==== 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 TRANSFERASE 01-MAY-09 3HA8 . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.ZHAO,M.A.CLARK . 342 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16968.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 213 62.3 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 . 41 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 . 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 . 27 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 28.1 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 3 1 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 . 1 1 2 0 3 0 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 4 A E 0 0 132 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -31.5 26.9 1.8 24.0 2 5 A R - 0 0 107 1,-0.0 2,-0.1 89,-0.0 89,-0.0 -0.552 360.0-145.5 -73.8 119.5 24.9 3.5 21.2 3 6 A P - 0 0 66 0, 0.0 2,-0.3 0, 0.0 -1,-0.0 -0.490 31.4 -99.0 -73.9 156.9 21.5 1.8 20.3 4 7 A T - 0 0 87 -2,-0.1 15,-2.5 1,-0.0 2,-0.2 -0.645 39.2-149.7 -80.6 132.8 20.5 2.0 16.6 5 8 A F E -A 18 0A 27 -2,-0.3 2,-0.3 13,-0.3 11,-0.1 -0.668 8.9-162.3 -99.9 154.3 18.0 4.7 15.8 6 9 A Y E -A 17 0A 61 11,-2.3 11,-1.7 -2,-0.2 2,-0.4 -0.988 12.5-129.7-137.5 152.3 15.3 4.8 13.1 7 10 A R E +A 16 0A 157 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.779 27.9 159.6-105.8 139.4 13.3 7.6 11.4 8 11 A Q E -A 15 0A 53 7,-2.0 7,-3.6 -2,-0.4 2,-0.5 -0.979 32.7-127.4-150.9 151.5 9.6 8.0 10.8 9 12 A E E -A 14 0A 111 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.879 22.1-177.8-102.1 123.1 7.3 11.0 10.2 10 13 A L S S- 0 0 25 3,-2.8 15,-0.0 -2,-0.5 -2,-0.0 -0.921 73.1 -27.7-126.7 106.1 4.2 11.3 12.4 11 14 A N S S- 0 0 116 -2,-0.5 -1,-0.2 1,-0.2 3,-0.1 0.986 128.0 -39.9 38.4 82.5 2.0 14.3 11.4 12 15 A K S S+ 0 0 184 1,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.752 119.2 107.9 46.8 37.7 4.7 16.6 9.8 13 16 A T - 0 0 39 2,-0.0 -3,-2.8 0, 0.0 2,-0.6 -0.966 65.3-135.3-145.0 122.4 7.3 15.7 12.5 14 17 A I E -A 9 0A 63 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.680 21.0-164.5 -80.3 116.7 10.4 13.5 12.1 15 18 A W E -A 8 0A 3 -7,-3.6 -7,-2.0 -2,-0.6 2,-0.5 -0.913 6.6-173.5-103.1 125.0 10.7 11.1 15.1 16 19 A E E +A 7 0A 54 -2,-0.5 -9,-0.2 -9,-0.2 -11,-0.0 -0.941 20.6 157.0-119.7 106.1 14.1 9.4 15.5 17 20 A V E -A 6 0A 0 -11,-1.7 -11,-2.3 -2,-0.5 -2,-0.0 -0.867 45.3 -87.7-127.4 157.3 14.0 6.8 18.3 18 21 A P E > -A 5 0A 3 0, 0.0 3,-1.7 0, 0.0 -13,-0.3 -0.327 43.1-109.9 -58.6 148.9 16.0 3.7 19.3 19 22 A E T 3 S+ 0 0 113 -15,-2.5 22,-0.1 1,-0.3 -14,-0.1 0.673 111.2 74.9 -51.2 -26.3 14.9 0.3 17.7 20 23 A R T 3 S+ 0 0 66 -16,-0.2 21,-2.8 20,-0.1 2,-0.5 0.859 82.8 75.6 -61.8 -34.5 13.6 -0.8 21.1 21 24 A Y E < +B 40 0B 0 -3,-1.7 2,-0.3 19,-0.2 19,-0.2 -0.691 68.2 174.3 -85.3 121.2 10.6 