 A R E +A 16 0A 176 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.752 31.3 161.1 -96.2 130.2 43.1 1.4 -21.1 8 11 A Q E -A 15 0A 72 7,-2.3 7,-2.9 -2,-0.4 2,-0.5 -0.986 32.0-132.6-144.5 139.0 41.1 4.6 -21.2 9 12 A E E +A 14 0A 130 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.812 33.6 163.8 -92.6 130.0 39.8 6.8 -18.4 10 13 A L - 0 0 13 3,-2.7 3,-0.2 -2,-0.5 -2,-0.1 -0.955 57.2 -1.3-147.7 129.0 36.1 7.9 -18.7 11 14 A N S S- 0 0 70 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 0.942 125.5 -51.7 64.1 55.8 33.7 9.4 -16.1 12 15 A K S S+ 0 0 198 1,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.791 124.6 89.9 52.8 32.0 35.8 9.4 -13.0 13 16 A T S S- 0 0 33 -3,-0.2 -3,-2.7 2,-0.0 2,-0.3 -0.970 77.8-117.7-158.5 139.3 36.7 5.8 -13.6 14 17 A I E -A 9 0A 80 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.597 28.2-159.2 -79.4 136.0 39.3 3.7 -15.5 15 18 A W E -A 8 0A 1 -7,-2.9 -7,-2.3 -2,-0.3 2,-0.7 -0.971 11.0-169.9-123.2 121.4 37.9 1.5 -18.3 16 19 A E E +A 7 0A 49 -2,-0.5 -9,-0.2 -9,-0.2 -7,-0.0 -0.827 24.3 161.6-111.7 93.2 39.8 -1.5 -19.7 17 20 A V E -A 6 0A 0 -11,-1.5 -11,-1.9 -2,-0.7 -2,-0.0 -0.817 40.6 -99.5-113.0 150.2 38.0 -2.6 -22.9 18 21 A P E > -A 5 0A 5 0, 0.0 3,-1.0 0, 0.0 -13,-0.2 -0.126 37.5-105.6 -60.8 164.0 39.1 -4.8 -25.8 19 22 A E T 3 S+ 0 0 117 -15,-1.8 -14,-0.1 1,-0.2 19,-0.1 0.813 112.1 76.5 -61.4 -34.2 40.3 -3.3 -29.1 20 23 A R T 3 S+ 0 0 54 -16,-0.2 18,-2.0 17,-0.1 2,-0.4 0.833 84.2 69.7 -38.2 -49.0 37.0 -4.3 -30.7 21 24 A Y E < -B 37 0B 0 -3,-1.0 2,-0.3 16,-0.2 16,-0.2 -0.696 69.6-178.4 -92.1 126.1 35.1 -1.5 -29.1 22 25 A Q E +B 36 0B 79 14,-3.3 14,-3.3 -2,-0.4 -2,-0.0 -0.793 48.8 21.7-128.3 161.4 35.8 2.0 -30.3 23 26 A N E S- 0 0 125 -2,-0.3 2,-0.2 12,-0.2 -1,-0.2 0.862 71.2-163.3 47.6 48.0 34.9 5.7 -29.7 24 27 A L E + 0 0 10 -3,-0.2 11,-0.2 11,-0.1 -1,-0.2 -0.411 12.8 176.8 -58.3 123.2 33.6 5.1 -26.1 25 28 A S E -B 34 0B 58 9,-2.7 9,-3.2 -2,-0.2 -15,-0.0 -0.994 31.1-112.6-136.1 130.3 31.5 8.0 -24.9 26 29 A P E +B 33 0B 67 0, 0.0 7,-0.3 0, 0.0 3,-0.1 -0.304 30.7 174.5 -62.8 135.6 29.6 8.3 -21.6 27 30 A V E - 0 0 89 5,-2.3 2,-0.2 1,-0.4 6,-0.1 0.447 57.6 -63.1-121.1 -6.3 25.8 8.3 -21.7 28 31 A G E B 32 0B 38 4,-0.8 4,-1.4 0, 0.0 -1,-0.4 -0.513 360.0 360.0 137.5 157.2 24.9 8.2 -18.0 29 32 A S 0 0 130 2,-0.2 18,-0.0 -2,-0.2 0, 0.0 -0.884 360.0 360.0-104.2 360.0 25.2 6.2 -14.8 30 ! 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 31 37 A S 0 0 27 0, 0.0 17,-3.