==== 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 11-FEB-03 1NY3 . COMPND 2 MOLECULE: MAP KINASE-ACTIVATED PROTEIN KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.W.UNDERWOOD,K.D.PARRIS,E.FEDERICO,L.MOSYAK,T.SHANE,M.TAYLO . 277 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15409.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 189 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 15.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 22 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 75 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 0 3 1 0 0 1 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 2 1 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 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 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 46 A F 0 0 223 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 81.2 214.3 108.4 178.7 2 47 A H + 0 0 190 2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.662 360.0 156.0 -80.7 119.8 217.0 105.9 179.7 3 48 A V - 0 0 99 -2,-0.6 2,-0.2 0, 0.0 0, 0.0 -0.992 26.0-155.3-144.6 136.5 216.6 102.6 177.8 4 49 A K - 0 0 150 -2,-0.3 2,-0.1 1,-0.1 64,-0.0 -0.590 37.2 -85.3-102.3 174.3 219.0 99.8 176.9 5 50 A S - 0 0 99 -2,-0.2 2,-0.1 1,-0.1 -1,-0.1 -0.427 38.8-117.0 -79.2 153.5 218.8 97.4 174.0 6 51 A G - 0 0 65 1,-0.1 2,-0.1 -2,-0.1 -1,-0.1 -0.452 41.6 -88.7 -82.8 160.6 216.8 94.2 174.1 7 52 A L - 0 0 42 -2,-0.1 2,-0.4 70,-0.0 -1,-0.1 -0.430 41.1-162.1 -70.5 143.7 218.5 90.9 173.7 8 53 A Q - 0 0 134 -2,-0.1 2,-1.2 -3,-0.1 70,-0.6 -0.966 14.0-143.1-132.8 121.2 219.0 89.5 170.1 9 54 A I E -a 78 0A 31 -2,-0.4 70,-0.2 68,-0.1 71,-0.1 -0.661 24.3-144.2 -85.4 97.3 219.7 86.0 169.2 10 55 A K E -a 79 0A 58 68,-2.2 70,-2.9 -2,-1.2 4,-0.1 -0.308 13.6-166.8 -61.3 138.3 222.1 86.2 166.3 11 56 A K + 0 0 125 68,-0.2 71,-0.2 2,-0.1 -1,-0.1 0.680 53.7 98.0-101.7 -20.5 221.6 83.5 163.6 12 57 A N S S- 0 0 69 1,-0.2 68,-0.1 69,-0.1 5,-0.1 -0.358 93.5 -80.0 -69.3 151.3 224.8 83.8 161.5 13 58 A A >> - 0 0 36 1,-0.2 3,-2.3 2,-0.1 4,-0.7 -0.274 34.2-137.0 -54.4 121.1 227.7 81.4 162.2 14 59 A I H 3> S+ 0 0 8 1,-0.3 4,-2.8 2,-0.2 3,-0.3 0.735 99.0 73.9 -50.1 -22.1 229.6 82.8 165.2 15 60 A I H 34 S+ 0 0 102 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.814 89.2 