==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=16-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 19-JUL-12 4G6O . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.N.KANG,J.A.STUCKEY,VERTEX CRYSTALLOGRAPHERS . 341 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16657.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 202 59.2 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 . 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 . 13 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 100 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 1 2 0 1 0 1 1 1 1 0 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 . 2 2 1 1 2 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 9 A P 0 0 143 0, 0.0 9,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 88.3 25.2 12.7 35.6 2 10 A E - 0 0 46 7,-0.3 7,-2.7 6,-0.1 2,-0.4 -0.405 360.0-147.7 -67.5 135.1 26.4 13.3 32.0 3 11 A M B -A 8 0A 129 5,-0.2 2,-0.4 -2,-0.1 5,-0.2 -0.893 14.2-175.5-107.8 133.7 25.0 16.4 30.1 4 12 A V S S- 0 0 17 3,-2.6 15,-0.1 -2,-0.4 -2,-0.0 -0.973 70.3 -22.5-134.9 119.8 24.4 16.4 26.3 5 13 A R S S- 0 0 87 -2,-0.4 3,-0.1 1,-0.2 -1,-0.1 0.863 128.7 -47.0 47.9 49.1 23.2 19.5 24.4 6 14 A G S S+ 0 0 79 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.917 118.8 103.0 62.1 49.9 21.7 21.0 27.6 7 15 A Q S S- 0 0 25 2,-0.0 -3,-2.6 20,-0.0 2,-0.2 -0.958 76.9-102.0-158.7 142.0 19.9 17.8 28.7 8 16 A V B +A 3 0A 63 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.1 -0.481 39.0 167.6 -66.4 129.5 20.4 15.1 31.4 9 17 A F + 0 0 0 -7,-2.7 2,-1.0 -2,-0.2 -7,-0.3 -0.564 4.8 168.6-144.3 67.1 21.8 11.9 29.8 10 18 A D + 0 0 77 -9,-0.2 81,-0.1 1,-0.1 -2,-0.1 -0.757 7.1 161.7 -93.5 96.9 22.9 9.7 32.8 11 19 A V > - 0 0 6 -2,-1.0 4,-0.6 1,-0.3 3,-0.3 0.287 46.2-126.6 -99.7 8.7 23.6 6.2 31.4 12 20 A G T 4 - 0 0 44 1,-0.2 3,-0.4 2,-0.1 -1,-0.3 -0.134 44.0 -45.7 76.9-171.7 25.7 5.2 34.4 13 21 A P T 4 S+ 0 0 123 0, 0.0 -1,-0.2 0, 0.0 21,-0.1 0.814 126.6 64.4 -66.2 -32.1 29.3 3.7 34.7 14 22 A R T 4 S+ 0 0 77 -3,-0.3 20,-3.3 1,-0.1 2,-0.5 0.852 100.7 50.1 -60.4 -42.4 28.8 1.2 31.8 15 23 A Y E < S+B 33 0B 4 -4,-0.6 -4,-0.2 -3,-0.4 2,-0.2 -0.911 71.3 