1.5 20.8 22 25 A Q E +B 39 0B 71 17,-2.8 17,-2.8 -2,-0.5 -2,-0.0 -0.825 47.4 26.7-127.7 161.6 8.0 0.1 18.3 23 26 A N E S- 0 0 125 -2,-0.3 2,-0.2 15,-0.2 -1,-0.2 0.884 70.2-165.2 53.4 48.2 4.5 0.9 17.1 24 27 A L E + 0 0 14 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.479 10.9 178.6 -64.9 128.3 4.8 4.6 17.7 25 28 A S E -B 37 0B 64 12,-2.4 12,-3.0 -2,-0.2 -15,-0.0 -0.961 30.0-116.5-141.7 113.5 1.3 6.0 17.5 26 29 A P E +B 36 0B 56 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.089 36.3 169.0 -50.1 148.1 0.5 9.7 18.1 27 30 A V E + 0 0 95 8,-2.5 2,-0.3 1,-0.3 9,-0.2 0.606 51.4 21.2-139.0 -28.2 -1.7 10.3 21.1 28 31 A G E -B 35 0B 39 7,-1.1 2,-2.0 2,-0.0 7,-1.1 -0.936 55.5-131.6-160.5 134.0 -2.0 14.0 22.1 29 32 A S - 0 0 130 -2,-0.3 5,-0.1 5,-0.1 0, 0.0 -0.473 45.7-178.0 -78.9 69.9 -1.5 17.6 20.7 30 33 A G - 0 0 49 -2,-2.0 4,-0.0 3,-0.4 5,-0.0 0.067 33.2-133.5 -66.0 176.6 0.6 19.0 23.6 31 34 A A S S+ 0 0 90 1,-0.1 3,-0.1 3,-0.0 -1,-0.1 0.440 105.0 35.9-114.2 -6.0 2.0 22.5 24.0 32 35 A Y S S- 0 0 113 1,-0.4 21,-0.3 20,-0.0 2,-0.2 0.032 132.7 -25.7-127.8 23.8 5.6 21.6 25.0 33 36 A G - 0 0 3 19,-0.3 -3,-0.4 2,-0.0 -1,-0.4 -0.808 66.5 -88.3 152.2 166.7 5.9 18.6 22.7 34 37 A S E - C 0 51B 38 17,-1.3 17,-2.3 -2,-0.2 2,-0.4 -0.811 37.6-147.9-101.7 149.6 4.1 15.8 20.8 35 38 A V E -BC 28 50B 36 -7,-1.1 -8,-2.5 -2,-0.3 -7,-1.1 -0.971 11.3-170.1-125.6 131.8 3.4 12.4 22.5 36 39 A C E -BC 26 49B 2 13,-2.9 13,-3.0 -2,-0.4 2,-0.4 -0.910 22.3-131.3-112.3 145.5 3.3 8.9 21.1 37 40 A A E +BC 25 48B 20 -12,-3.0 -12,-2.4 -2,-0.4 2,-0.3 -0.780 42.0 168.4 -79.7 137.0 2.1 5.7 22.6 38 41 A A E - C 0 47B 7 9,-3.1 9,-2.5 -2,-0.4 2,-0.5 -0.911 36.3-118.8-141.9 171.2 4.8 3.1 21.9 39 42 A F E -BC 22 46B 81 -17,-2.8 -17,-2.8 -2,-0.3 2,-0.9 -0.983 20.7-145.6-116.3 124.4 5.8 -0.4 22.9 40 43 A D E >> -BC 21 45B 0 5,-2.6 4,-2.0 -2,-0.5 5,-0.7 -0.783 8.2-164.8 -92.2 103.1 9.2 -0.8 24.6 41 44 A T T 45S+ 0 0 78 -21,-2.8 -1,-0.1 -2,-0.9 -20,-0.1 0.641 82.8 55.2 -65.6 -17.1 10.6 -4.2 23.4 42 45 A K T 45S+ 0 0 91 1,-0.1 -1,-0.2 -22,-0.1 -21,-0.0 0.874 120.9 24.5 -84.4 -40.1 13.3 -4.3 26.1 43 46 A T T 45S- 0 0 71 -3,-0.4 -2,-0.2 2,-0.2 -1,-0.1 0.575 97.1-128.5 -97.9 -14.0 11.1 -3.9 29.3 44 47 A G T <5 + 0 0 47 -4,-2.0 2,-0.3 1,-0.3 -3,-0.2 0.682 64.4 137.2 66.5 19.8 7.9 -5.2 27.7 45 48 A L E < -C 40 0B 63 -5,-0.7 -5,-2.6 59,-0.0 2,-0.5 -0.656 60.7-122.6 -94.3 151.9 6.2 -2.1 29.0 46 49 A R E -C 39 0B 99 -2,-0.3 59,-2.4 -7,-0.2 2,-0.3 -0.852 44.5-166.4 -87.8 126.1 3.7 0.1 27.1 47 50 A V E -CD 38 104B 0 -9,-2.5 -9,-3.1 -2,-0.5 2,-0.5 -0.831 27.9-136.9-124.2 154.1 5.3 3.6 27.1 48 51 A A E -CD 37 103B 16 55,-3.0 55,-2.3 -2,-0.3 2,-0.5 -0.930 24.3-163.9-101.5 129.7 4.6 7.2 26.4 49 52 A V E -CD 36 102B 0 -13,-3.0 -13,-2.9 -2,-0.5 2,-0.4 -0.975 1.6-164.4-119.0 127.0 7.3 9.0 24.4 50 