57.3 -65.7 -30.7 232.7 81.9 163.3 16 61 A D H <4 S+ 0 0 85 -3,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.869 118.4 29.8 -69.5 -37.8 232.3 84.9 161.0 17 62 A D H < S+ 0 0 62 -4,-0.7 22,-0.8 -3,-0.3 23,-0.4 0.726 127.9 36.7 -91.8 -26.0 232.2 87.4 163.8 18 63 A Y E < -B 38 0A 5 -4,-2.8 2,-0.5 -5,-0.2 20,-0.2 -0.740 68.3-132.5-123.7 170.1 234.5 85.5 166.1 19 64 A K E -B 37 0A 114 18,-3.0 18,-3.0 -2,-0.2 2,-0.4 -0.963 24.6-154.1-131.2 107.1 237.5 83.3 166.1 20 65 A V E -B 36 0A 45 -2,-0.5 2,-0.2 16,-0.2 16,-0.2 -0.708 12.6-167.1 -86.1 133.4 237.1 80.3 168.2 21 66 A T E - 0 0 25 14,-1.5 14,-0.1 -2,-0.4 -1,-0.0 -0.666 32.0-118.8-116.2 173.3 240.2 78.6 169.7 22 67 A S E S+ 0 0 116 -2,-0.2 14,-0.1 12,-0.1 -1,-0.1 0.600 74.2 117.3 -84.9 -13.8 241.1 75.3 171.4 23 68 A Q E - 0 0 119 12,-0.2 12,-1.6 1,-0.1 2,-0.7 -0.268 60.0-140.0 -57.6 140.0 242.2 77.0 174.6 24 69 A V E -B 34 0A 76 10,-0.2 10,-0.2 1,-0.1 3,-0.1 -0.892 17.9-172.5-110.2 107.4 240.1 76.0 177.6 25 70 A L E S- 0 0 60 8,-2.0 2,-0.3 -2,-0.7 9,-0.2 0.752 71.7 -53.8 -65.9 -22.2 239.3 78.8 180.0 26 71 A G E -B 33 0A 29 7,-0.7 7,-2.9 -3,-0.1 2,-0.3 -0.912 53.5-100.9 163.1 171.1 237.8 76.1 182.2 27 72 A L E +B 32 0A 144 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.783 41.1 127.6-118.9 163.8 235.4 73.2 182.5 28 73 A G E > -B 31 0A 48 3,-0.7 3,-2.2 -2,-0.3 -2,-0.0 -0.989 63.9 -36.3 176.8-171.7 232.0 72.6 184.0 29 74 A I T 3 S+ 0 0 146 1,-0.3 3,-0.1 -2,-0.3 -1,-0.1 0.830 131.7 37.7 -36.7 -56.9 228.4 71.4 183.8 30 75 A N T 3 S- 0 0 85 1,-0.3 2,-0.4 -3,-0.0 -1,-0.3 0.539 119.8-111.7 -80.1 -5.2 227.8 72.4 180.1 31 76 A G E < +B 28 0A 28 -3,-2.2 -3,-0.7 2,-0.0 2,-0.3 -0.886 67.2 4.8 118.7-148.0 231.4 71.4 179.2 32 77 A K E -B 27 0A 38 -2,-0.4 2,-0.9 -5,-0.2 17,-0.3 -0.603 52.9-147.2 -83.3 135.0 234.4 73.4 178.1 33 78 A V E -B 26 0A 30 -7,-2.9 -8,-2.0 -2,-0.3 -7,-0.7 -0.880 27.3-154.0-101.1 101.9 234.3 77.2 178.2 34 79 A L E -BC 24 47A 29 13,-1.0 13,-2.6 -2,-0.9 2,-0.4 -0.390 12.1-120.9 -78.8 153.2 236.5 78.1 175.2 35 80 A Q E - C 0 46A 20 -12,-1.6 -14,-1.5 11,-0.2 2,-0.3 -0.768 36.9-177.1 -91.2 134.2 238.5 81.3 174.8 36 81 A I E -BC 20 45A 0 9,-3.6 9,-2.9 -2,-0.4 2,-0.4 -0.877 17.9-136.4-131.0 165.5 237.6 83.2 171.6 37 82 A F E -BC 19 44A 63 -18,-3.0 -18,-3.0 -2,-0.3 2,-0.8 -0.961 15.8-129.0-125.6 