158.9-111.4 122.4 28.3 3.7 29.0 16 24 A T E +B 32 0B 51 16,-2.4 16,-3.9 -2,-0.5 -2,-0.0 -0.790 40.3 46.7-134.0 173.0 30.8 6.7 28.5 17 25 A N E S- 0 0 120 -2,-0.2 -1,-0.2 14,-0.2 2,-0.2 0.985 73.1-159.3 53.4 70.1 32.2 9.3 25.9 18 26 A L E - 0 0 42 13,-0.1 2,-0.3 -3,-0.1 13,-0.2 -0.503 18.1-173.8 -83.1 148.4 28.8 10.4 24.6 19 27 A S E -B 30 0B 58 11,-1.6 11,-2.8 -2,-0.2 -15,-0.1 -0.986 28.2-115.5-140.7 128.6 28.2 12.2 21.2 20 28 A Y E +B 29 0B 63 -2,-0.3 9,-0.2 9,-0.2 -15,-0.0 -0.238 34.4 167.9 -65.2 153.3 24.7 13.6 20.2 21 29 A I E - 0 0 97 7,-1.8 2,-0.2 1,-0.4 8,-0.2 0.542 49.5 -62.5-127.7 -67.9 22.9 12.1 17.1 22 30 A G E B 28 0B 36 6,-0.9 6,-2.0 1,-0.0 -1,-0.4 -0.901 360.0 360.0-168.5-167.3 19.2 13.3 16.9 23 31 A E 0 0 194 -2,-0.2 3,-0.4 4,-0.2 -1,-0.0 0.286 360.0 360.0-138.5 360.0 15.7 13.5 18.4 24 ! 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 25 34 A Y 0 0 94 0, 0.0 21,-2.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 176.2 9.7 11.7 22.8 26 35 A G E - C 0 45B 28 -3,-0.4 2,-0.2 19,-0.2 19,-0.2 -0.955 360.0 -70.2 160.1-175.8 13.4 11.9 23.6 27 36 A M E - C 0 44B 17 17,-0.6 17,-2.9 -2,-0.3 2,-0.4 -0.674 27.1-148.1-108.1 158.6 17.1 12.2 22.6 28 37 A V E +BC 22 43B 37 -6,-2.0 -7,-1.8 15,-0.3 -6,-0.9 -0.996 19.4 172.7-130.9 133.6 19.6 9.7 21.0 29 38 A C E -BC 20 42B 0 13,-2.8 13,-3.2 -2,-0.4 2,-0.3 -0.936 29.6-123.0-134.7 159.2 23.5 9.6 21.6 30 39 A S E +BC 19 41B 14 -11,-2.8 -11,-1.6 -2,-0.3 2,-0.3 -0.739 38.8 172.7 -98.0 149.9 26.4 7.3 20.7 31 40 A A E - C 0 40B 0 9,-2.3 9,-3.6 -2,-0.3 2,-0.5 -0.990 35.7-104.7-157.4 157.1 28.5 5.9 23.6 32 41 A Y E -BC 16 39B 71 -16,-3.9 -16,-2.4 -2,-0.3 2,-0.6 -0.746 28.5-143.4 -89.0 123.2 31.3 3.5 24.6 33 42 A D E > -B 15 0B 1 5,-2.1 4,-1.6 -2,-0.5 5,-0.3 -0.801 7.0-161.8 -86.9 115.3 30.1 0.3 26.3 34 43 A N T 4 S+ 0 0 58 -20,-3.3 -1,-0.1 -2,-0.6 -19,-0.1 0.650 87.1 49.5 -74.0 -15.7 32.7 -0.6 29.0 35 44 A V T 4 S+ 0 0 98 -21,-0.2 -1,-0.2 3,-0.1 -20,-0.0 0.930 125.1 24.5 -86.5 -53.1 31.5 -4.3 29.2 36 45 A N T 4 S- 0 0 93 2,-0.2 -2,-0.2 0, 0.0 3,-0.1 0.573 97.1-137.0 -88.3 -13.6 31.5 -5.2 25.5 37 46 A K < + 0 0 120 -4,-1.6 2,-0.3 1,-0.2 -3,-0.2 0.645 65.1 115.8 62.8 25.0 34.1 -2.5 24.6 