==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 12-OCT-10 3P7B . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR K.K.MOFFETT,H.NAMBOODIRI . 332 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17421.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 209 63.0 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 . 39 11.7 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 . 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 . 23 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 29.8 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 0 1 1 0 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 . 0 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 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 0 160 0, 0.0 87,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 136.6 75.6 22.7 -25.5 2 6 A P - 0 0 69 0, 0.0 2,-0.5 0, 0.0 0, 0.0 -0.118 360.0 -93.2 -76.5 177.0 75.1 26.0 -27.4 3 7 A T - 0 0 83 2,-0.0 15,-2.5 0, 0.0 16,-0.3 -0.863 41.5-153.9 -97.1 125.9 77.0 29.3 -26.9 4 8 A F E -A 17 0A 30 -2,-0.5 2,-0.3 13,-0.3 11,-0.1 -0.660 6.1-160.8 -96.2 148.8 75.3 31.7 -24.5 5 9 A Y E -A 16 0A 53 11,-2.8 11,-1.8 -2,-0.3 2,-0.3 -0.963 11.0-136.7-125.8 154.1 75.5 35.5 -24.4 6 10 A R E +A 15 0A 165 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.769 26.3 160.8-105.3 152.3 74.7 37.9 -21.6 7 11 A Q E -A 14 0A 83 7,-1.2 7,-3.2 -2,-0.3 2,-0.5 -0.960 32.8-124.1-165.5 149.6 72.9 41.2 -21.7 8 12 A E E -A 13 0A 116 -2,-0.3 2,-0.4 5,-0.2 5,-0.3 -0.867 22.6-175.7-101.9 132.6 71.2 43.5 -19.2 9 13 A L S S- 0 0 27 3,-3.4 3,-0.4 -2,-0.5 15,-0.1 -0.944 70.3 -29.8-133.6 109.6 67.6 44.5 -19.9 10 14 A N S S- 0 0 134 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.930 127.3 -40.5 43.5 65.1 66.0 47.0 -17.5 11 15 A K S S+ 0 0 178 1,-0.2 2,-0.4 -3,-0.0 -1,-0.2 0.702 121.4 107.3 64.6 20.7 68.0 46.1 -14.4 12 16 A T - 0 0 37 -3,-0.4 -3,-3.4 2,-0.0 2,-0.5 -0.982 64.8-134.5-125.0 142.9 67.7 42.3 -15.3 13 17 A I E -A 8 0A 86 -2,-0.4 2,-0.5 -5,-0.3 -5,-0.2 -0.847 19.7-167.5 -96.2 131.9 70.4 40.0 -16.6 14 18 A W E -A 7 0A 5 -7,-3.2 -7,-1.2 -2,-0.5 2,-0.6 -0.976 7.6-177.0-124.3 116.9 69.5 37.7 -19.5 15 19 A E E +A 6 0A 39 -2,-0.5 -9,-0.2 -9,-0.2 -11,-0.0 -0.936 22.5 149.6-120.6 108.5 71.7 34.8 -20.5 16 20 A V E -A 5 0A 1 -11,-1.8 -11,-2.8 -2,-0.6 -2,-0.0 -0.882 50.2 -82.1-135.1 159.6 70.4 33.0 -23.5 17 21 A P E > -A 4 0A 4 0, 0.0 3,-1.8 0, 0.0 -13,-0.3 -0.241 41.6-114.7 -59.4 152.3 71.8 31.0 -26.5 18 22 A E T 3 S+ 0 0 112 -15,-2.5 20,-0.2 1,-0.3 -14,-0.1 0.790 110.0 83.9 -63.9 -22.9 73.0 33.0 -29.5 19 23 A R T 3 S+ 0 0 53 -16,-0.3 19,-2.5 18,-0.1 2,-0.5 0.851 86.4 59.3 -36.7 -45.2 70.1 31.3 -31.2 20 24 A Y E < S+B 37 0B 0 -3,-1.8 2,-0.2 17,-0.2 17,-0.2 -0.842 71.0 164.7-101.5 122.1 67.9 34.1 -29.7 21 25 A Q E +B 36 0B 73 15,-2.0 15,-3.1 -2,-0.5 -3,-0.0 -0.793 47.1 42.7-133.1 166.7 68.7 37.8 -30.7 22 26 A N E S- 0 0 123 -2,-0.2 -1,-0.1 13,-0.2 2,-0.1 0.884 70.4-170.5 59.8 45.5 67.0 41.2 -30.5 23 27 A L E + 0 0 15 -3,-0.1 12,-0.2 12,-0.1 -1,-0.2 -0.436 9.7 175.0 -69.5 132.5 65.6 40.7 -27.0 24 28 A S E -B 34 0B 63 10,-1.8 10,-2.2 -2,-0.1 -15,-0.0 -0.939 32.2-113.9-141.2 124.9 63.1 43.4 -26.0 25 29 A P E +B 33 0B 56 0, 0.0 8,-0.2 0, 0.0 3,-0.1 -0.156 40.0 159.8 -58.8 146.7 61.2 43.4 -22.7 26 30 A V E + 0 0 99 6,-2.5 2,-0.3 1,-0.3 7,-0.2 0.254 63.5 32.0-139.0 -8.5 57.4 43.0 -23.0 27 31 A G E B 32 0B 21 5,-1.5 5,-2.1 136,-0.0 -1,-0.3 -0.980 360.0 360.0-165.9 141.8 56.7 41.8 -19.4 28 32 A S 0 0 138 -2,-0.3 3,-0.2 3,-0.3 0, 0.0 -0.851 360.0 360.0-161.5 360.0 57.6 41.8 -15.7 29 ! 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 30 36 A G 0 0 49 0, 0.0 2,-0.3 0, 0.0 19,-0.2 0.000 360.0 360.0 360.0-179.0 59.3 36.2 -14.1 31 37 A S E - C 0 48B 11 17,-1.5 17,-3.1 -3,-0.2 2,-0.4 -0.919 360.0-144.0-126.6 157.9 59.8 38.7 -16.9 32 38 A V E -BC 27 47B 17 -5,-2.1 -6,-2.5 -2,-0.3 -5,-1.5 -0.960 10.3-167.8-129.5 133.9 59.3 38.1 -20.7 33 39 A C E -BC 25 46B 0 13,-2.7 13,-3.5 -2,-0.4 2,-0.2 -0.979 20.3-132.2-118.2 139.4 61.1 39.3 -23.8 34 40 A A E +BC 24 45B 20 -10,-2.2 -10,-1.8 -2,-0.4 2,-0.3 -0.521 39.4 170.0 -66.8 150.6 60.2 39.1 -27.4 35 41 A A E - C 0 44B 4 9,-2.1 9,-2.9 -12,-0.2 2,-0.5 -0.971 36.7-111.5-160.5 168.7 63.1 37.8 -29.5 36 42 A F E -BC 21 43B 69 -15,-3.1 -15,-2.0 -2,-0.3 2,-1.0 -0.960 23.0-144.1-114.8 124.3 64.0 36.6 -33.0 37 43 A D E >>> -BC 20 42B 1 5,-2.8 4,-3.1 -2,-0.5 3,-2.1 -0.780 9.4-165.3 -93.5 98.7 64.9 32.9 -33.3 38 44 A T T 345S+ 0 0 76 -19,-2.5 -1,-0.2 -2,-1.0 -18,-0.1 0.720 83.1 66.2 -55.0 -24.4 67.6 32.8 -35.9 39 45 A K T 345S+ 0 0 139 -20,-0.3 -1,-0.3 1,-0.1 -19,-0.1 0.573 121.7 13.0 -75.4 -13.2 67.1 29.1 -36.3 40 46 A T T <45S- 0 0 72 -3,-2.1 -2,-0.2 2,-0.2 -1,-0.1 0.540 94.7-122.9-129.9 -29.0 63.6 29.4 -37.7 41 47 A G T <5S+ 0 0 36 -4,-3.1 2,-0.2 1,-0.3 -3,-0.2 0.452 72.1 122.3 87.2 7.0 63.2 33.0 -38.6 42 48 A H E < -C 37 0B 111 -5,-0.6 -5,-2.8 1,-0.0 -1,-0.3 -0.625 66.9-107.3 -99.7 158.6 60.2 33.3 -36.3 43 49 A R E -C 36 0B 162 -2,-0.2 59,-2.3 -7,-0.2 2,-0.3 -0.617 38.6-169.7 -81.5 139.2 59.5 35.6 -33.4 44 50 A V E -CD 35 101B 0 -9,-2.9 -9,-2.1 -2,-0.3 2,-0.5 -0.843 23.0-133.9-125.6 162.1 59.6 34.1 -29.9 45 51 A A E -CD 34 100B 15 55,-2.6 55,-2.4 -2,-0.3 2,-0.5 -0.982 21.5-161.9-111.5 126.7 58.7 35.0 -26.4 46 52 A V E -CD 33 99B 0 -13,-3.5 -13,-2.7 -2,-0.5 2,-0.5 -0.971 3.2-160.9-111.3 118.9 61.4 34.1 -23.8 47 53 A K E -CD 32 98B 44 51,-2.7 51,-2.3 -2,-0.5 2,-0.6 -0.911 2.1-157.9-101.0 127.5 60.2 34.0 -20.1 48 54 A K E -CD 31 97B 24 -17,-3.1 -17,-1.5 -2,-0.5 49,-0.2 -0.929 23.2-124.3-101.3 120.5 62.9 34.2 -17.4 49 55 A L - 0 0 9 47,-2.6 2,-0.7 -2,-0.6 47,-0.3 -0.424 20.8-129.6 -67.9 132.6 61.7 32.7 -14.1 50 56 A S S S- 0 0 70 1,-0.2 -1,-0.1 -2,-0.1 45,-0.0 -0.793 78.7 -26.2 -87.4 112.6 62.1 35.2 -11.3 51 57 A R S > S- 0 0 173 -2,-0.7 3,-1.6 1,-0.1 4,-0.3 0.915 76.2-172.9 59.9 53.7 63.9 33.7 -8.2 52 58 A P T 3 S+ 0 0 5 0, 0.0 10,-0.4 0, 0.0 11,-0.2 0.698 75.7 29.5 -62.3 -20.9 62.8 30.1 -9.2 53 59 A F T 3 S+ 0 0 15 41,-0.2 6,-0.1 1,-0.1 -2,-0.1 0.031 78.0 118.5-131.0 27.0 64.1 28.4 -6.0 54 60 A Q S < S+ 0 0 111 -3,-1.6 2,-0.2 2,-0.0 -1,-0.1 0.883 85.5 8.4 -59.7 -47.5 63.9 31.1 -3.3 55 61 A S S > S- 0 0 44 -4,-0.3 4,-1.8 -3,-0.1 5,-0.1 -0.724 81.6-103.7-124.6 179.9 61.4 29.1 -1.1 56 62 A I H > S+ 0 0 80 -2,-0.2 4,-2.7 2,-0.2 5,-0.2 0.930 125.1 50.8 -67.0 -41.9 60.0 25.6 -1.2 57 63 A I H > S+ 0 0 117 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.828 110.7 46.5 -64.5 -39.7 56.8 27.1 -2.5 58 64 A H H > S+ 0 0 60 2,-0.2 4,-1.8 1,-0.1 -1,-0.2 0.874 112.1 52.9 -63.0 -43.0 58.6 29.0 -5.3 59 65 A A H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.903 109.2 47.4 -65.1 -45.1 60.6 25.8 -6.1 60 66 A K H X S+ 0 0 26 -4,-2.7 4,-3.0 2,-0.2 -1,-0.2 0.875 110.8 52.2 -59.3 -41.5 57.4 23.8 -6.5 61 67 A R H X S+ 0 0 135 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.823 108.8 51.2 -63.2 -34.6 55.7 26.5 -8.7 62 68 A T H X S+ 0 0 8 -4,-1.8 4,-2.6 -10,-0.4 -2,-0.2 0.966 113.4 43.9 -67.2 -48.5 58.8 26.5 -11.0 63 69 A Y H X S+ 0 0 18 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.904 112.7 54.0 -65.1 -43.5 58.6 22.7 -11.3 64 70 A R H X S+ 0 0 67 -4,-3.0 4,-2.8 1,-0.2 -1,-0.2 0.894 110.9 45.2 -52.6 -49.0 54.8 22.9 -11.8 65 71 A E H X S+ 0 0 43 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.932 114.3 47.2 -72.0 -41.0 55.2 25.4 -14.7 66 72 A L H X S+ 0 0 1 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.936 113.9 47.2 -62.7 -43.9 57.9 23.5 -16.4 67 73 A R H X S+ 0 0 38 -4,-2.8 4,-0.9 2,-0.2 -2,-0.2 0.938 115.2 47.1 -63.9 -48.6 56.0 20.1 -16.1 68 74 A L H >X S+ 0 0 44 -4,-2.8 4,-1.8 -5,-0.2 3,-1.1 0.956 112.2 47.6 -57.0 -54.7 52.8 21.7 -17.3 69 75 A L H 3< S+ 0 0 22 -4,-2.9 11,-0.8 1,-0.3 -1,-0.2 0.841 109.1 54.5 -59.5 -35.1 54.3 23.5 -20.3 70 76 A K H 3< S+ 0 0 36 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.752 111.0 47.7 -65.8 -23.8 56.2 20.3 -21.3 71 77 A H H << S+ 0 0 37 -3,-1.1 2,-0.6 -4,-0.9 232,-0.3 0.812 87.3 94.6 -88.4 -29.2 52.9 18.5 -21.4 72 78 A M < + 0 0 9 -4,-1.8 8,-0.4 1,-0.1 2,-0.3 -0.494 38.7 158.4 -77.8 110.9 50.8 21.0 -23.4 73 79 A K + 0 0 164 -2,-0.6 2,-0.3 6,-0.1 6,-0.1 -0.727 31.2 111.9-131.3 78.1 50.8 20.0 -27.1 74 80 A H > - 0 0 19 3,-0.5 3,-1.6 -2,-0.3 57,-0.0 -0.990 69.0-121.2-151.8 144.4 47.7 21.7 -28.6 75 81 A E T 3 S+ 0 0 125 -2,-0.3 4,-0.1 1,-0.3 56,-0.1 0.746 111.9 45.2 -57.3 -29.5 47.1 24.5 -31.2 76 82 A N T 3 S+ 0 0 4 83,-0.1 84,-2.2 2,-0.1 2,-0.4 0.107 106.0 69.1-104.9 18.5 45.0 26.6 -28.8 77 83 A V B < S-f 160 0C 6 -3,-1.6 -3,-0.5 82,-0.3 84,-0.2 -0.999 93.5 -95.6-133.5 141.6 47.3 26.3 -25.7 78 84 A I - 0 0 31 82,-2.7 2,-0.3 -2,-0.4 -2,-0.1 -0.232 46.3-167.3 -49.9 137.4 50.7 27.7 -25.2 79 85 A G - 0 0 22 22,-0.1 2,-0.5 -6,-0.1 22,-0.4 -0.911 21.7-107.3-130.4 155.8 53.4 25.1 -26.0 80 86 A L + 0 0 14 -11,-0.8 20,-0.2 -8,-0.4 3,-0.1 -0.768 27.8 174.4 -90.1 121.2 57.2 24.9 -25.4 81 87 A L S S- 0 0 51 18,-3.1 2,-0.3 -2,-0.5 19,-0.2 0.761 75.0 -9.8 -82.8 -32.2 59.6 25.5 -28.2 82 88 A D E -E 99 0B 27 17,-1.3 17,-2.7 250,-0.1 -1,-0.3 -0.989 50.2-163.1-162.2 152.9 62.6 25.4 -25.9 83 89 A V E +E 98 0B 8 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.960 26.7 161.1-144.4 134.9 63.7 25.3 -22.3 84 90 A F E -E 97 0B 14 13,-2.4 13,-2.6 -2,-0.3 3,-0.1 -0.967 25.6-159.4-148.0 161.4 67.2 26.1 -21.3 85 91 A T - 0 0 14 -2,-0.3 11,-0.1 11,-0.2 8,-0.1 -0.980 24.0-136.8-135.0 142.5 69.5 27.2 -18.4 86 92 A P S S+ 0 0 18 0, 0.0 -82,-0.1 0, 0.0 -1,-0.1 0.864 74.2 112.5 -63.5 -30.1 73.0 28.8 -18.7 87 93 A A - 0 0 17 8,-0.2 -2,-0.2 1,-0.1 6,-0.1 -0.030 58.1-156.4 -48.8 133.6 74.1 26.4 -15.8 88 94 A R S S+ 0 0 141 1,-0.1 2,-0.3 -87,-0.0 -1,-0.1 0.532 74.3 12.0 -87.1 -8.1 76.6 23.7 -16.7 89 95 A S S >> S- 0 0 35 1,-0.1 4,-2.8 0, 0.0 3,-0.5 -0.989 80.0 -97.4-163.3 167.9 75.5 21.4 -13.8 90 96 A L T 34 S+ 0 0 45 -2,-0.3 -1,-0.1 1,-0.3 234,-0.1 0.884 122.5 52.6 -60.9 -39.8 72.9 20.8 -11.0 91 97 A E T 34 S+ 0 0 164 1,-0.2 -1,-0.3 -3,-0.1 -4,-0.0 0.781 115.7 41.6 -66.4 -29.4 75.1 22.5 -8.4 92 98 A E T <4 S+ 0 0 125 -3,-0.5 -2,-0.2 -6,-0.0 -1,-0.2 0.780 86.8 117.2 -83.3 -34.6 75.3 25.5 -10.8 93 99 A F < + 0 0 0 -4,-2.8 3,-0.1 1,-0.2 231,-0.1 -0.080 21.5 126.8 -36.8 116.2 71.6 25.5 -11.8 