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 136.1 28.5 3.5 -15.7 32 38 A V E -BC 28 47B 35 -4,-1.4 -5,-2.3 15,-0.2 -4,-0.8 -0.951 360.0-168.3-121.8 135.8 27.6 3.1 -19.4 33 39 A C E -BC 26 46B 2 13,-2.5 13,-3.0 -2,-0.4 2,-0.3 -0.975 20.0-132.3-119.9 138.7 29.4 4.2 -22.5 34 40 A A E +BC 25 45B 13 -9,-3.2 -9,-2.7 -2,-0.4 2,-0.3 -0.651 41.7 164.0 -74.9 144.3 28.1 4.3 -26.1 35 41 A A E - C 0 44B 9 9,-2.2 9,-3.5 -2,-0.3 2,-0.5 -0.977 38.9-111.2-157.6 164.0 30.6 2.7 -28.5 36 42 A F E -BC 22 43B 76 -14,-3.3 -14,-3.3 -2,-0.3 2,-0.6 -0.935 22.6-149.6-107.1 125.4 31.2 1.2 -31.9 37 43 A D E > -B 21 0B 0 5,-3.0 4,-1.6 -2,-0.5 -16,-0.2 -0.834 9.7-171.3 -91.6 123.9 31.9 -2.5 -32.2 38 44 A T T 4 S+ 0 0 83 -18,-2.0 -1,-0.1 -2,-0.6 -17,-0.1 0.744 79.3 61.7 -90.9 -26.8 34.2 -3.1 -35.2 39 45 A K T 4 S+ 0 0 169 -19,-0.2 -1,-0.2 1,-0.1 -18,-0.0 0.908 125.7 17.8 -61.3 -40.1 34.0 -6.9 -35.3 40 46 A T T 4 S- 0 0 39 2,-0.2 -2,-0.2 -20,-0.1 -1,-0.1 0.673 96.9-126.2-107.2 -27.6 30.2 -6.7 -35.9 41 47 A G < + 0 0 41 -4,-1.6 2,-0.3 1,-0.3 -3,-0.2 0.500 64.4 131.3 90.6 4.8 29.6 -3.1 -37.1 42 48 A L - 0 0 44 -5,-0.1 -5,-3.0 -6,-0.0 2,-0.4 -0.642 62.6-121.3 -90.9 145.3 27.0 -2.3 -34.5 43 49 A R E -C 36 0B 172 -2,-0.3 59,-2.8 -7,-0.2 2,-0.3 -0.736 44.2-166.2 -74.4 133.2 26.8 0.7 -32.2 44 50 A V E -CD 35 101B 0 -9,-3.5 -9,-2.2 -2,-0.4 2,-0.5 -0.928 25.7-135.9-130.5 148.9 26.9 -0.8 -28.7 45 51 A A E -CD 34 100B 19 55,-3.0 55,-1.8 -2,-0.3 2,-0.5 -0.906 21.8-162.2 -97.5 128.7 26.2 0.2 -25.1 46 52 A V E -CD 33 99B 0 -13,-3.0 -13,-2.5 -2,-0.5 2,-0.6 -0.963 1.9-161.7-114.3 118.4 28.8 -1.1 -22.7 47 53 A K E -CD 32 98B 74 51,-2.9 51,-2.2 -2,-0.5 2,-0.5 -0.887 6.1-153.5-102.6 122.2 27.9 -1.1 -19.0 48 54 A K E - D 0 97B 22 -17,-3.5 2,-0.5 -2,-0.6 49,-0.2 -0.844 28.8-119.1 -89.5 124.6 30.6 -1.3 -16.4 49 55 A L - 0 0 9 47,-3.0 47,-0.4 -2,-0.5 2,-0.3 -0.530 28.4-125.0 -73.4 117.2 29.2 -2.9 -13.2 50 56 A S S S- 0 0 82 -2,-0.5 -1,-0.1 1,-0.3 45,-0.0 -0.466 77.4 -25.5 -71.0 120.9 29.5 -0.4 -10.4 51 57 A R S > S- 0 0 158 -2,-0.3 3,-1.0 1,-0.1 4,-0.4 0.913 78.5-173.1 41.8 67.4 31.4 -1.8 -7.4 52 58 A P T 3 S+ 0 0 5 0, 0.0 10,-0.3 0, 0.0 3,-0.2 0.874 73.4 23.2 -64.8 -41.1 30.5 -5.4 -8.2 53 59 A F T 3 S+ 0 0 15 41,-0.3 -2,-0.1 1,-0.1 267,-0.1 0.003 85.7 110.8-116.8 28.9 31.8 -7.3 -5.2 54 60 A Q S < S+ 0 0 118 -3,-1.0 2,-0.2 2,-0.0 -1,-0.1 0.921 88.6 12.0 -65.8 -47.8 31.9 -4.5 -2.5 55 61 A S S > S- 0 0 36 -4,-0.4 4,-1.9 -3,-0.2 5,-0.2 -0.738 81.6-106.2-122.8 172.2 29.0 -6.1 -0.5 56 62 A I H > S+ 0 0 79 -2,-0.2 4,-2.9 2,-0.2 5,-0.2 0.913 122.0 50.4 -63.8 -39.8 27.1 -9.4 -0.5 57 63 A I H > S+ 0 0 75 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.968 108.7 49.0 -63.1 -56.3 24.2 -7.6 -2.1 58 64 A H H > S+ 0 0 52 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.890 115.8 45.4 -48.7 -46.0 26.2 -6.0 -4.9 59 65 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.937 113.1 47.7 -65.7 -50.0 27.8 -9.4 -5.6 60 66 A K H X S+ 0 0 64 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.857 114.4 49.6 -55.7 -38.5 24.5 -11.3 -5.5 61 67 A R H X S+ 0 0 159 -4,-3.0 4,-1.7 -5,-0.2 -1,-0.2 0.831 108.2 52.5 -70.8 -36.1 23.1 -8.6 -7.7 62 