38 47 A V S S- 0 0 81 -5,-0.3 -5,-2.1 -7,-0.0 2,-0.2 -0.882 73.8-106.3-118.8 149.2 32.1 -1.5 21.4 39 48 A R E -C 32 0B 94 -2,-0.3 57,-0.4 -7,-0.2 -7,-0.3 -0.579 44.7-173.4 -75.9 137.9 30.5 1.9 20.7 40 49 A V E -C 31 0B 6 -9,-3.6 -9,-2.3 -2,-0.2 2,-0.4 -0.695 24.2-113.9-123.8 173.3 26.6 1.7 21.0 41 50 A A E -CD 30 94B 13 53,-2.1 53,-3.1 -11,-0.2 2,-0.4 -0.929 27.6-164.7-112.4 136.4 23.5 3.9 20.4 42 51 A I E -CD 29 93B 0 -13,-3.2 -13,-2.8 -2,-0.4 2,-0.6 -0.996 6.1-160.5-129.8 128.6 21.4 5.0 23.3 43 52 A K E -CD 28 92B 40 49,-2.9 49,-2.8 -2,-0.4 2,-0.5 -0.942 6.8-156.9-112.0 111.3 17.9 6.5 23.1 44 53 A K E -CD 27 91B 27 -17,-2.9 -17,-0.6 -2,-0.6 2,-0.4 -0.766 15.4-171.9 -83.9 124.8 16.7 8.4 26.1 45 54 A I E -CD 26 90B 15 45,-2.8 45,-2.3 -2,-0.5 -19,-0.2 -0.982 20.5-173.3-126.0 139.2 12.9 8.5 26.2 46 55 A S + 0 0 48 -21,-2.6 3,-0.3 -2,-0.4 43,-0.1 -0.808 31.4 142.7-122.4 76.9 10.7 10.6 28.5 47 56 A P + 0 0 1 0, 0.0 3,-0.5 0, 0.0 7,-0.4 0.489 34.3 100.7-102.4 -2.2 7.1 9.3 27.7 48 57 A F S S+ 0 0 34 40,-0.3 282,-0.1 1,-0.2 3,-0.1 0.635 75.9 62.0 -65.6 -13.8 5.4 9.3 31.1 49 58 A E S S+ 0 0 168 -3,-0.3 2,-0.4 1,-0.2 -1,-0.2 0.946 107.0 40.7 -74.0 -50.6 3.4 12.6 30.5 50 59 A H S > S- 0 0 129 -3,-0.5 4,-1.3 1,-0.1 3,-0.3 -0.884 70.3-146.8-107.9 128.9 1.4 11.4 27.5 51 60 A Q H > S+ 0 0 77 -2,-0.4 4,-2.2 1,-0.2 -1,-0.1 0.675 99.5 60.2 -66.3 -21.6 -0.1 7.8 27.3 52 61 A T H > S+ 0 0 75 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.917 105.3 47.8 -70.8 -44.4 0.4 7.7 23.5 53 62 A Y H > S+ 0 0 20 -3,-0.3 4,-1.4 1,-0.2 -2,-0.2 0.825 114.2 48.5 -63.1 -33.5 4.2 8.1 24.0 54 63 A C H X S+ 0 0 0 -4,-1.3 4,-2.4 -7,-0.4 -2,-0.2 0.884 109.8 50.8 -70.0 -46.3 3.9 5.3 26.7 55 64 A Q H X S+ 0 0 12 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.866 113.5 45.2 -59.9 -41.9 1.9 3.1 24.4 56 65 A R H X S+ 0 0 99 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.778 113.4 50.6 -71.7 -35.7 4.6 3.5 21.6 57 66 A T H X S+ 0 0 13 -4,-1.4 4,-2.1 -5,-0.2 -2,-0.2 0.907 114.0 44.3 -67.8 -47.2 7.4 2.9 24.1 58 67 A L H X S+ 0 0 0 -4,-2.4 4,-3.3 2,-0.2 5,-0.2 0.929 112.0 48.7 -66.4 -53.9 5.9 -0.3 25.5 59 68 A R H X S+ 0 0 42 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.903 