139.2 238.8 86.3 169.8 38 83 A N E >> -B 18 0A 24 5,-2.1 4,-4.5 -2,-0.4 3,-1.2 -0.785 19.1-150.6 -88.1 111.9 236.7 89.0 168.1 39 84 A K T 34 S+ 0 0 105 -22,-0.8 -1,-0.2 -2,-0.8 -21,-0.1 0.919 90.7 44.3 -43.0 -66.8 238.1 89.4 164.6 40 85 A R T 34 S+ 0 0 218 -23,-0.4 -1,-0.2 1,-0.2 -22,-0.1 0.573 132.6 21.4 -61.6 -12.7 237.4 93.1 164.0 41 86 A T T <4 S- 0 0 59 -3,-1.2 -1,-0.2 2,-0.1 -2,-0.2 0.521 90.8-140.6-128.4 -19.6 238.6 94.1 167.5 42 87 A Q < + 0 0 127 -4,-4.5 2,-0.3 1,-0.2 -3,-0.2 0.740 47.9 146.1 63.4 27.3 240.8 91.3 168.4 43 88 A E - 0 0 115 -5,-0.4 -5,-2.1 1,-0.1 -1,-0.2 -0.678 50.1-110.5 -94.8 152.2 239.8 91.1 172.1 44 89 A K E +C 37 0A 29 -2,-0.3 51,-0.6 -7,-0.2 2,-0.3 -0.510 39.5 175.4 -81.0 146.0 239.5 87.9 174.0 45 90 A F E -CD 36 94A 34 -9,-2.9 -9,-3.6 -2,-0.2 2,-0.3 -0.990 29.8-115.7-148.7 156.3 236.2 86.5 175.1 46 91 A A E -CD 35 93A 10 47,-2.7 47,-3.1 -2,-0.3 2,-0.5 -0.734 26.2-153.7 -93.1 140.3 234.7 83.4 176.9 47 92 A L E -CD 34 92A 1 -13,-2.6 -13,-1.0 -2,-0.3 2,-0.4 -0.974 9.3-172.0-121.6 124.1 232.4 81.2 174.9 48 93 A K E - D 0 91A 40 43,-2.4 43,-3.0 -2,-0.5 2,-0.6 -0.926 9.5-152.8-113.9 132.9 229.7 79.0 176.5 49 94 A M E + D 0 90A 65 -2,-0.4 2,-0.3 -17,-0.3 41,-0.2 -0.918 15.8 176.4-114.4 119.6 227.6 76.4 174.6 50 95 A L E - D 0 89A 7 39,-2.8 39,-2.9 -2,-0.6 2,-0.3 -0.880 37.3-110.2-112.9 150.5 224.1 75.5 175.6 51 96 A Q E - D 0 88A 70 -2,-0.3 2,-0.5 37,-0.2 37,-0.2 -0.632 45.7-111.6 -73.2 134.2 221.7 73.1 173.9 52 97 A D + 0 0 26 35,-2.3 35,-0.1 -2,-0.3 -1,-0.1 -0.556 66.3 127.4 -71.1 121.5 218.9 75.3 172.6 53 98 A C S >> S- 0 0 54 -2,-0.5 4,-1.9 1,-0.1 3,-1.1 -0.938 72.3 -90.7-168.5 153.0 215.8 74.6 174.6 54 99 A P H 3> S+ 0 0 115 0, 0.0 4,-1.2 0, 0.0 5,-0.1 0.801 122.4 51.8 -39.3 -49.2 213.3 76.7 176.6 55 100 A K H 3> S+ 0 0 46 1,-0.2 4,-1.8 2,-0.2 3,-0.1 0.893 110.5 50.0 -60.0 -40.5 215.1 76.4 179.9 56 101 A A H <> S+ 0 0 7 -3,-1.1 4,-2.2 1,-0.2 5,-0.3 0.960 106.4 52.1 -63.1 -54.3 218.3 77.6 178.3 57 102 A R H X S+ 0 0 63 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.760 108.8 54.9 -55.6 -23.9 216.9 80.6 176.6 58 103 A R H X S+ 0 0 136 -4,-1.2 4,-2.6 -5,-0.3 -1,-0.2 0.944 107.4 47.2 -73.5 -49.5 215.5 81.6 180.0 59 104 A E H X S+ 0 0 29 -4,-1.8 4,-2.6 1,-0.2 5,-0.3 0.976 112.2 50.0 -51.2 -63.2 218.8 81.4 181.8 