94 100 A N + 0 0 87 1,-0.3 2,-0.4 -42,-0.0 -41,-0.2 0.395 56.1 63.0-150.5 -10.7 69.8 28.7 -10.6 95 101 A D - 0 0 53 -44,-0.1 2,-0.4 -43,-0.1 -1,-0.3 -0.949 55.4-165.9-128.3 142.2 68.1 30.2 -13.7 96 102 A V - 0 0 0 -2,-0.4 -47,-2.6 -47,-0.3 2,-0.4 -0.996 3.9-173.5-130.8 128.5 65.3 28.8 -15.9 97 103 A Y E -DE 48 84B 0 -13,-2.6 -13,-2.4 -2,-0.4 2,-0.3 -0.983 3.3-166.3-123.4 137.4 64.3 30.1 -19.3 98 104 A L E -DE 47 83B 7 -51,-2.3 -51,-2.7 -2,-0.4 2,-0.4 -0.946 6.5-155.4-122.1 144.3 61.3 28.9 -21.3 99 105 A V E +DE 46 82B 1 -17,-2.7 -18,-3.1 -2,-0.3 -17,-1.3 -0.950 16.4 166.4-126.3 131.0 60.6 29.7 -25.0 100 106 A T E -D 45 0B 21 -55,-2.4 -55,-2.6 -2,-0.4 2,-0.2 -0.961 45.7 -80.9-136.6 164.2 57.4 29.8 -27.0 101 107 A H E -D 44 0B 72 -22,-0.4 2,-0.5 -2,-0.3 -57,-0.3 -0.396 50.7-121.5 -59.7 124.0 56.0 31.1 -30.3 102 108 A L - 0 0 49 -59,-2.3 2,-0.4 -2,-0.2 -59,-0.2 -0.599 22.9-162.8 -70.5 119.4 55.3 34.8 -30.1 103 109 A M - 0 0 27 -2,-0.5 50,-0.2 1,-0.1 49,-0.1 -0.859 22.1-129.6 -98.4 142.4 51.7 35.7 -30.9 104 110 A G S S+ 0 0 74 -2,-0.4 2,-0.3 47,-0.1 49,-0.2 0.653 73.7 11.1 -73.7 -20.4 51.5 39.4 -31.7 105 111 A A E -G 152 0C 32 47,-1.3 47,-2.7 4,-0.0 2,-0.3 -0.908 62.7-120.2-152.0 164.9 48.6 40.5 -29.3 106 112 A D E > -G 151 0C 41 45,-0.3 4,-1.6 -2,-0.3 45,-0.2 -0.699 37.0-110.6-104.1 163.8 46.3 39.6 -26.4 107 113 A L H > S+ 0 0 0 43,-1.6 4,-2.3 40,-1.4 41,-0.2 0.811 115.6 63.3 -66.8 -30.9 42.5 39.5 -26.7 108 114 A N H > S+ 0 0 60 39,-0.5 4,-1.2 2,-0.2 -1,-0.2 0.965 104.1 48.6 -55.6 -49.2 42.2 42.6 -24.5 109 115 A N H >> S+ 0 0 87 1,-0.2 4,-0.9 2,-0.2 3,-0.7 0.926 111.8 47.9 -54.8 -50.9 44.0 44.6 -27.1 110 116 A I H 3X S+ 0 0 24 -4,-1.6 4,-0.5 1,-0.2 -1,-0.2 0.852 107.7 56.7 -58.3 -38.2 41.9 43.3 -30.0 111 117 A V H 3< S+ 0 0 18 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.749 98.4 63.6 -71.0 -21.1 38.6 44.0 -28.0 112 118 A K H << S+ 0 0 128 -4,-1.2 -1,-0.2 -3,-0.7 -2,-0.2 0.942 115.7 17.1 -79.0 -44.5 39.3 47.7 -27.6 113 119 A C H < S+ 0 0 101 -4,-0.9 2,-0.3 1,-0.1 -1,-0.2 0.106 115.1 65.4-121.6 33.4 39.4 49.1 -31.1 114 120 A Q < - 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0 0 43 1,-0.2 4,-2.0 2,-0.1 3,-0.5 -0.278 36.5-132.8 -47.3 123.5 22.7 35.9 -32.2 261 279 A P H > S+ 0 0 102 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.824 108.2 58.6 -57.8 -30.0 20.0 34.0 -30.2 262 280 A L H > S+ 0 0 72 2,-0.2 4,-1.9 1,-0.2 27,-0.2 0.889 105.2 49.5 -66.1 -38.6 22.3 30.9 -30.3 263 281 A A H > S+ 0 0 0 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.902 110.2 50.6 -63.7 -43.7 25.0 33.0 -28.6 264 282 A V H X S+ 0 0 12 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.927 109.3 51.8 -58.6 -45.0 22.5 34.1 -25.9 265 283 A D H X S+ 0 0 52 -4,-2.5 4,-1.1 1,-0.2 -1,-0.2 0.897 110.2 47.9 -56.5 -45.5 21.5 30.4 -25.4 266 284 A L H X S+ 0 0 0 -4,-1.9 4,-1.3 1,-0.2 3,-0.3 0.894 109.3 52.5 -67.2 -40.8 25.1 29.4 -24.9 267 285 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 3,-0.4 0.891 106.0 54.9 -61.5 -37.0 25.8 32.3 -22.4 268 286 A E H < S+ 0 0 61 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.825 109.2 48.1 -62.9 -30.6 22.7 31.1 -20.4 269 287 A K H < S+ 0 0 83 -4,-1.1 10,-2.4 -3,-0.3 3,-0.3 0.667 117.2 42.1 -84.6 -20.9 24.3 27.7 -20.2 270 288 A M H < S+ 0 0 0 -4,-1.3 2,-0.9 -3,-0.4 -2,-0.2 0.817 107.2 57.5 -85.8 -38.8 27.8 29.1 -19.1 271 289 A L S < S+ 0 0 4 -4,-2.6 2,-0.4 -5,-0.1 -1,-0.2 -0.379 71.5 134.7 -98.8 51.7 26.8 31.8 -16.6 272 290 A V - 0 0 41 -2,-0.9 6,-0.1 -3,-0.3 5,-0.1 -0.857 53.7-141.1 -95.9 131.4 24.8 29.6 -14.2 273 291 A L S S+ 0 0 31 -2,-0.4 2,-0.8 -52,-0.2 -99,-0.2 0.947 88.3 76.2 -57.7 -48.0 25.6 30.2 -10.5 274 292 A D S > S- 0 0 16 1,-0.2 3,-2.5 3,-0.1 4,-0.3 -0.548 73.1-155.4 -72.0 112.4 25.4 26.5 -9.8 275 293 A S G > S+ 0 0 26 -2,-0.8 3,-1.3 1,-0.3 -1,-0.2 0.818 90.5 65.1 -60.6 -28.1 28.8 25.0 -11.1 276 294 A D G 3 S+ 0 0 108 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.705 103.3 46.2 -64.2 -20.0 27.1 21.6 -11.5 277 295 A K G < S+ 0 0 112 -3,-2.5 2,-0.3 -5,-0.1 -1,-0.3 0.335 84.8 111.8-107.3 -0.4 24.8 23.0 -14.1 278 296 A R S < S- 0 0 8 -3,-1.3 -8,-0.2 -4,-0.3 -9,-0.1 -0.616 76.9-106.4 -72.5 139.3 27.3 24.9 -16.2 279 297 A I - 0 0 19 -10,-2.4 2,-0.1 -2,-0.3 -1,-0.1 -0.270 36.0-122.5 -58.6 143.5 27.9 23.4 -19.7 280 298 A T > - 0 0 55 1,-0.1 4,-2.6 -3,-0.1 5,-0.2 -0.418 22.0-109.5 -82.8 165.4 31.3 21.6 -20.1 281 299 A A H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 -148,-0.2 0.975 121.9 49.4 -61.7 -47.0 33.9 22.7 -22.7 282 300 A A H > S+ 0 0 54 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.911 112.0 47.1 -57.7 -44.7 33.3 19.4 -24.6 283 301 A Q H >4 S+ 0 0 116 1,-0.2 3,-0.6 2,-0.2 -1,-0.2 0.901 111.2 53.2 -60.9 -45.2 29.4 19.9 -24.5 284 302 A A H >< S+ 0 0 0 -4,-2.6 3,-1.9 1,-0.2 6,-0.2 0.834 98.0 62.0 -59.4 -40.9 29.9 23.6 -25.6 285 303 A L H 3< S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.855 104.4 50.9 -56.5 -32.0 32.0 22.6 -28.6 286 304 A A T << S+ 0 0 65 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.387 83.8 117.6 -82.3 -2.4 28.8 20.7 -29.9 287 305 A H S X S- 0 0 23 -3,-1.9 