114.7 48.0 -58.7 -37.0 4.9 -1.9 22.2 60 69 A E H X S+ 0 0 6 -4,-1.4 4,-2.9 2,-0.2 5,-0.2 0.917 113.5 46.0 -68.2 -44.4 8.4 -1.3 20.8 61 70 A I H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 5,-0.3 0.972 114.7 48.4 -61.3 -52.3 10.1 -2.6 23.9 62 71 A K H X S+ 0 0 66 -4,-3.3 4,-1.3 1,-0.2 -2,-0.2 0.894 116.8 42.1 -52.5 -49.9 7.8 -5.7 24.0 63 72 A I H X S+ 0 0 3 -4,-2.6 4,-1.6 -5,-0.2 -1,-0.2 0.924 115.8 46.9 -67.1 -48.7 8.4 -6.4 20.2 64 73 A L H < S+ 0 0 3 -4,-2.9 11,-0.4 1,-0.2 -1,-0.2 0.730 109.4 53.7 -70.9 -23.7 12.2 -5.8 20.1 65 74 A L H < S+ 0 0 23 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.849 114.1 42.4 -77.1 -32.4 12.9 -7.8 23.3 66 75 A R H < S+ 0 0 134 -4,-1.3 2,-0.3 -5,-0.3 -2,-0.2 0.747 104.3 81.3 -81.8 -25.7 11.1 -10.8 21.7 67 76 A F < + 0 0 13 -4,-1.6 2,-0.3 -5,-0.1 62,-0.0 -0.591 49.3 175.2 -85.0 143.4 12.6 -10.3 18.2 68 77 A R + 0 0 229 -2,-0.3 2,-0.3 6,-0.1 5,-0.1 -0.809 24.8 133.0-148.0 100.3 16.1 -11.5 17.3 69 78 A H > - 0 0 17 3,-0.4 3,-1.7 -2,-0.3 56,-0.0 -0.988 58.0-125.7-153.8 142.2 17.1 -11.0 13.7 70 79 A E T 3 S+ 0 0 130 -2,-0.3 4,-0.1 1,-0.3 55,-0.1 0.710 112.3 46.7 -57.2 -32.3 20.1 -9.6 11.7 71 80 A N T 3 S+ 0 0 7 82,-0.1 83,-3.2 2,-0.1 2,-0.4 0.123 102.6 75.9-102.5 20.0 18.0 -7.1 9.8 72 81 A I B < S-f 154 0C 5 -3,-1.7 -3,-0.4 81,-0.3 83,-0.2 -0.999 86.5-112.8-131.0 133.5 16.1 -5.8 12.8 73 82 A I - 0 0 8 81,-3.1 2,-0.2 -2,-0.4 -6,-0.1 -0.299 36.8-150.3 -61.3 136.3 17.4 -3.4 15.5 74 83 A G - 0 0 18 -4,-0.1 2,-0.5 -6,-0.1 21,-0.4 -0.471 15.6-122.8 -98.7 178.3 17.8 -5.1 18.9 75 84 A I + 0 0 18 -11,-0.4 19,-0.2 -2,-0.2 3,-0.1 -0.984 29.0 176.1-120.0 105.7 17.6 -3.8 22.4 76 85 A N - 0 0 71 17,-2.7 2,-0.3 -2,-0.5 18,-0.2 0.843 66.9 -6.5 -80.6 -37.0 21.0 -4.7 24.0 77 86 A D E -E 93 0B 18 16,-1.3 16,-3.8 2,-0.0 2,-0.4 -0.986 53.8-146.3-158.0 154.2 20.3 -3.0 27.3 78 87 A I E -E 92 0B 1 -2,-0.3 2,-0.5 14,-0.2 14,-0.2 -0.988 17.3-163.0-128.0 118.4 17.7 -0.8 29.1 79 88 A I E +E 91 0B 30 12,-3.0 12,-3.6 -2,-0.4 2,-0.3 -0.900 27.4 134.4-104.4 130.7 19.0 1.8 31.6 80 89 A R E -E 90 0B 18 -2,-0.5 10,-0.1 10,-0.2 7,-0.1 -0.956 57.4 -67.8-162.2 167.9 16.6 3.4 34.1 81 90 A A - 0 0 26 