53 A K E -CD 35 101B 41 51,-2.9 51,-2.8 -2,-0.5 2,-0.7 -0.927 9.6-157.3-112.4 132.2 7.5 12.8 24.2 51 54 A K E -CD 34 100B 27 -17,-2.3 -17,-1.3 -2,-0.4 49,-0.2 -0.918 23.2-136.8-104.8 104.5 9.5 14.8 21.7 52 55 A L - 0 0 5 47,-2.1 47,-0.5 -2,-0.7 2,-0.4 -0.415 18.5-142.8 -62.2 126.1 10.2 18.2 23.2 53 56 A S S S- 0 0 70 -21,-0.3 -1,-0.1 1,-0.2 45,-0.0 -0.772 72.7 -5.7 -96.0 140.1 9.6 20.9 20.5 54 57 A R S > S+ 0 0 159 -2,-0.4 3,-0.9 1,-0.1 -1,-0.2 0.892 77.4 166.8 47.4 53.4 11.8 24.0 20.3 55 58 A P T 3 S+ 0 0 10 0, 0.0 10,-0.4 0, 0.0 11,-0.2 0.738 72.3 29.6 -74.7 -21.3 13.6 23.1 23.6 56 59 A F T 3 S+ 0 0 22 41,-0.2 -2,-0.1 1,-0.1 273,-0.1 -0.174 79.0 120.2-129.2 40.4 16.5 25.6 23.3 57 60 A Q S < S+ 0 0 118 -3,-0.9 2,-0.3 1,-0.1 -1,-0.1 0.773 83.6 3.1 -80.0 -28.0 15.0 28.4 21.3 58 61 A S S > S- 0 0 40 -4,-0.2 4,-2.7 -3,-0.1 5,-0.2 -0.942 80.3 -98.6-147.1 168.9 15.6 31.1 24.0 59 62 A I H > S+ 0 0 80 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.920 123.3 51.3 -52.8 -47.6 17.2 31.4 27.4 60 63 A I H > S+ 0 0 108 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.938 113.7 41.6 -55.3 -54.9 13.8 31.0 29.1 61 64 A H H > S+ 0 0 71 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.839 113.4 53.3 -66.1 -36.3 12.8 27.8 27.1 62 65 A A H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.857 111.1 46.3 -68.2 -36.8 16.3 26.3 27.5 63 66 A K H X S+ 0 0 42 -4,-2.2 4,-3.2 -5,-0.2 -2,-0.2 0.919 112.2 51.9 -66.5 -45.2 16.2 26.8 31.3 64 67 A R H X S+ 0 0 82 -4,-2.3 4,-3.1 1,-0.2 -2,-0.2 0.904 109.5 49.1 -57.1 -46.3 12.6 25.3 31.3 65 68 A T H X S+ 0 0 9 -4,-2.5 4,-2.5 -10,-0.4 -1,-0.2 0.911 112.6 48.2 -59.5 -45.2 13.8 22.3 29.4 66 69 A Y H X S+ 0 0 13 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.946 113.4 46.9 -60.2 -50.9 16.7 21.8 31.8 67 70 A R H X S+ 0 0 70 -4,-3.2 4,-2.9 2,-0.2 5,-0.2 0.932 111.2 52.1 -54.6 -52.1 14.4 22.2 34.8 68 71 A E H X S+ 0 0 40 -4,-3.1 4,-2.4 1,-0.2 5,-0.2 0.944 112.2 45.1 -48.9 -56.4 11.8 19.8 33.3 69 72 A L H X S+ 0 0 3 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.850 112.5 51.9 -59.8 -39.1 14.6 17.1 32.8 70 73 A R H X S+ 0 0 36 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.929 110.7 47.2 -63.1 -48.0 16.0 17.7 36.3 71 74 A L H X S+ 0 0 24 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.948 116.7 43.5 -55.9 -52.5 12.6 17.2 38.0 72 75 A L H < S+ 0 0 28 -4,-2.4 11,-0.8 1,-0.2 -2,-0.2 0.827 111.4 52.7 -67.4 -36.8 11.8 14.1 35.9 73 76 A K H < S+ 0 0 34 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.830 115.9 43.2 -65.3 -30.4 15.3 12.6 36.4 74 77 A H H < S+ 0 0 33 -4,-1.6 2,-0.9 -5,-0.2 238,-0.2 0.802 89.0 93.2 -86.2 -33.2 14.8 13.1 40.1 75 78 A M < + 0 0 3 -4,-2.2 2,-0.5 6,-0.1 8,-0.4 -0.520 43.1 161.3 -71.5 102.7 11.2 11.9 40.6 76 79 A K + 0 0 145 -2,-0.9 2,-0.3 6,-0.1 5,-0.1 -0.782 