60 105 A V H X S+ 0 0 5 -4,-2.2 4,-3.2 1,-0.2 5,-0.2 0.855 110.3 50.4 -44.2 -48.9 220.5 83.5 179.0 61 106 A E H X S+ 0 0 86 -4,-1.6 4,-2.9 -5,-0.3 -1,-0.2 0.962 109.3 50.8 -58.7 -52.3 217.8 86.1 179.2 62 107 A L H < S+ 0 0 3 -4,-2.6 4,-0.3 1,-0.2 -2,-0.2 0.923 114.9 43.2 -51.3 -48.5 218.1 86.4 183.0 63 108 A H H >X S+ 0 0 8 -4,-2.6 3,-1.1 1,-0.2 4,-0.6 0.899 113.6 50.4 -66.9 -41.8 221.9 86.8 182.7 64 109 A W H >< S+ 0 0 51 -4,-3.2 3,-0.6 -5,-0.3 4,-0.2 0.865 109.3 52.5 -64.7 -33.1 221.6 89.2 179.8 65 110 A R T 3< S+ 0 0 109 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.563 114.3 43.9 -76.3 -8.2 219.1 91.2 181.8 66 111 A A T X4 S+ 0 0 0 -3,-1.1 3,-1.4 -4,-0.3 -1,-0.2 0.359 85.3 90.9-115.9 0.8 221.6 91.4 184.6 67 112 A S T << + 0 0 17 -4,-0.6 5,-0.2 -3,-0.6 -2,-0.1 0.671 70.0 77.3 -71.9 -13.6 224.7 92.1 182.7 68 113 A Q T 3 S+ 0 0 89 -4,-0.2 -1,-0.3 3,-0.1 -2,-0.1 0.546 76.8 95.4 -72.2 -2.4 224.1 95.8 183.2 69 114 A C S X S- 0 0 6 -3,-1.4 3,-3.1 1,-0.1 -1,-0.1 -0.826 77.5-137.5 -98.0 115.3 225.4 95.3 186.7 70 115 A P T 3 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.727 100.9 47.2 -31.7 -47.9 229.1 96.1 187.2 71 116 A H T 3 S+ 0 0 32 48,-0.1 84,-3.0 83,-0.1 2,-0.4 0.297 95.7 83.8 -89.8 11.2 229.8 93.0 189.3 72 117 A I B < S-f 155 0B 0 -3,-3.1 84,-0.2 82,-0.3 82,-0.0 -0.930 92.3-104.4-112.2 135.8 228.1 90.5 187.1 73 118 A V - 0 0 3 82,-2.2 2,-0.3 -2,-0.4 -4,-0.1 -0.374 44.3-122.5 -59.5 135.0 230.0 89.0 184.2 74 119 A R - 0 0 28 -4,-0.1 20,-2.5 -6,-0.1 2,-0.7 -0.630 7.5-138.9 -89.5 138.8 228.6 90.7 181.0 75 120 A I E - E 0 93A 7 -2,-0.3 18,-0.2 -12,-0.2 3,-0.1 -0.844 14.6-172.4 -93.4 113.4 227.1 88.9 178.0 76 121 A V E - 0 0 60 16,-1.4 2,-0.3 -2,-0.7 -1,-0.2 0.916 65.1 -33.0 -73.3 -48.5 228.4 90.6 174.9 77 122 A D E - E 0 92A 18 15,-0.9 15,-2.9 -70,-0.0 2,-0.4 -0.961 53.2-132.1-169.4 164.6 226.1 88.7 172.6 78 123 A V E -aE 9 91A 0 -70,-0.6 -68,-2.2 -2,-0.3 2,-0.3 -0.938 14.5-158.9-124.3 142.3 224.4 85.4 172.0 79 124 A Y E -aE 10 90A 0 11,-4.0 11,-2.6 -2,-0.4 2,-0.5 -0.875 14.0-156.6-120.7 149.7 224.1 83.1 169.0 80 125 A E E + E 0 89A 33 -70,-2.9 9,-0.2 -2,-0.3 2,-0.2 -0.840 37.7 159.2-122.3 87.0 221.7 80.4 167.9 81 126 A N E - E 0 88A 21 -2,-0.5 7,-2.4 7,-0.5 2,-0.7 -0.532 46.5-103.2-104.6 175.9 223.8 78.3 165.5 82 127 A L E + E 0 87A 