3,-2.3 1,-0.1 7,-0.1 -0.500 76.3-121.4 -70.2 138.3 26.5 23.7 -29.4 288 306 A A G > S+ 0 0 60 1,-0.3 3,-2.0 2,-0.2 4,-0.2 0.685 105.2 78.2 -57.1 -21.3 24.9 24.9 -32.6 289 307 A Y G 3 S+ 0 0 3 1,-0.3 3,-0.3 -27,-0.2 -1,-0.3 0.842 101.1 41.7 -53.3 -30.8 26.5 28.4 -32.2 290 308 A F G X> S+ 0 0 0 -3,-2.3 3,-2.8 -6,-0.2 4,-2.5 0.182 74.8 123.9-103.3 16.9 29.7 26.8 -33.4 291 309 A A T <4 S+ 0 0 64 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.818 75.7 52.7 -47.1 -36.5 28.2 24.7 -36.2 292 310 A Q T 34 S+ 0 0 152 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.564 121.1 29.8 -76.1 -9.9 30.6 26.3 -38.8 293 311 A Y T <4 S+ 0 0 62 -3,-2.8 -2,-0.2 -8,-0.1 -1,-0.2 0.663 89.2 107.5-120.8 -25.2 33.7 25.5 -36.7 294 312 A H < + 0 0 62 -4,-2.5 -8,-0.1 -7,-0.1 5,-0.0 -0.257 32.5 168.4 -65.1 134.8 33.1 22.3 -34.8 295 313 A D > - 0 0 68 1,-0.0 3,-2.5 3,-0.0 -9,-0.0 -0.776 20.2-161.7-142.9 104.1 34.8 19.2 -36.0 296 314 A P T 3 S+ 0 0 88 0, 0.0 3,-0.4 0, 0.0 -2,-0.0 0.614 91.8 58.4 -64.6 -9.4 34.5 16.4 -33.6 297 315 A D T 3 S+ 0 0 150 1,-0.2 -3,-0.0 3,-0.0 0, 0.0 0.425 108.5 45.9 -92.7 -2.4 37.5 14.6 -35.2 298 316 A D S < S+ 0 0 76 -3,-2.5 -1,-0.2 1,-0.1 -3,-0.0 -0.143 82.2 91.7-136.4 44.6 39.7 17.6 -34.6 299 317 A E - 0 0 10 -3,-0.4 -1,-0.1 -5,-0.0 -14,-0.0 -0.749 67.6-166.6-130.4 76.0 39.1 18.6 -30.9 300 318 A P - 0 0 59 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.179 13.2-136.9 -77.8 165.6 41.8 16.5 -29.3 301 319 A V - 0 0 86 -164,-0.1 -167,-0.1 1,-0.1 2,-0.1 -0.688 26.3-102.3-112.9 167.0 42.5 15.5 -25.7 302 320 A A - 0 0 14 -168,-0.5 3,-0.1 -2,-0.2 -230,-0.1 -0.474 33.1-104.6 -89.6 153.1 45.8 15.4 -23.7 303 321 A D - 0 0 116 -232,-0.3 -1,-0.1 1,-0.2 -232,-0.0 -0.307 63.5 -68.4 -62.2 163.0 47.8 12.4 -22.8 304 322 A P - 0 0 124 0, 0.0 2,-0.6 0, 0.0 -1,-0.2 -0.312 51.9-146.9 -64.9 142.2 47.6 11.4 -19.3 305 323 A Y - 0 0 25 -3,-0.1 2,-1.2 -167,-0.1 -237,-0.0 -0.926 0.5-148.5-114.5 113.7 49.1 13.9 -17.0 306 324 A D + 0 0 96 -2,-0.6 3,-0.4 1,-0.1 -168,-0.0 -0.619 27.4 163.1 -76.2 97.2 50.8 12.7 -13.8 307 325 A Q > + 0 0 51 -2,-1.2 3,-1.7 1,-0.2 4,-0.2 -0.023 31.5 122.9-106.9 37.1 50.3 15.4 -11.2 308 326 A S G > + 0 0 42 1,-0.3 3,-1.6 2,-0.2 4,-0.4 0.794 61.5 75.7 -59.5 -26.6 51.1 13.3 -8.2 309 327 A F G > S+ 0 0 3 -3,-0.4 3,-1.5 1,-0.3 -1,-0.3 0.748 80.3 74.6 -51.5 -25.7 53.9 15.9 -7.3 310 328 A E G < S+ 0 0 63 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.725 94.7 46.9 -64.3 -28.9 51.0 18.2 -6.2 311 329 A S G < S+ 0 0 99 -3,-1.6 -1,-0.3 -4,-0.2 -2,-0.2 0.587 95.3 103.0 -85.0 -8.9 50.5 