8,-0.5 6,-0.1 -2,-0.3 260,-0.0 -0.168 46.8-115.9 -57.1 154.0 16.2 4.3 37.8 82 91 A P S S+ 0 0 90 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.725 94.7 44.5 -70.8 -19.5 15.9 1.3 40.3 83 92 A T S > S- 0 0 48 1,-0.1 4,-1.0 0, 0.0 -2,-0.1 -0.863 80.6-121.8-125.1 156.8 12.3 2.3 41.4 84 93 A I T >4 S+ 0 0 52 -2,-0.3 3,-0.6 1,-0.2 -1,-0.1 0.914 113.8 54.4 -58.6 -44.0 9.1 3.4 39.6 85 94 A E T 34 S+ 0 0 153 1,-0.3 -1,-0.2 -3,-0.0 -4,-0.0 0.847 112.2 41.2 -59.6 -44.1 9.1 6.6 41.7 86 95 A Q T 34 S+ 0 0 131 1,-0.1 2,-1.1 -3,-0.0 -1,-0.3 0.597 89.8 107.2 -80.9 -13.6 12.7 7.6 40.7 87 96 A M << + 0 0 1 -4,-1.0 3,-0.1 -3,-0.6 247,-0.1 -0.572 26.2 142.7 -74.1 97.7 12.1 6.5 37.0 88 97 A K + 0 0 64 -2,-1.1 -40,-0.3 1,-0.2 2,-0.3 0.719 69.7 25.3-101.9 -32.9 11.8 9.8 35.0 89 98 A D - 0 0 34 -3,-0.2 -8,-0.5 -43,-0.1 2,-0.4 -0.899 63.3-147.9-132.2 158.2 13.6 8.5 31.8 90 99 A V E -DE 45 80B 0 -45,-2.3 -45,-2.8 -2,-0.3 2,-0.6 -0.999 12.3-154.0-125.8 126.0 14.2 5.2 30.1 91 100 A Y E -DE 44 79B 5 -12,-3.6 -12,-3.0 -2,-0.4 2,-0.6 -0.927 5.8-161.0-107.4 117.0 17.5 4.6 28.2 92 101 A I E -DE 43 78B 1 -49,-2.8 -49,-2.9 -2,-0.6 2,-0.5 -0.898 6.6-153.4 -99.1 117.4 17.2 2.0 25.4 93 102 A V E +DE 42 77B 0 -16,-3.8 -17,-2.7 -2,-0.6 -16,-1.3 -0.843 28.4 159.3 -93.7 121.9 20.7 0.7 24.3 94 103 A Q E -D 41 0B 15 -53,-3.1 -53,-2.1 -2,-0.5 -19,-0.1 -0.707 45.7 -56.1-133.7 179.6 20.7 -0.5 20.7 95 104 A D - 0 0 49 -21,-0.4 2,-0.5 -2,-0.2 -55,-0.1 -0.369 51.2-129.4 -57.7 134.0 22.9 -1.2 17.7 96 105 A L - 0 0 49 -57,-0.4 2,-0.4 -2,-0.1 -1,-0.1 -0.806 29.4-172.8 -89.1 127.9 25.1 1.8 16.7 97 106 A M - 0 0 26 -2,-0.5 50,-0.2 1,-0.1 55,-0.0 -0.995 25.1-141.1-130.1 135.0 24.7 2.4 12.9 98 107 A E S S- 0 0 116 -2,-0.4 2,-0.2 47,-0.1 49,-0.2 0.824 77.0 -11.9 -64.1 -38.5 26.7 4.9 10.9 99 108 A T E -G 146 0C 29 47,-2.7 47,-3.1 4,-0.0 2,-0.3 -0.788 58.4-129.1-148.0-169.5 23.9 6.0 8.6 100 109 A D E > -G 145 0C 30 45,-0.3 4,-2.3 -2,-0.2 45,-0.2 -0.918 35.4-104.5-143.4 163.1 20.3 5.4 7.4 101 110 A L H > S+ 0 0 0 43,-2.4 4,-2.6 40,-1.0 41,-0.2 0.769 118.1 58.2 -66.2 -27.3 18.8 5.1 4.0 102 111 A Y H > S+ 0 0 108 39,-0.8 4,-1.3 42,-0.3 -1,-0.2 0.979 110.1 43.9 -64.3 -51.1 17.2 8.6 4.2 