68 A T H X S+ 0 0 10 -4,-1.9 4,-2.0 -10,-0.3 -2,-0.2 0.926 110.5 47.1 -66.7 -47.7 26.0 -8.8 -10.2 63 69 A Y H X S+ 0 0 6 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.901 108.8 55.4 -59.9 -45.6 25.6 -12.6 -10.6 64 70 A R H X S+ 0 0 85 -4,-1.8 4,-2.8 -5,-0.2 5,-0.3 0.954 109.7 45.3 -54.2 -54.5 21.8 -12.3 -11.1 65 71 A E H X S+ 0 0 58 -4,-1.7 4,-2.9 1,-0.2 5,-0.3 0.944 113.3 48.0 -56.8 -54.9 22.0 -9.9 -14.0 66 72 A L H X S+ 0 0 1 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.903 116.1 44.2 -53.3 -49.9 24.8 -11.8 -15.9 67 73 A R H X S+ 0 0 51 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.939 114.6 47.3 -61.5 -52.6 23.0 -15.1 -15.6 68 74 A L H >X S+ 0 0 27 -4,-2.8 4,-1.8 -5,-0.3 3,-0.7 0.937 114.1 46.6 -57.1 -51.3 19.6 -13.9 -16.5 69 75 A L H 3< S+ 0 0 26 -4,-2.9 11,-0.5 1,-0.3 -1,-0.2 0.778 107.9 57.2 -65.4 -26.9 20.8 -11.9 -19.5 70 76 A K H 3< S+ 0 0 33 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.826 111.7 43.5 -68.4 -29.6 22.9 -14.9 -20.6 71 77 A H H << S+ 0 0 46 -4,-1.4 2,-0.9 -3,-0.7 -2,-0.2 0.723 92.5 93.1 -89.7 -26.8 19.7 -16.9 -20.7 72 78 A M < + 0 0 9 -4,-1.8 8,-0.4 -5,-0.2 2,-0.3 -0.609 44.2 155.9 -71.9 102.6 17.6 -14.2 -22.4 73 79 A K + 0 0 159 -2,-0.9 2,-0.3 6,-0.1 5,-0.1 -0.756 27.5 108.0-132.2 87.3 17.8 -14.9 -26.1 74 80 A H > - 0 0 23 3,-0.5 3,-0.8 -2,-0.3 57,-0.0 -0.966 69.2-119.5-159.2 150.3 14.8 -13.4 -27.9 75 81 A E T 3 S+ 0 0 121 -2,-0.3 4,-0.1 1,-0.2 56,-0.1 0.746 112.0 45.4 -73.1 -27.1 14.4 -10.4 -30.2 76 82 A N T 3 S+ 0 0 9 83,-0.1 84,-3.3 51,-0.1 2,-0.4 0.254 106.5 69.1-101.8 10.1 12.0 -8.4 -28.0 77 83 A V B < S-f 160 0C 6 -3,-0.8 -3,-0.5 82,-0.3 84,-0.2 -0.986 94.0-104.0-122.5 139.3 14.0 -9.0 -24.8 78 84 A I + 0 0 39 82,-2.2 2,-0.2 -2,-0.4 -2,-0.1 -0.280 46.7 179.6 -59.8 144.6 17.4 -7.4 -24.2 79 85 A G - 0 0 18 -4,-0.1 2,-0.5 -6,-0.1 -9,-0.1 -0.729 28.4 -90.2-136.4-174.8 20.4 -9.8 -24.6 80 86 A L + 0 0 13 -11,-0.5 20,-0.2 -8,-0.4 3,-0.1 -0.911 21.5 179.7-111.8 123.3 24.2 -10.0 -24.5 81 87 A L S S- 0 0 21 18,-2.9 2,-0.3 -2,-0.5 19,-0.2 0.752 79.2 -21.0 -82.2 -25.8 26.5 -9.3 -27.4 82 88 A D E -E 99 0B 22 17,-1.0 17,-2.0 250,-0.1 -1,-0.3 -0.966 51.0-154.0-170.5 159.9 29.5 -9.9 -25.1 83 89 A V E +E 98 0B 7 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.957 28.5 166.4-143.7 136.8 30.7 -10.0 -21.5 84 90 A F E -E 97 0B 12 13,-1.8 13,-2.0 -2,-0.3 244,-0.1 -0.980 24.5-166.5-150.7 159.0 34.3 -9.5 -20.6 85 91 A T - 0 0 16 -2,-0.3 11,-0.1 2,-0.2 8,-0.1 -0.982 26.7-136.1-140.4 147.1 36.9 -8.8 -17.9 86 92 A P S S+ 0 0 23 0, 0.0 -81,-0.1 0, 0.0 7,-0.1 0.657 72.7 116.5 -74.0 -13.5 40.6 -7.7 -18.2 87 93 A A - 0 0 11 8,-0.3 -2,-0.2 1,-0.2 3,-0.1 -0.275 48.2-169.2 -56.4 132.2 41.3 -10.2 -15.5 88 94 A R S S+ 0 0 186 1,-0.3 2,-0.3 -86,-0.0 -1,-0.2 0.488 78.0 25.4 -96.3 -7.2 43.6 -13.0 -16.6 89 95 A S S >> S- 0 0 42 1,-0.1 3,-2.3 0, 0.0 4,-0.5 -0.983 80.0-115.8-157.3 141.5 42.9 -14.9 -13.4 90 96 A L G >4 S+ 0 0 51 -2,-0.3 3,-1.2 1,-0.3 -1,-0.1 0.808 113.3 62.7 -41.5 -39.9 40.1 -15.2 -10.8 91 97 A E G 34 S+ 0 0 163 1,-0.3 -1,-0.3 -3,-0.0 -4,-0.0 0.716 110.2 38.2 -70.4 -19.6 42.5 -13.8 -8.2 92 98 A E G <4 S+ 0 0 111 -3,-2.3 2,-0.4 -6,-0.0 -1,-0.3 0.346 89.5 123.5-104.2 3.6 42.8 -10.5 -10.1 93 99 A F << + 0 0 2 -3,-1.2 3,-0.1 -4,-0.5 231,-0.1 -0.512 17.4 131.6 -71.6 119.0 39.1 -10.5 -11.0 94 100 A N + 0 0 87 -2,-0.4 2,-0.3 1,-0.3 -41,-0.3 0.452 53.9 54.6-146.2 -9.2 37.4 -7.3 -9.9 95 101 A D - 0 0 49 -43,-0.1 2,-0.4 -44,-0.1 -8,-0.3 -0.977 53.0-161.3-136.4 149.0 35.4 -5.8 -12.7 96 102 A V - 0 0 0 -47,-0.4 -47,-3.0 -2,-0.3 2,-0.4 -0.996 4.5-169.2-132.0 130.0 32.6 -6.9 -15.1 97 103 A Y E -DE 48 84B 5 -13,-2.0 -13,-1.8 -2,-0.4 2,-0.4 -0.949 3.2-164.9-117.0 139.9 31.5 -5.3 -18.4 98 104 A L E -DE 47 83B 10 -51,-2.2 -51,-2.9 -2,-0.4 2,-0.4 -0.961 6.1-158.4-126.8 144.9 28.3 -6.2 -20.4 99 105 A V E +DE 46 82B 0 -17,-2.0 -18,-2.9 -2,-0.4 -17,-1.0 -0.952 18.1 154.2-129.8 136.2 27.6 -5.3 -24.0 100 106 A T E -D 45 0B 24 -55,-1.8 -55,-3.0 -2,-0.4 -20,-0.1 -0.969 54.3 -66.0-150.1 164.5 24.4 -4.9 -26.1 101 107 A H E -D 44 0B 65 -2,-0.3 -57,-0.3 -57,-0.2 2,-0.2 -0.276 56.5-116.2 -49.0 126.6 23.1 -3.1 -29.2 102 108 A L - 0 0 52 -59,-2.8 2,-0.4 -67,-0.2 -59,-0.2 -0.545 36.3-145.3 -63.4 133.3 23.1 0.6 -28.4 103 109 A M - 0 0 48 -2,-0.2 50,-0.1 1,-0.1 3,-0.0 -0.892 7.5-134.8-115.3 140.6 19.4 1.6 -28.6 104 110 A G - 0 0 65 -2,-0.4 2,-0.2 1,-0.1 49,-0.2 0.959 68.3 -26.4 -56.5 -69.8 17.9 4.9 -29.9 105 111 A A E -G 152 0C 23 47,-1.7 47,-2.2 45,-0.0 2,-0.2 -0.770 56.5-107.5-138.5 176.7 15.3 5.9 -27.4 106 112 A D E > -G 151 0C 49 -2,-0.2 4,-2.9 45,-0.2 45,-0.2 -0.525 52.0 -88.2 -98.3 178.8 12.8 4.6 -24.9 107 113 A L H > S+ 0 0 5 40,-1.6 4,-0.7 43,-0.7 41,-0.1 0.666 129.6 51.2 -69.9 -15.4 9.0 4.6 -25.4 108 114 A N H > S+ 0 0 73 39,-0.2 4,-0.7 2,-0.1 5,-0.4 0.899 114.0 43.8 -74.2 -48.5 8.7 8.2 -24.1 109 115 A N H 4 S+ 0 0 119 2,-0.2 -2,-0.2 1,-0.1 3,-0.2 0.872 107.9 57.3 -66.3 -42.2 11.4 9.4 -26.4 110 116 A I H < S- 0 0 47 -4,-2.9 2,-0.2 1,-0.2 -3,-0.1 0.978 138.8 -49.3 -51.5 -73.4 10.2 7.6 -29.5 111 117 A V H < S+ 0 0 58 -4,-0.7 -1,-0.2 -5,-0.1 -2,-0.2 -0.704 81.1 139.6-161.9 118.3 6.8 9.3 -29.2 112 118 A K S < S+ 0 0 16 -4,-0.7 4,-0.2 -2,-0.2 -3,-0.1 0.683 70.1 54.5-120.3 -58.3 4.9 9.4 -26.0 113 119 A S S S+ 0 0 104 -5,-0.4 2,-0.2 2,-0.1 -4,-0.1 0.760 104.7 77.5 -52.0 -24.5 3.2 12.8 -25.4 114 120 A Q S S- 0 0 128 1,-0.1 2,-1.0 88,-0.0 87,-0.3 -0.577 90.1-110.3 -99.2 154.0 1.7 12.2 -28.9 115 121 A K - 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0 0 3 -4,-2.4 -1,-0.2 26,-0.3 -2,-0.1 -0.110 38.8 -57.6 92.8 163.0 -14.9 -0.4 -10.4 223 241 A T S S- 0 0 21 24,-1.0 26,-0.1 