134 5,-0.2 2,-0.6 -2,-0.2 5,-0.2 -0.886 40.0 178.9-104.0 109.6 223.4 74.8 164.2 83 128 A Y E > - E 0 86A 150 3,-3.4 3,-1.0 -2,-0.7 -2,-0.0 -0.925 68.1 -17.9-118.1 111.7 225.9 72.5 165.9 84 129 A A T 3 S- 0 0 87 -2,-0.6 -1,-0.2 1,-0.3 3,-0.1 0.940 122.1 -58.0 64.5 49.6 226.0 68.8 165.1 85 130 A G T 3 S+ 0 0 79 1,-0.2 2,-0.5 -3,-0.2 -1,-0.3 0.445 122.3 117.6 61.3 -6.9 222.6 68.8 163.6 86 131 A R E < S- E 0 83A 48 -3,-1.0 -3,-3.4 1,-0.0 2,-0.7 -0.809 72.3-127.5 -97.4 129.7 221.8 70.1 167.1 87 132 A K E - E 0 82A 115 -2,-0.5 -35,-2.3 -5,-0.2 -5,-0.2 -0.644 40.8-174.2 -75.0 112.4 220.3 73.6 167.5 88 133 A C E -DE 51 81A 15 -7,-2.4 2,-0.5 -2,-0.7 -7,-0.5 -0.659 28.3-133.3-113.0 169.6 222.6 75.3 170.0 89 134 A L E -DE 50 80A 0 -39,-2.9 -39,-2.8 -2,-0.2 2,-0.5 -0.936 20.0-164.0-123.2 106.0 222.9 78.5 172.0 90 135 A L E -DE 49 79A 15 -11,-2.6 -11,-4.0 -2,-0.5 2,-0.5 -0.807 5.4-165.0 -94.1 126.3 226.3 80.1 171.9 91 136 A I E -DE 48 78A 4 -43,-3.0 -43,-2.4 -2,-0.5 2,-0.5 -0.949 5.9-154.4-114.7 118.2 226.9 82.7 174.6 92 137 A V E -DE 47 77A 0 -15,-2.9 -16,-1.4 -2,-0.5 -15,-0.9 -0.794 18.8-175.3 -93.8 131.3 229.8 85.2 174.4 93 138 A M E -DE 46 75A 22 -47,-3.1 -47,-2.7 -2,-0.5 -18,-0.2 -0.922 35.2 -96.8-124.0 144.7 231.0 86.6 177.7 94 139 A E E -D 45 0A 43 -20,-2.5 2,-0.8 -2,-0.3 -49,-0.2 -0.392 52.7-112.6 -50.7 140.1 233.6 89.2 178.8 95 140 A C - 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0 0 80 1,-0.2 3,-0.7 -3,-0.2 4,-0.2 0.382 13.1-134.7 -17.1 129.9 213.3 82.9 198.0 184 242 A K T >> S+ 0 0 38 1,-0.2 3,-1.9 2,-0.1 4,-0.9 0.455 76.3 111.1 -73.6 -2.4 216.8 84.3 197.5 185 243 A S H >> + 0 0 17 1,-0.3 4,-1.7 2,-0.2 3,-0.5 0.827 69.4 60.7 -42.3 -43.9 217.7 83.6 201.2 186 244 A C H <> S+ 0 0 47 -3,-0.7 4,-3.0 1,-0.3 3,-0.4 0.911 97.7 60.8 -52.6 -40.5 220.1 80.9 200.1 187 245 A D H <> S+ 0 0 0 -3,-1.9 4,-1.3 1,-0.3 -1,-0.3 0.912 105.0 47.1 -51.4 -46.2 221.9 83.7 198.3 188 246 A M H X S+ 0 0 14 -4,-2.5 4,-3.0 1,-0.2 3,-0.7 0.822 108.4 57.6 -41.7 -47.1 236.1 81.7 204.8 198 256 A L H 3< S+ 0 0 5 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.969 105.7 48.5 -49.2 -64.2 237.6 85.0 203.8 199 257 A L H 3< S+ 0 0 1 -4,-1.8 73,-0.4 -3,-0.2 74,-0.3 0.631 130.7 14.3 -53.2 -23.1 238.4 86.1 207.4 200 258 A C H << S- 0 0 1 -4,-1.1 76,-0.2 -3,-0.7 -1,-0.2 0.640 