29.9 111.9-124.2 83.6 11.5 8.2 41.5 77 80 A H B > -F 80 0C 22 3,-0.5 3,-1.1 -2,-0.5 5,-0.1 -0.986 69.3-121.7-156.1 149.8 8.2 7.3 43.1 78 81 A E T 3 S+ 0 0 119 -2,-0.3 4,-0.1 1,-0.2 -1,-0.1 0.787 112.2 43.0 -68.2 -30.4 5.2 5.1 42.2 79 82 A N T 3 S+ 0 0 8 83,-0.1 84,-2.2 51,-0.1 2,-0.4 0.088 105.6 71.9-105.4 19.5 2.7 7.9 42.4 80 83 A V B < S-Fg 77 163C 1 -3,-1.1 -3,-0.5 82,-0.3 2,-0.4 -1.000 89.5-110.5-134.9 132.3 4.8 10.5 40.5 81 84 A I + 0 0 15 82,-3.0 2,-0.2 -2,-0.4 -6,-0.1 -0.501 49.1 169.9 -66.6 118.9 5.5 10.4 36.8 82 85 A G - 0 0 15 -2,-0.4 2,-0.6 -5,-0.1 22,-0.3 -0.530 35.2 -83.5-120.1-168.2 9.2 9.7 36.4 83 86 A L + 0 0 17 -11,-0.8 20,-0.2 -8,-0.4 3,-0.1 -0.878 26.8 176.5-116.4 111.5 11.5 8.8 33.6 84 87 A L S S- 0 0 26 18,-1.8 2,-0.3 -2,-0.6 19,-0.2 0.747 81.2 -11.0 -75.3 -27.8 12.0 5.3 32.2 85 88 A D E -E 102 0B 23 17,-1.4 17,-2.7 256,-0.1 2,-0.3 -0.977 52.4-166.2-164.0 157.7 14.4 6.7 29.5 86 89 A V E +E 101 0B 7 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.944 26.1 161.3-147.5 137.0 15.6 10.0 28.0 87 90 A F E -E 100 0B 14 13,-1.7 13,-2.1 -2,-0.3 250,-0.1 -0.962 27.0-154.8-151.9 164.8 17.6 10.1 24.7 88 91 A T - 0 0 12 -2,-0.3 11,-0.1 11,-0.2 -71,-0.1 -0.988 21.8-139.3-141.3 140.3 18.8 12.1 21.7 89 92 A P S S+ 0 0 19 0, 0.0 -84,-0.1 0, 0.0 7,-0.1 0.727 74.8 111.0 -66.6 -18.5 19.8 10.9 18.2 90 93 A A - 0 0 12 8,-0.3 -2,-0.2 1,-0.1 6,-0.1 -0.303 56.2-160.4 -65.5 135.4 22.7 13.3 18.4 91 94 A R S S+ 0 0 178 -2,-0.1 2,-0.3 1,-0.0 -1,-0.1 0.538 74.5 18.1 -91.7 -9.9 26.2 11.8 18.7 92 95 A S S S- 0 0 34 1,-0.1 3,-0.4 0, 0.0 4,-0.3 -0.941 81.6-101.9-155.1 168.4 27.7 15.0 20.1 93 96 A L S > S+ 0 0 57 -2,-0.3 3,-0.6 1,-0.2 240,-0.1 0.812 114.8 60.8 -67.5 -32.4 26.9 18.4 21.8 94 97 A E T 3 S+ 0 0 156 1,-0.2 -1,-0.2 -3,-0.0 -4,-0.0 0.797 113.3 35.6 -67.6 -31.0 27.4 20.4 18.5 95 98 A E T 3 S+ 0 0 94 -3,-0.4 2,-0.5 2,-0.0 -1,-0.2 0.330 88.6 122.9-103.1 3.7 24.5 18.4 16.8 96 99 A F < + 0 0 0 -3,-0.6 3,-0.1 -4,-0.3 237,-0.1 -0.570 19.8 129.0 -72.6 114.4 22.4 18.1 20.0 97 100 A N + 0 0 88 -2,-0.5 2,-0.4 1,-0.2 -41,-0.2 0.537 51.8 64.3-135.0 -30.8 19.0 19.7 19.3 98 101 A D - 0 0 51 -44,-0.1 2,-0.4 -43,-0.1 -8,-0.3 -0.862 50.6-165.7-117.0 139.2 16.3 17.2 20.4 99 102 A V - 0 0 0 -47,-0.5 -47,-2.1 -2,-0.4 2,-0.4 -0.981 7.5-168.7-118.1 129.2 15.2 15.7 23.7 100 103 A Y E -DE 51 87B 1 -13,-2.1 -13,-1.7 -2,-0.4 2,-0.4 -0.963 5.9-158.5-115.1 137.6 12.9 12.7 23.8 101 104 A L E -DE 50 86B 13 -51,-2.8 -51,-2.9 -2,-0.4 2,-0.4 -0.936 2.4-162.4-117.8 138.9 11.4 11.5 27.1 102 105 A V E +DE 49 85B 0 -17,-2.7 -18,-1.8 -2,-0.4 -17,-1.4 -0.965 20.5 149.7-120.5 136.5 10.0 8.1 27.9 103 106 A T E -D 48 0B 24 -55,-2.3 -55,-3.0 -2,-0.4 -20,-0.1 -0.918 51.3 -60.7-149.2 174.9 7.6 7.1 30.7 104 107 A H E -D 47 0B 65 -22,-0.3 2,-0.5 -2,-0.3 -57,-0.2 -0.347 53.3-117.3 -59.1 