1,-0.1 50,-0.0 -0.514 75.9 -78.1 -74.2 150.2 -14.7 -1.4 -6.7 224 242 A P - 0 0 18 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.203 49.7-127.7 -54.9 132.5 -13.9 -5.0 -6.0 225 243 A G > - 0 0 40 1,-0.1 4,-3.4 -3,-0.1 3,-0.3 -0.197 30.9 -95.4 -72.0 169.9 -16.8 -7.4 -6.5 226 244 A A H > S+ 0 0 74 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.741 127.6 57.0 -60.1 -24.3 -18.0 -10.0 -3.9 227 245 A E H 4 S+ 0 0 111 2,-0.2 -1,-0.2 1,-0.1 4,-0.1 0.902 113.5 37.6 -69.7 -44.1 -15.8 -12.5 -5.8 228 246 A L H >> S+ 0 0 23 -3,-0.3 3,-1.8 1,-0.2 4,-0.5 0.855 110.5 61.7 -74.2 -37.5 -12.7 -10.4 -5.3 229 247 A L H >< S+ 0 0 34 -4,-3.4 3,-1.0 1,-0.3 -1,-0.2 0.862 98.7 58.1 -53.6 -39.8 -13.8 -9.3 -1.8 230 248 A K T 3< S+ 0 0 170 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.583 100.7 58.1 -68.0 -12.1 -13.6 -13.0 -0.8 231 249 A K T <4 S+ 0 0 82 -3,-1.8 2,-0.6 -4,-0.1 -1,-0.2 0.576 74.0 106.9 -99.7 -11.1 -9.9 -13.1 -1.8 232 250 A I << - 0 0 15 -3,-1.0 6,-0.1 -4,-0.5 -3,-0.0 -0.594 48.6-169.1 -72.9 117.3 -8.5 -10.4 0.4 233 251 A S + 0 0 118 -2,-0.6 -1,-0.2 4,-0.0 2,-0.1 0.952 60.1 83.1 -70.3 -54.0 -6.5 -12.1 3.2 234 252 A S > - 0 0 56 1,-0.1 4,-2.0 2,-0.0 5,-0.1 -0.339 66.8-149.9 -63.2 125.6 -5.9 -9.2 5.5 235 253 A E H > S+ 0 0 146 2,-0.2 4,-2.5 1,-0.2 3,-0.4 0.979 96.8 49.8 -55.6 -61.5 -8.8 -8.4 7.9 236 254 A S H > S+ 0 0 81 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.842 109.6 52.7 -46.9 -45.5 -8.1 -4.6 8.1 237 255 A A H > S+ 0 0 34 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.911 109.3 47.8 -59.6 -47.9 -7.9 -4.4 4.2 238 256 A R H X S+ 0 0 86 -4,-2.0 4,-2.0 -3,-0.4 5,-0.2 0.942 108.2 56.2 -56.5 -49.9 -11.3 -6.1 3.8 239 257 A N H X S+ 0 0 65 -4,-2.5 4,-1.1 1,-0.2 -1,-0.2 0.826 109.3 47.3 -51.9 -37.5 -12.8 -3.7 6.4 240 258 A Y H < S+ 0 0 134 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.868 106.2 54.9 -73.5 -40.3 -11.6 -0.8 4.3 241 259 A I H >< S+ 0 0 30 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.837 108.7 50.3 -65.1 -32.9 -12.9 -2.0 1.0 242 260 A Q H 3< S+ 0 0 117 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.888 100.8 65.3 -64.9 -39.9 -16.4 -2.3 2.6 243 261 A S T 3< S+ 0 0 101 -4,-1.1 2,-0.3 -5,-0.2 -1,-0.2 0.190 88.8 93.3 -73.8 17.4 -16.0 1.2 3.9 244 262 A L S < S- 0 0 60 -3,-0.9 2,-0.4 3,-0.0 3,-0.0 -0.807 83.1-108.4-109.6 152.2 -16.0 2.6 0.3 245 263 A T - 0 0 127 -2,-0.3 -2,-0.1 1,-0.1 -22,-0.0 -0.663 48.6 -99.7 -75.2 130.7 -18.9 3.9 -1.9 246 264 A Q - 0 0 147 -2,-0.4 -1,-0.1 -4,-0.1 -4,-0.0 -0.238 39.0-160.6 -53.9 129.7 -19.7 1.4 -4.6 247 265 A M - 0 0 67 -23,-0.1 -24,-1.0 -3,-0.0 2,-0.3 -0.931 10.6-135.2-111.4 139.3 -18.2 2.3 -8.0 248 266 A P - 0 0 98 0, 0.0 2,-0.3 0, 0.0 -26,-0.3 -0.729 33.7 -99.7 -88.3 144.9 -19.5 0.9 -11.4 249 267 A K - 0 0 105 -2,-0.3 -28,-0.2 -28,-0.2 -29,-0.1 -0.495 