103 112 A K H >> S+ 0 0 117 1,-0.2 4,-0.7 2,-0.2 3,-0.6 0.926 115.5 48.9 -57.1 -48.1 20.7 10.2 4.7 104 113 A L H >X S+ 0 0 14 -4,-2.3 4,-2.9 1,-0.2 3,-1.1 0.888 108.1 52.9 -58.7 -48.9 22.2 8.0 1.9 105 114 A L H 3< S+ 0 0 7 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.741 99.5 64.2 -64.3 -24.3 19.4 8.9 -0.6 106 115 A K H << S+ 0 0 127 -4,-1.3 -1,-0.2 -3,-0.6 -2,-0.2 0.800 126.8 5.9 -68.2 -28.2 19.9 12.7 -0.1 107 116 A T H << S+ 0 0 109 -3,-1.1 2,-0.5 -4,-0.7 -2,-0.2 0.546 112.1 82.0-131.9 -11.0 23.6 12.6 -1.5 108 117 A Q < - 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0 0 69 1,-0.0 3,-2.2 3,-0.0 -1,-0.0 -0.671 28.0-169.0-156.4 89.6 17.7 -18.7 0.3 308 317 A P G > S+ 0 0 65 0, 0.0 3,-1.3 0, 0.0 -2,-0.0 0.777 89.3 60.6 -62.6 -22.1 14.5 -19.4 2.4 309 318 A S G 3 S+ 0 0 107 1,-0.3 0, 0.0 3,-0.1 0, 0.0 0.756 107.7 45.9 -71.2 -22.1 16.6 -21.6 4.7 310 319 A D G < S+ 0 0 85 -3,-2.2 -1,-0.3 1,-0.1 -3,-0.0 0.002 96.2 81.6-109.3 27.3 18.7 -18.5 5.5 311 320 A E S < S- 0 0 4 -3,-1.3 -1,-0.1 -184,-0.0 -186,-0.0 -0.829 77.2-154.3-128.3 79.1 15.5 -16.3 6.0 312 321 A P - 0 0 60 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.178 5.2-150.4 -63.7 154.1 14.5 -17.1 9.6 313 322 A I - 0 0 96 -182,-0.1 -185,-0.2 -183,-0.1 -184,-0.1 -0.847 33.9 -83.0-116.4 160.8 11.0 -16.7 10.9 314 323 A A - 0 0 12 -186,-0.6 -247,-0.1 -2,-0.3 -1,-0.0 -0.341 29.9-131.3 -64.9 141.5 9.8 -16.0 14.4 315 324 A E S S+ 0 0 207 1,-0.2 -1,-0.1 -183,-0.0 -183,-0.0 0.713 90.6 8.2 -65.2 -25.6 9.7 -19.0 16.9 316 325 A A S S- 0 0 52 0, 0.0 -1,-0.2 0, 0.0 -185,-0.0 -0.970 85.2-100.7-153.7 145.8 6.1 -17.9 17.9 317 326 A P 0 0 87 0, 0.0 -184,-0.2 0, 0.0 -185,-0.1 -0.212 360.0 360.0 -61.7 155.1 3.5 -15.3 16.8 318 327 A F 0 0 59 -186,-3.8 -255,-0.0 -4,-0.0 -4,-0.0 -0.166 360.0 360.0-100.2 360.0 3.3 -12.1 18.9 319 ! 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 0.0 320 332 A E 0 0 128 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 135.0 -4.8 -4.3 24.9 321 333 A L + 0 0 36 1,-0.0 3,-0.4 3,-0.0 -266,-0.1 0.396 360.0 81.8-113.4 -1.4 -2.9 -0.9 25.1 322 334 A D S S+ 0 0 79 1,-0.3 2,-1.2 -267,-0.0 -267,-0.1 0.984 97.9 38.4 -67.1 -59.1 -5.6 1.4 23.5 323 335 A D