136.1 4.8 4.6 31.6 105 108 A L - 0 0 61 -59,-2.4 2,-0.4 -67,-0.1 -59,-0.1 -0.685 32.2-159.7 -75.8 125.1 1.8 4.8 29.4 106 109 A M - 0 0 33 -2,-0.5 50,-0.2 1,-0.1 3,-0.1 -0.869 14.9-138.4-111.6 144.1 -1.3 5.8 31.4 107 110 A G - 0 0 52 -2,-0.4 2,-0.3 1,-0.1 49,-0.2 0.852 69.5 -24.3 -72.4 -40.9 -4.9 5.1 30.4 108 111 A A E -H 155 0C 27 47,-2.3 47,-3.5 3,-0.0 -1,-0.1 -0.966 60.8-100.5-160.1 167.4 -6.7 8.4 31.3 109 112 A D E -H 154 0C 54 -2,-0.3 45,-0.2 45,-0.3 42,-0.2 -0.402 45.8-100.9 -85.9 177.0 -6.6 11.4 33.5 110 113 A L S >> S+ 0 0 0 40,-1.9 4,-2.8 43,-1.3 3,-1.1 0.800 121.0 63.0 -71.7 -29.3 -8.8 11.7 36.6 111 114 A N H 3> S+ 0 0 37 39,-0.5 4,-2.0 1,-0.2 5,-0.3 0.938 99.5 53.1 -53.1 -51.1 -11.3 13.9 34.7 112 115 A N H 34 S+ 0 0 94 1,-0.2 -1,-0.2 2,-0.2 4,-0.2 0.487 114.5 44.5 -67.6 -2.5 -12.0 11.0 32.3 113 116 A I H <> S+ 0 0 26 -3,-1.1 4,-3.4 3,-0.1 -2,-0.2 0.810 111.4 46.3-104.6 -49.6 -12.7 8.9 35.4 114 117 A V H < S+ 0 0 18 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.753 115.4 50.6 -65.3 -25.8 -14.9 11.2 37.5 115 118 A K T < S+ 0 0 151 -4,-2.0 -1,-0.2 -5,-0.3 -3,-0.1 0.914 122.8 28.3 -74.5 -45.2 -17.0 12.0 34.4 116 119 A C T 4 S+ 0 0 97 -5,-0.3 2,-0.2 -4,-0.2 -2,-0.2 0.861 114.3 60.4 -86.9 -39.8 -17.6 8.4 33.3 117 120 A Q < - 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0 0 29 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.0 -0.350 31.4-147.7 -56.4 134.9 -16.9 20.8 41.2 213 222 A L S S+ 0 0 35 -11,-0.3 -1,-0.1 1,-0.2 -34,-0.1 0.930 90.0 18.5 -74.6 -49.0 -16.6 22.1 44.7 214 223 A F + 0 0 6 -36,-0.4 2,-2.3 2,-0.1 -1,-0.2 -0.616 68.3 172.0-123.0 74.4 -15.8 25.8 43.8 215 224 A P - 0 0 39 0, 0.0 -40,-0.1 0, 0.0 -37,-0.0 -0.327 19.7-179.1 -81.5 61.0 -16.8 26.3 40.2 216 225 A G - 0 0 0 -2,-2.3 -42,-0.4 1,-0.1 -39,-0.1 -0.277 30.5-145.0 -60.7 143.9 -16.2 30.1 40.3 217 226 A T S S- 0 0 71 -44,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.437 82.8 -8.3 -89.1 -4.9 -16.9 32.1 37.2 218 227 A D S > S- 0 0 66 -47,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.932 89.4 -78.5-173.0 176.2 -14.0 34.4 38.0 219 228 A H H > S+ 0 0 56 -2,-0.3 4,-1.7 1,-0.2 5,-0.1 0.852 126.9 43.3 -55.3 -42.3 -11.5 35.1 40.8 220 229 A I H > S+ 0 0 64 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.915 113.7 49.5 -74.0 -45.4 -14.0 37.1 42.9 221 230 A D H > S+ 0 0 50 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.865 111.9 50.0 -62.0 -36.8 -16.9 34.8 42.4 222 231 A Q H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.872 107.6 52.7 -70.3 -38.0 -14.7 31.8 43.4 223 232 A L H X S+ 0 0 0 -4,-1.7 4,-2.7 -5,-0.2 5,-0.2 0.926 108.7 51.9 -59.2 -44.1 -13.4 33.6 46.5 224 233 A K H X S+ 0 0 108 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.874 109.6 48.0 -60.9 -41.2 -17.1 34.1 47.5 225 234 A L H X S+ 0 0 62 -4,-1.8 4,-1.0 2,-0.2 -1,-0.2 0.930 112.9 49.7 -63.5 -46.5 -17.9 30.4 47.0 226 235 A I H >X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 3,-0.7 0.923 112.7 45.0 -56.3 -50.0 -14.8 29.5 49.1 227 236 A L H 3X S+ 0 0 1 -4,-2.7 4,-1.9 1,-0.3 -1,-0.2 0.780 103.2 65.1 -72.3 -26.9 -15.7 31.8 52.0 228 237 A R H 3< S+ 0 0 61 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.837 115.6 30.9 -60.1 -33.5 -19.3 30.7 51.9 229 238 A L H << S+ 0 0 11 -4,-1.0 30,-2.6 -3,-0.7 -2,-0.2 0.881 131.8 29.9 -91.5 -46.7 -18.0 27.3 53.0 230 239 A V H < S- 0 0 16 -4,-2.8 28,-0.3 28,-0.2 52,-0.2 0.625 106.5-119.9 -94.0 -13.3 -14.9 28.0 55.0 231 240 A G < - 0 0 3 -4,-1.9 -1,-0.2 26,-0.3 -2,-0.1 -0.075 36.4 -62.2 93.1 161.2 -15.8 31.4 56.5 232 241 A T - 0 0 23 24,-1.6 26,-0.1 1,-0.1 50,-0.1 -0.433 69.7 -81.3 -74.6 156.6 -14.2 34.8 56.1 233 242 A P - 0 0 6 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.270 43.2-132.5 -60.1 142.0 -10.6 35.3 57.5 234 243 A G > - 0 0 43 -3,-0.1 4,-1.9 1,-0.1 5,-0.1 -0.224 34.3 -90.9 -81.7 180.0 -10.1 35.9 61.2 235 244 A A H > S+ 0 0 70 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.901 125.1 53.5 -59.6 -42.7 -7.9 38.6 62.7 236 245 A E H > S+ 0 0 130 1,-0.2 4,-1.1 2,-0.2 3,-0.4 0.926 109.2 45.9 -61.0 -50.2 -4.9 36.2 62.9 237 246 A L H > S+ 0 0 9 1,-0.2 4,-0.8 2,-0.2 3,-0.2 0.859 107.2 60.1 -61.9 -37.2 -5.0 35.3 59.2 238 247 A L H >< S+ 0 0 31 -4,-1.9 3,-0.6 1,-0.2 -1,-0.2 0.862 99.6 56.4 -57.3 -39.4 -5.5 38.9 58.2 239 248 A K H 3< S+ 0 0 166 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.897 105.6 51.8 -57.6 -41.7 -2.1 39.8 59.8 240 249 A K H 3< S+ 0 0 62 -4,-1.1 2,-1.4 -3,-0.2 -1,-0.2 0.630 83.5 94.2 -74.9 -18.0 -0.4 37.2 57.6 241 250 A I << - 0 0 0 -4,-0.8 -52,-0.2 -3,-0.6 6,-0.2 -0.657 55.2-176.9 -78.4 94.5 -1.9 38.6 54.4 242 251 A S + 0 0 89 -2,-1.4 2,-0.7 -54,-0.4 -1,-0.2 0.725 54.1 97.1 -69.2 -23.8 1.0 40.9 53.5 243 252 A S > - 0 0 42 -55,-1.9 4,-2.6 1,-0.2 5,-0.2 -0.578 58.1-164.7 -69.8 111.0 -0.8 42.3 50.4 244 253 A E H > S+ 0 0 80 -2,-0.7 4,-2.0 2,-0.2 -1,-0.2 0.828 90.0 53.8 -65.9 -33.6 -2.3 45.6 51.5 245 254 A S H > S+ 0 0 58 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.934 112.8 42.7 -63.2 -48.1 -4.5 45.6 48.4 246 255 A A H > S+ 0 0 14 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.916 113.5 50.5 -66.5 -46.9 -5.8 42.1 49.2 247 256 A R H X S+ 0 0 71 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.909 108.9 51.8 -58.7 -46.5 -6.3 42.7 52.9 248 257 A N H < S+ 0 0 117 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.864 110.7 48.8 -61.0 -37.1 -8.3 45.9 52.3 249 258 A Y H >< S+ 0 0 73 -4,-1.5 3,-1.4 2,-0.2 4,-0.5 0.926 107.6 53.6 -68.2 -46.6 -10.6 44.1 49.9 250 259 A I H >< S+ 0 0 8 -4,-2.4 3,-1.7 1,-0.3 -2,-0.2 0.896 103.6 56.4 -54.0 -45.2 -11.3 41.1 52.3 251 260 A Q T 3< S+ 0 0 132 