44.8-122.3 -58.5 117.5 -17.0 -0.3 -14.0 250 268 A M - 0 0 77 -30,-1.8 2,-0.8 -2,-0.3 -1,-0.1 -0.425 26.2-106.7 -61.3 138.4 -16.7 2.6 -16.4 251 269 A N >> - 0 0 83 1,-0.2 3,-2.1 -2,-0.1 4,-0.8 -0.620 24.3-147.4 -71.8 109.4 -17.6 1.6 -20.0 252 270 A F H 3> S+ 0 0 2 -2,-0.8 4,-3.0 1,-0.3 3,-0.5 0.762 93.0 69.6 -50.3 -33.7 -14.2 1.6 -21.8 253 271 A A H 34 S+ 0 0 48 1,-0.2 5,-0.3 2,-0.2 -1,-0.3 0.860 103.2 43.6 -49.9 -42.0 -15.9 2.7 -25.0 254 272 A N H <4 S+ 0 0 120 -3,-2.1 3,-0.4 1,-0.2 -1,-0.2 0.659 112.4 52.1 -82.5 -20.1 -16.5 6.1 -23.4 255 273 A V H < S+ 0 0 50 -4,-0.8 2,-0.8 -3,-0.5 -2,-0.2 0.892 116.9 38.9 -78.0 -42.3 -13.0 6.3 -21.9 256 274 A F S >< S- 0 0 9 -4,-3.0 3,-1.9 3,-0.1 -1,-0.2 -0.630 89.7-159.7-110.8 70.7 -11.4 5.6 -25.2 257 275 A I T 3 S- 0 0 142 -2,-0.8 -3,-0.1 -3,-0.4 3,-0.1 -0.305 72.2 -5.0 -61.5 121.5 -13.6 7.6 -27.5 258 276 A G T 3 S+ 0 0 82 -5,-0.3 -1,-0.3 1,-0.3 2,-0.1 0.469 93.7 145.1 75.5 3.1 -13.4 6.5 -31.1 259 277 A A < - 0 0 24 -3,-1.9 -1,-0.3 -6,-0.3 5,-0.1 -0.412 67.7 -85.0 -66.8 148.1 -10.6 4.0 -30.4 260 278 A N >> - 0 0 53 1,-0.2 3,-2.0 -3,-0.1 4,-1.5 -0.416 36.8-136.8 -56.0 116.7 -10.7 0.7 -32.5 261 279 A P H 3> S+ 0 0 97 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.623 104.6 63.1 -60.4 -13.8 -13.1 -1.5 -30.5 262 280 A L H 3> S+ 0 0 69 2,-0.2 4,-1.4 1,-0.2 27,-0.3 0.854 105.6 45.3 -69.6 -37.7 -10.7 -4.4 -31.0 263 281 A A H <> S+ 0 0 0 -3,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.797 112.0 53.4 -71.1 -31.3 -8.2 -2.3 -29.0 264 282 A V H X S+ 0 0 17 -4,-1.5 4,-3.1 2,-0.2 -2,-0.2 0.955 106.9 49.1 -67.8 -51.5 -11.0 -1.6 -26.5 265 283 A D H X S+ 0 0 58 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.873 111.5 51.7 -54.6 -39.6 -11.9 -5.3 -26.0 266 284 A L H X S+ 0 0 0 -4,-1.4 4,-0.8 2,-0.2 3,-0.4 0.921 110.4 46.7 -65.4 -46.0 -8.2 -6.0 -25.5 267 285 A L H >X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 3,-1.0 0.900 107.1 58.7 -61.8 -40.7 -7.9 -3.3 -22.8 268 286 A E H 3< S+ 0 0 51 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.851 109.1 46.2 -52.0 -35.3 -11.1 -4.7 -21.2 269 287 A K H 3< S+ 0 0 83 -4,-1.2 10,-2.6 -3,-0.4 -1,-0.2 0.590 116.5 41.7 -90.0 -13.1 -9.2 -7.9 -20.8 270 288 A M H << S+ 0 0 0 -3,-1.0 2,-1.4 -4,-0.8 -2,-0.2 0.810 105.7 59.4 -99.3 -42.3 -6.0 -6.5 -19.5 271 289 A L S < S+ 0 0 4 -4,-2.7 2,-0.6 -5,-0.2 -1,-0.2 -0.407 70.7 139.2 -92.8 58.8 -7.2 -3.9 -17.0 272 290 A V - 0 0 41 -2,-1.4 6,-0.2 -3,-0.2 5,-0.1 -0.927 51.1-142.2-107.6 121.3 -9.2 -6.3 -14.8 273 291 A L S S+ 0 0 29 -2,-0.6 2,-0.6 -52,-0.2 -99,-0.2 0.881 89.7 67.1 -51.1 -49.0 -8.9 -5.6 -11.1 274 292 A D S > S- 0 0 19 1,-0.1 3,-1.5 -3,-0.1 4,-0.3 -0.669 75.9-154.2 -76.8 115.2 -8.8 -9.3 -10.2 275 293 A S G > S+ 0 0 22 -2,-0.6 3,-1.2 1,-0.3 -1,-0.1 0.778 86.7 70.3 -64.5 -31.2 -5.5 -10.6 -11.6 276 294 A D G 3 S+ 0 