97.3-111.6-128.3 -27.0 240.1 82.8 208.5 201 259 A G S < S+ 0 0 8 -4,-3.0 -4,-0.1 -5,-0.3 -3,-0.1 0.294 87.7 71.3 110.7 -11.9 240.9 80.6 205.5 202 260 A Y S S- 0 0 30 -6,-0.2 -1,-0.3 -5,-0.2 -2,-0.2 -0.956 83.2 -97.5-137.0 156.9 238.5 77.8 206.0 203 261 A P - 0 0 47 0, 0.0 -9,-0.1 0, 0.0 -10,-0.1 -0.248 28.3-122.8 -68.8 155.5 234.7 77.3 205.8 204 262 A P S S+ 0 0 12 0, 0.0 2,-0.8 0, 0.0 16,-0.3 0.988 101.2 53.2 -64.4 -57.2 232.3 77.5 208.8 205 263 A F S S- 0 0 19 14,-0.1 14,-0.1 1,-0.0 5,-0.1 -0.706 82.3-163.9 -86.7 109.9 230.8 74.0 208.4 206 264 A Y 0 0 108 -2,-0.8 7,-0.1 -4,-0.1 -1,-0.0 -0.173 360.0 360.0 -84.1 177.6 233.7 71.5 208.2 207 265 A S 0 0 133 3,-0.1 -1,-0.0 4,-0.0 -2,-0.0 -0.965 360.0 360.0-119.6 360.0 233.8 67.9 207.0 208 ! 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 0.0 209 274 A G > 0 0 89 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 46.5 228.0 64.3 209.8 210 275 A M H > + 0 0 76 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.914 360.0 62.5 -76.2 -46.6 228.5 67.7 208.1 211 276 A K H > S+ 0 0 78 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.808 110.4 47.5 -49.8 -25.1 225.0 67.8 206.5 212 277 A T H >>S+ 0 0 78 2,-0.2 4,-3.9 1,-0.2 5,-0.5 0.973 101.2 56.6 -78.6 -62.0 224.0 67.8 210.2 213 278 A R H <>S+ 0 0 73 -4,-1.8 5,-3.7 1,-0.2 -2,-0.2 0.764 113.4 49.3 -40.9 -29.0 226.3 70.4 211.7 214 279 A I H ><5S+ 0 0 57 -4,-1.9 3,-0.7 3,-0.2 -1,-0.2 0.961 111.2 42.5 -76.3 -60.4 224.6 72.6 209.0 215 280 A R H 3<5S+ 0 0 71 -4,-1.7 -2,-0.2 1,-0.3 -3,-0.2 0.907 118.8 48.0 -54.2 -41.5 221.0 71.8 209.6 216 281 A M T 3<5S- 0 0 126 -4,-3.9 -1,-0.3 -5,-0.1 -2,-0.2 0.714 108.0-138.6 -70.3 -20.0 221.8 72.1 213.3 217 282 A G T < < + 0 0 21 -3,-0.7 2,-0.6 -5,-0.5 -3,-0.2 0.920 45.3 156.3 62.0 45.1 223.5 75.3 212.4 218 283 A Q < + 0 0 112 -5,-3.7 2,-0.3 -6,-0.2 -1,-0.2 -0.892 5.4 124.8-114.0 113.3 226.5 74.6 214.6 219 284 A Y - 0 0 56 -2,-0.6 2,-0.3 -14,-0.1 -14,-0.1 -0.832 35.7-143.7-145.7-179.9 229.9 76.2 213.9 220 285 A E - 0 0 59 -16,-0.3 -2,-0.0 -2,-0.3 0, 0.0 -0.938 24.2-122.1-148.4 167.1 232.4 78.4 215.8 221 286 A F - 0 0 17 -2,-0.3 5,-0.2 5,-0.0 8,-0.1 -0.676 47.6-151.7-111.6 70.9 234.9 81.2 215.3 222 287 A P > - 0 0 40 0, 0.0 4,-1.8 0, 0.0 5,-0.2 -0.102 18.4 -95.6 -49.6 131.4 237.9 79.2 216.6 223 288 A N T 4 S+ 0 0 