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.614 96.5 66.4 -65.3 -13.5 -12.4 43.5 55.1 252 261 A S T < S+ 0 0 79 -3,-1.4 -1,-0.3 -4,-0.3 2,-0.2 0.699 85.9 91.1 -78.7 -20.3 -15.0 45.0 52.8 253 262 A L S < S- 0 0 33 -3,-1.7 2,-0.2 -4,-0.5 3,-0.1 -0.508 90.2-104.3 -79.3 142.3 -16.9 41.6 52.7 254 263 A T - 0 0 125 -2,-0.2 -1,-0.1 1,-0.1 2,-0.1 -0.476 47.3-111.0 -59.4 128.0 -19.7 40.8 55.2 255 264 A Q - 0 0 158 -2,-0.2 -1,-0.1 -4,-0.1 -4,-0.0 -0.377 38.8-170.5 -69.7 143.3 -18.1 38.3 57.7 256 265 A M - 0 0 67 -2,-0.1 -24,-1.6 -23,-0.1 2,-0.2 -0.964 18.6-121.0-135.3 148.3 -19.3 34.8 57.6 257 266 A P - 0 0 108 0, 0.0 -26,-0.3 0, 0.0 2,-0.2 -0.539 40.1 -92.5 -84.7 157.9 -18.9 31.7 59.8 258 267 A K - 0 0 98 -28,-0.3 -28,-0.2 -2,-0.2 -29,-0.1 -0.500 47.7-121.2 -60.4 131.2 -17.4 28.4 58.6 259 268 A M - 0 0 90 -30,-2.6 2,-0.7 -2,-0.2 -1,-0.1 -0.435 25.6-101.1 -76.1 153.4 -20.2 26.1 57.4 260 269 A N >> - 0 0 85 1,-0.2 3,-1.4 -2,-0.1 4,-0.6 -0.684 29.3-155.6 -76.3 112.7 -20.9 22.7 59.0 261 270 A F H >> S+ 0 0 0 -2,-0.7 4,-2.6 1,-0.3 3,-0.7 0.778 89.4 65.0 -64.6 -30.6 -19.3 20.2 56.5 262 271 A A H 34 S+ 0 0 56 1,-0.2 -1,-0.3 2,-0.2 5,-0.2 0.767 104.3 48.3 -61.8 -27.0 -21.5 17.3 57.6 263 272 A N H <4 S+ 0 0 118 -3,-1.4 3,-0.3 3,-0.1 -1,-0.2 0.626 113.2 46.5 -86.9 -17.2 -24.5 19.4 56.3 264 273 A V H << S+ 0 0 57 -3,-0.7 2,-1.1 -4,-0.6 -2,-0.2 0.894 115.3 41.9 -89.6 -50.3 -22.8 20.1 52.9 265 274 A F S >< S- 0 0 11 -4,-2.6 3,-1.5 3,-0.0 -1,-0.2 -0.566 86.9-168.4 -97.7 68.2 -21.5 16.6 52.0 266 275 A I T 3 + 0 0 142 -2,-1.1 -3,-0.1 -3,-0.3 -4,-0.0 -0.300 65.9 13.9 -62.9 136.4 -24.6 14.7 53.1 267 276 A G T 3 S+ 0 0 82 1,-0.3 -1,-0.2 -5,-0.2 -4,-0.1 0.271 93.5 134.6 87.1 -10.3 -24.2 10.9 53.4 268 277 A A S < S- 0 0 28 -3,-1.5 -1,-0.3 -6,-0.1 5,-0.0 -0.255 70.8 -82.8 -71.5 156.7 -20.4 10.9 53.2 269 278 A N >> - 0 0 45 1,-0.2 4,-2.1 2,-0.1 3,-1.3 -0.459 37.6-135.6 -53.9 117.2 -18.0 8.9 55.4 270 279 A P H 3> S+ 0 0 102 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.781 106.8 55.4 -49.7 -32.2 -17.7 11.0 58.6 271 280 A L H 3> S+ 0 0 74 2,-0.2 4,-2.1 1,-0.2 27,-0.2 0.812 106.3 50.1 -71.7 -32.5 -13.9 10.3 58.4 272 281 A A H <> S+ 0 0 0 -3,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.865 109.9 51.6 -68.1 -39.0 -13.8 11.8 54.9 273 282 A V H X S+ 0 0 16 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.914 110.1 48.7 -63.0 -44.5 -15.7 14.8 56.2 274 283 A D H X S+ 0 0 60 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.935 111.4 48.8 -61.2 -48.8 -13.2 15.2 59.0 275 284 A L H X S+ 0 0 0 -4,-2.1 4,-1.0 1,-0.2 3,-0.4 0.899 109.2 53.2 -58.9 -43.6 -10.2 15.0 56.6 276 285 A L H X S+ 0 0 1 -4,-2.3 4,-2.9 1,-0.2 3,-0.4 0.872 105.9 54.0 -58.6 -39.3 -11.8 17.6 54.3 277 286 A E H < S+ 0 0 55 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.789 109.8 46.9 -66.1 -29.8 -12.2 20.0 57.2 278 287 A K H < S+ 0 0 73 -4,-1.3 10,-2.4 -3,-0.4 3,-0.3 0.593 116.8 44.8 -87.9 -12.9 -8.5 19.7 58.0 279 288 A M H < S+ 0 0 0 -4,-1.0 2,-0.6 -3,-0.4 -2,-0.2 0.819 108.1 54.3 -94.4 -41.3 -7.6 20.2 54.3 280 289 A L S < S+ 0 0 4 -4,-2.9 2,-0.5 -5,-0.2 -1,-0.2 -0.266 73.2 140.1 -93.7 46.1 -9.9 23.1 53.4 281 290 A V - 0 0 39 -2,-0.6 6,-0.1 -3,-0.3 -3,-0.1 -0.802 51.4-140.9 -86.8 128.4 -8.7 25.4 56.2 282 291 A L S S+ 0 0 13 -2,-0.5 2,-0.6 -52,-0.2 -99,-0.2 0.924 87.0 72.9 -55.4 -48.9 -8.4 28.9 54.9 283 292 A D S > S- 0 0 12 1,-0.2 3,-1.6 -3,-0.1 4,-0.4 -0.587 73.1-153.7 -74.5 113.6 -5.2 29.6 56.9 284 293 A S G > S+ 0 0 6 -2,-0.6 3,-0.6 1,-0.3 -1,-0.2 0.731 91.5 63.7 -61.9 -25.5 -2.4 27.7 55.1 285 294 A D G 3 S+ 0 0 103 1,-0.2 -1,-0.3 -93,-0.0 -2,-0.1 0.787 105.7 45.0 -65.5 -29.6 -0.4 27.5 58.3 286 295 A K G < S+ 0 0 142 -3,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.409 87.4 114.9 -99.1 -1.9 -3.2 25.4 59.9 287 296 A R S < S- 0 0 8 -3,-0.6 -8,-0.2 -4,-0.4 2,-0.1 -0.400 74.3-105.3 -68.7 146.1 -3.7 23.0 57.0 288 297 A I - 0 0 18 -10,-2.4 2,-0.2 -13,-0.2 -1,-0.1 -0.415 36.4-130.2 -64.0 144.3 -2.9 19.3 57.4 289 298 A T > - 0 0 36 1,-0.1 4,-2.4 -2,-0.1 5,-0.1 -0.483 19.8-110.1 -90.0 168.5 0.3 18.3 55.6 290 299 A A H > S+ 0 0 2 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.955 120.0 50.6 -60.5 -50.4 0.6 15.3 53.2 291 300 A A H > S+ 0 0 53 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.867 115.2 43.4 -56.4 -40.1 2.7 13.4 55.7 292 301 A Q H >4 S+ 0 0 116 1,-0.2 3,-0.8 2,-0.2 -1,-0.2 0.860 110.2 55.8 -72.0 -38.4 0.1 14.0 58.5 293 302 A A H >< S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.787 97.5 63.3 -67.5 -29.5 -2.8 13.2 56.1 294 303 A L H 3< S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.803 101.7 52.0 -61.7 -30.6 -1.4 9.8 55.4 295 304 A A T << S+ 0 0 68 -3,-0.8 -1,-0.2 -4,-0.5 -2,-0.2 0.400 82.3 120.0 -89.5 1.6 -1.8 8.9 59.1 296 305 A H S X S- 0 0 24 -3,-1.2 3,-2.3 -4,-0.2 7,-0.2 -0.440 75.4-120.3 -67.5 140.6 -5.5 10.0 59.1 297 306 A A G > S+ 0 0 62 1,-0.3 3,-1.1 2,-0.2 4,-0.2 0.627 106.0 77.8 -60.5 -14.8 -7.9 7.1 60.1 298 307 A Y G 3 S+ 0 0 3 -27,-0.2 -1,-0.3 1,-0.2 3,-0.2 0.706 101.1 39.9 -65.6 -20.1 -9.7 7.6 56.7 299 308 A F G X> S+ 0 0 0 -3,-2.3 4,-3.5 -6,-0.2 3,-2.2 0.235 74.6 121.3-112.6 11.9 -6.7 5.7 55.1 300 309 A A T <4 S+ 0 0 78 -3,-1.1 -1,-0.1 1,-0.3 -2,-0.1 0.709 75.6 56.2 -49.9 -24.0 -6.2 3.0 57.9 301 310 A Q T 34 S+ 0 0 126 -3,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.762 121.9 24.3 -80.1 -28.3 -6.9 0.3 55.2 302 311 A Y T <4 S+ 0 0 61 -3,-2.2 -2,-0.2 -8,-0.1 -1,-0.1 0.711 91.3 116.6-105.8 -28.9 -4.1 1.6 52.9 303 312 A H < + 0 0 61 -4,-3.5 -8,-0.1 -7,-0.2 5,-0.1 -0.178 31.8 170.7 -54.3 121.7 -1.7 3.4 55.3 304 313 A D > - 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