0 86 1,-0.2 -1,-0.3 -3,-0.0 -3,-0.1 0.710 104.2 43.9 -58.0 -22.0 -6.8 -14.2 -11.9 277 295 A K G < S+ 0 0 118 -3,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.433 85.9 111.9-107.7 -0.6 -9.1 -13.0 -14.8 278 296 A R S < S- 0 0 8 -3,-1.2 -8,-0.2 -4,-0.3 -9,-0.1 -0.413 77.6 -99.0 -66.0 148.4 -6.6 -10.8 -16.8 279 297 A I - 0 0 15 -10,-2.6 2,-0.3 -13,-0.2 -1,-0.1 -0.282 37.0-121.9 -63.2 151.2 -5.6 -12.1 -20.2 280 298 A T > - 0 0 53 1,-0.1 4,-2.7 -3,-0.1 5,-0.2 -0.689 20.4-113.9 -94.8 154.8 -2.2 -13.9 -20.4 281 299 A A H > S+ 0 0 3 -2,-0.3 4,-1.9 1,-0.2 -148,-0.1 0.950 120.7 49.7 -49.5 -53.8 0.6 -12.6 -22.7 282 300 A A H > S+ 0 0 51 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.903 111.4 48.4 -47.5 -51.1 0.2 -15.8 -24.8 283 301 A Q H >4 S+ 0 0 108 1,-0.2 3,-0.9 2,-0.2 4,-0.4 0.899 107.9 55.3 -59.4 -41.5 -3.6 -15.3 -25.0 284 302 A A H >< S+ 0 0 0 -4,-2.7 3,-1.6 1,-0.3 6,-0.3 0.866 98.6 58.9 -66.5 -40.3 -3.3 -11.7 -26.1 285 303 A L H 3< S+ 0 0 0 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.779 105.3 53.7 -54.3 -27.6 -1.1 -12.4 -29.1 286 304 A A T << S+ 0 0 68 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.607 85.5 112.4 -81.5 -14.0 -4.0 -14.6 -30.3 287 305 A H S X S- 0 0 24 -3,-1.6 3,-2.4 -4,-0.4 7,-0.1 -0.372 80.5-118.2 -70.4 139.2 -6.4 -11.7 -30.0 288 306 A A G > S+ 0 0 56 1,-0.3 3,-2.5 2,-0.2 4,-0.3 0.730 105.2 78.7 -47.5 -31.3 -7.9 -10.4 -33.2 289 307 A Y G 3 S+ 0 0 2 1,-0.3 -1,-0.3 -27,-0.3 3,-0.2 0.737 99.2 41.0 -51.9 -27.9 -6.3 -7.0 -32.6 290 308 A F G X> S+ 0 0 0 -3,-2.4 4,-3.6 -6,-0.3 3,-2.3 0.032 75.5 122.2-110.6 24.3 -2.9 -8.3 -33.7 291 309 A A T <4 S+ 0 0 78 -3,-2.5 -1,-0.2 1,-0.3 -2,-0.1 0.871 74.5 55.3 -51.8 -38.8 -4.3 -10.3 -36.7 292 310 A Q T 34 S+ 0 0 103 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.553 123.9 23.9 -74.7 -5.4 -2.0 -8.3 -39.0 293 311 A Y T <4 S+ 0 0 75 -3,-2.3 -2,-0.2 -8,-0.1 -1,-0.2 0.615 87.9 115.8-128.0 -27.4 1.1 -9.4 -36.9 294 312 A H < + 0 0 63 -4,-3.6 -8,-0.1 -7,-0.1 5,-0.1 -0.260 29.9 171.2 -61.5 130.2 0.4 -12.6 -35.0 295 313 A D > - 0 0 65 3,-0.1 3,-2.1 1,-0.1 -1,-0.1 -0.808 17.1-167.6-140.6 101.0 2.5 -15.6 -36.0 296 314 A P T 3 S+ 0 0 89 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.572 88.1 59.4 -65.7 -11.6 2.2 -18.8 -33.8 297 315 A D T 3 S+ 0 0 153 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.435 110.0 42.5 -93.5 -0.2 5.2 -20.4 -35.3 298 316 A D S < S+ 0 0 77 -3,-2.1 -1,-0.2 1,-0.1 -3,-0.1 -0.214 82.9 92.4-142.8 44.0 7.5 -17.5 -34.3 299 317 A E - 0 0 11 -3,-0.4 -1,-0.1 -5,-0.1 -14,-0.0 -0.613 66.6-170.2-132.9 71.2 6.5 -16.6 -30.7 300 318 A P - 0 0 57 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.109 14.8-137.7 -77.4 162.2 9.0 -18.8 -28.9 301 319 A V - 0 0 88 -164,-0.1 2,-0.3 -165,-0.1 -167,-0.2 -0.579 21.3-110.4-109.5 171.4 9.5 -19.7 -25.3 302 320 