16.3 -3.0 312 330 A R < - 0 0 111 -3,-1.5 2,-0.6 -4,-0.4 -3,-0.0 -0.496 55.2-156.3 -91.5 144.1 54.3 16.1 -2.2 313 331 A D + 0 0 155 -2,-0.2 2,-0.2 -253,-0.0 -3,-0.0 -0.941 33.2 167.5-119.9 98.3 56.1 18.2 0.4 314 332 A L - 0 0 40 -2,-0.6 2,-0.1 -258,-0.1 -254,-0.1 -0.674 37.7 -96.2-116.4 168.5 59.7 18.2 -0.7 315 333 A L > - 0 0 100 -2,-0.2 4,-2.1 1,-0.1 3,-0.3 -0.406 39.8-111.2 -74.8 151.4 63.1 20.0 0.1 316 334 A I H > S+ 0 0 51 1,-0.2 4,-2.4 2,-0.2 3,-0.4 0.962 119.0 48.6 -47.8 -57.2 64.1 22.9 -2.2 317 335 A D H > S+ 0 0 111 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.736 107.3 56.3 -63.8 -27.1 67.0 21.0 -3.7 318 336 A E H > S+ 0 0 86 -3,-0.3 4,-2.5 2,-0.2 -1,-0.3 0.957 110.8 42.7 -61.2 -49.7 64.7 18.1 -4.3 319 337 A W H X S+ 0 0 0 -4,-2.1 4,-2.4 -3,-0.4 -2,-0.2 0.859 115.2 54.2 -66.2 -31.3 62.3 20.3 -6.4 320 338 A K H X S+ 0 0 24 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.897 108.0 45.1 -72.8 -41.2 65.4 21.8 -7.9 321 339 A S H X S+ 0 0 40 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.871 114.0 51.6 -69.7 -33.7 66.9 18.5 -9.0 322 340 A L H X S+ 0 0 43 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.924 110.4 48.0 -64.5 -44.3 63.4 17.5 -10.4 323 341 A T H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.936 112.1 50.7 -63.8 -40.8 63.3 20.7 -12.3 324 342 A Y H X S+ 0 0 42 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.910 105.8 55.4 -61.8 -42.3 66.8 20.1 -13.6 325 343 A D H X S+ 0 0 89 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.910 108.4 48.2 -53.3 -49.2 65.8 16.5 -14.7 326 344 A E H X S+ 0 0 43 -4,-1.9 4,-0.6 2,-0.2 -1,-0.2 0.822 107.7 54.6 -66.8 -33.7 63.0 17.9 -16.8 327 345 A V H >< S+ 0 0 15 -4,-1.8 3,-0.9 1,-0.2 -1,-0.2 0.960 112.4 44.9 -60.3 -46.5 65.2 20.6 -18.5 328 346 A I H 3< S+ 0 0 109 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.894 111.9 49.6 -67.5 -41.4 67.6 17.8 -19.5 329 347 A S H 3< S+ 0 0 66 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.501 82.6 127.0 -79.3 -2.3 64.9 15.4 -20.8 330 348 A F << - 0 0 33 -3,-0.9 -247,-0.1 -4,-0.6 -3,-0.0 -0.296 39.7-168.3 -61.3 135.8 63.2 18.1 -22.9 331 349 A V - 0 0 113 -261,-0.1 -2,-0.1 -249,-0.0 -249,-0.0 -0.990 20.7-128.0-125.1 120.6 62.7 17.2 -26.6 332 350 A P - 0 0 69 0, 0.0 -251,-0.1 0, 0.0 -250,-0.1 -0.243 29.2-100.8 -66.2 149.6 61.7 20.1 -28.9 333 351 A P 0 0 65 0, 0.0 -260,-0.0 0, 0.0 -252,-0.0 -0.140 360.0 360.0 -61.1 169.8 58.6 19.8 -31.2 334 352 A P 0 0 184 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.108 360.0 360.0 -76.9 360.0 59.2 19.0 -34.9