S S+ 0 0 97 2,-0.0 -1,-0.3 0, 0.0 0, 0.0 -0.704 94.4 109.5 -96.1 79.0 -7.7 1.8 26.7 324 336 A L - 0 0 19 -2,-1.2 -269,-0.1 -3,-0.4 2,-0.0 -0.928 63.3-122.5-154.1 125.7 -4.9 2.0 29.3 325 337 A P > - 0 0 59 0, 0.0 4,-2.3 0, 0.0 3,-0.2 -0.334 24.5-114.0 -74.6 159.0 -3.7 5.1 31.4 326 338 A K H > S+ 0 0 10 1,-0.2 4,-1.2 2,-0.2 -276,-0.1 0.650 116.5 57.9 -60.0 -20.6 -0.1 6.5 31.4 327 339 A E H > S+ 0 0 147 2,-0.2 4,-1.4 3,-0.1 -1,-0.2 0.933 109.4 40.8 -75.9 -51.2 0.2 5.5 35.1 328 340 A K H > S+ 0 0 110 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.876 115.4 53.0 -63.3 -39.2 -0.5 1.7 34.4 329 341 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 -1,-0.2 0.838 103.0 57.7 -66.4 -34.6 1.7 2.0 31.3 330 342 A K H X S+ 0 0 47 -4,-1.2 4,-2.6 2,-0.2 -1,-0.2 0.912 108.3 46.7 -59.7 -45.1 4.6 3.5 33.4 331 343 A E H X S+ 0 0 104 -4,-1.4 4,-2.8 2,-0.2 -2,-0.2 0.892 112.0 50.7 -63.2 -42.9 4.4 0.3 35.6 332 344 A L H X S+ 0 0 51 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.925 111.1 47.4 -65.1 -42.7 4.3 -1.9 32.4 333 345 A I H X S+ 0 0 0 -4,-3.0 4,-1.6 2,-0.2 -2,-0.2 0.946 113.7 50.0 -61.4 -43.0 7.4 -0.1 31.0 334 346 A F H < S+ 0 0 35 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.896 114.7 43.2 -60.5 -45.7 9.1 -0.5 34.6 335 347 A E H >< S+ 0 0 112 -4,-2.8 3,-1.2 1,-0.2 4,-0.3 0.874 112.0 51.9 -69.8 -41.9 8.2 -4.3 34.6 336 348 A E H 3< S+ 0 0 49 -4,-2.9 3,-0.3 1,-0.2 -1,-0.2 0.761 111.8 48.1 -66.8 -26.8 9.3 -5.0 30.9 337 349 A T T >< S+ 0 0 0 -4,-1.6 3,-1.3 -5,-0.2 4,-0.3 0.375 84.3 97.3 -93.5 3.1 12.6 -3.3 31.6 338 350 A A G X + 0 0 43 -3,-1.2 3,-1.9 1,-0.2 -1,-0.2 0.863 69.4 68.2 -58.8 -41.6 13.3 -5.3 34.9 339 351 A R G 3 S+ 0 0 168 -4,-0.3 -1,-0.2 -3,-0.3 -2,-0.1 0.579 97.2 54.3 -57.0 -16.0 15.5 -8.0 33.2 340 352 A F G < S+ 0 0 45 -3,-1.3 -1,-0.3 -262,-0.1 -2,-0.2 0.559 80.9 110.2 -98.4 -8.9 18.3 -5.5 32.5 341 353 A Q S < S- 0 0 46 -3,-1.9 -262,-0.1 -4,-0.3 -260,-0.0 -0.367 76.7-122.3 -69.6 143.1 18.8 -4.2 36.1 342 354 A P 0 0 131 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.655 360.0 360.0 -60.2 -15.3 22.0 -5.1 38.0 343 355 A G 0 0 114 -5,-0.1 -2,-0.1 -261,-0.0 0, 0.0 -0.432 360.0 360.0 -62.2 360.0 19.9 -6.7 40.7