A A - 0 0 10 -168,-0.5 3,-0.1 -169,-0.2 -230,-0.1 -0.768 28.8-103.4-106.2 147.5 12.6 -20.0 -23.1 303 321 A D - 0 0 127 -2,-0.3 -1,-0.0 -232,-0.2 -166,-0.0 -0.489 65.9 -89.3 -56.3 137.8 14.3 -23.0 -21.5 304 322 A P - 0 0 110 0, 0.0 2,-0.4 0, 0.0 -166,-0.2 -0.168 45.2-131.0 -67.0 155.6 13.1 -22.7 -17.9 305 323 A Y - 0 0 16 -167,-0.7 2,-1.2 -168,-0.1 -237,-0.0 -0.861 7.0-124.9-118.1 140.3 15.2 -20.6 -15.5 306 324 A D > + 0 0 65 -2,-0.4 3,-0.6 1,-0.2 4,-0.3 -0.653 29.2 170.7 -86.8 90.8 16.5 -21.2 -12.0 307 325 A Q G > S+ 0 0 56 -2,-1.2 3,-1.6 1,-0.2 4,-0.4 0.842 74.6 66.5 -61.4 -37.0 15.3 -18.4 -9.7 308 326 A S G > S+ 0 0 79 1,-0.3 3,-0.8 2,-0.2 -1,-0.2 0.770 90.7 63.3 -62.2 -26.0 16.5 -20.3 -6.6 309 327 A L G < S+ 0 0 43 -3,-0.6 -1,-0.3 1,-0.2 3,-0.2 0.706 103.6 47.8 -70.6 -21.6 20.2 -19.9 -7.7 310 328 A E G < S+ 0 0 16 -3,-1.6 2,-0.5 -4,-0.3 -1,-0.2 0.451 101.8 67.1 -98.1 -2.1 19.9 -16.1 -7.4 311 329 A S S < S+ 0 0 92 -3,-0.8 2,-0.3 -4,-0.4 -1,-0.2 -0.654 78.4 123.9-117.6 72.4 18.3 -16.1 -3.9 312 330 A R - 0 0 67 -2,-0.5 2,-1.2 -3,-0.2 -252,-0.0 -0.938 65.6-123.0-139.8 152.2 21.0 -17.5 -1.7 313 331 A D + 0 0 166 -2,-0.3 2,-0.3 -253,-0.0 -2,-0.0 -0.704 53.7 157.5 -92.7 82.9 23.1 -16.8 1.4 314 332 A L - 0 0 29 -2,-1.2 -254,-0.1 -258,-0.1 2,-0.1 -0.813 44.3-109.1-112.7 148.3 26.5 -17.0 -0.1 315 333 A L >> - 0 0 118 -2,-0.3 4,-1.6 1,-0.1 3,-1.0 -0.357 37.6-106.7 -64.2 151.6 29.9 -15.6 1.0 316 334 A I H >> S+ 0 0 46 1,-0.2 4,-2.6 2,-0.2 3,-0.7 0.925 121.0 50.8 -41.8 -58.1 31.3 -12.7 -1.1 317 335 A D H 3> S+ 0 0 121 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.741 105.4 57.8 -58.5 -26.6 34.0 -15.0 -2.7 318 336 A E H <> S+ 0 0 95 -3,-1.0 4,-1.6 2,-0.2 -1,-0.3 0.862 110.2 41.5 -74.8 -37.4 31.3 -17.6 -3.6 319 337 A W H < S+ 0 0 13 -4,-2.1 3,-1.3 1,-0.2 -2,-0.2 0.941 112.9 46.6 -59.4 -50.7 32.1 -14.8 -17.8 328 346 A I H 3< S+ 0 0 112 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.897 112.1 51.0 -56.1 -43.3 34.5 -17.6 -18.8 329 347 A S T 3< S+ 0 0 64 -4,-2.7 2,-0.3 -5,-0.2 -1,-0.2 0.367 81.4 132.1 -81.9 5.1 31.7 -19.8 -20.1 330 348 A F < - 0 0 31 -3,-1.3 -247,-0.1 -4,-0.3 -3,-0.1 -0.424 37.3-167.3 -69.6 121.9 30.1 -17.1 -22.3 331 349 A V - 0 0 114 -2,-0.3 -2,-0.1 -261,-0.1 -1,-0.0 -0.947 20.6-133.1-103.8 119.3 29.3 -18.0 -25.9 332 350 A P - 0 0 68 0, 0.0 -251,-0.1 0, 0.0 -250,-0.1 -0.306 30.7 -97.2 -62.4 151.6 28.5 -15.0 -28.1 333 351 A P - 0 0 62 0, 0.0 2,-0.0 0, 0.0 -260,-0.0 -0.460 51.6 -89.3 -66.2 146.1 25.4 -15.1 -30.2 334 352 A P - 0 0 125 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 -0.326 53.4 -98.9 -57.2 137.1 26.1 -16.1 -33.9 335 353 A L 0 0 142 1,-0.1 -295,-0.0 -3,-0.1 0, 0.0 0.041 360.0 360.0 -56.0 162.4 26.9 -13.2 -36.2 336 354 A D 0 0 177 -296,-0.1 -1,-0.1 0, 0.0 -296,-0.0 0.953 360.0 360.0 -65.4 360.0 24.3 -11.6 -38.5