115 2,-0.2 2,-0.2 3,-0.2 0, 0.0 -0.594 100.5 29.6 -87.8 153.5 240.8 80.9 218.2 224 289 A P T >4 S+ 0 0 82 0, 0.0 3,-5.5 0, 0.0 4,-0.3 -0.769 121.1 54.8 -65.2 -49.6 243.4 81.9 217.5 225 290 A E T 34 S+ 0 0 48 1,-0.3 3,-0.4 -2,-0.2 -2,-0.2 0.537 120.8 31.3 -8.3 -57.7 242.0 82.6 214.0 226 291 A W T >< S+ 0 0 0 -4,-1.8 3,-1.2 1,-0.2 -1,-0.3 0.285 88.4 103.8 -97.2 9.2 239.1 84.7 215.2 227 292 A S T < S+ 0 0 84 -3,-5.5 -1,-0.2 1,-0.3 -2,-0.1 0.778 89.0 39.9 -60.8 -29.5 240.9 86.2 218.3 228 293 A E T 3 S+ 0 0 68 -3,-0.4 2,-0.4 -4,-0.3 -1,-0.3 0.334 94.3 106.7-103.1 6.9 241.3 89.5 216.5 229 294 A V S < S- 0 0 14 -3,-1.2 -3,-0.0 -8,-0.1 -8,-0.0 -0.728 72.9-113.3 -92.3 134.5 237.9 89.6 214.8 230 295 A S > - 0 0 38 -2,-0.4 4,-2.4 1,-0.1 5,-0.1 -0.210 9.7-132.2 -62.9 149.7 235.2 91.9 216.1 231 296 A E H > S+ 0 0 105 2,-0.2 4,-3.5 1,-0.2 -1,-0.1 0.743 112.4 60.5 -71.2 -22.5 232.0 90.6 217.7 232 297 A E H > S+ 0 0 109 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.954 107.6 41.1 -67.1 -51.6 230.4 93.0 215.2 233 298 A V H > S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.885 117.4 50.8 -61.8 -38.3 231.8 91.2 212.3 234 299 A K H X S+ 0 0 28 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.928 106.6 52.6 -65.6 -43.9 231.0 88.0 214.2 235 300 A M H X S+ 0 0 85 -4,-3.5 4,-1.7 1,-0.2 -1,-0.2 0.838 106.1 55.8 -60.4 -33.4 227.4 89.1 214.7 236 301 A L H X S+ 0 0 2 -4,-1.8 4,-0.7 2,-0.2 -1,-0.2 0.870 105.2 50.2 -67.9 -39.3 227.1 89.8 211.0 237 302 A I H >X S+ 0 0 0 -4,-1.5 4,-3.2 -3,-0.2 3,-0.8 0.931 107.9 55.9 -64.6 -42.4 228.1 86.2 210.0 238 303 A R H 3< S+ 0 0 74 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.885 105.5 48.7 -58.0 -44.9 225.5 84.9 212.5 239 304 A N H 3< S+ 0 0 60 -4,-1.7 10,-2.4 1,-0.2 3,-0.3 0.684 116.5 45.2 -71.0 -15.0 222.6 86.8 211.0 240 305 A L H << S+ 0 0 0 -3,-0.8 -2,-0.2 -4,-0.7 -1,-0.2 0.823 111.2 52.2 -91.1 -38.1 223.7 85.5 207.6 241 306 A L S < S+ 0 0 6 -4,-3.2 2,-0.3 -5,-0.1 -1,-0.2 -0.083 77.1 141.6 -88.4 32.2 224.3 82.0 208.9 242 307 A K - 0 0 56 -3,-0.3 6,-0.2 1,-0.2 -25,-0.1 -0.630 50.4-143.0 -75.3 132.8 220.8 81.8 210.4 243 308 A T S S+ 0 0 68 -2,-0.3 -1,-0.2 -26,-0.1 -26,-0.1 0.818 85.7 68.0 -67.2 -30.5 219.4 78.3 209.9 244 309 A E S >> S- 0 0 113 1,-0.2 4,-1.4 -3,-0.0 3,-1.3 -0.815 77.4-145.5 -96.4 121.8 215.9 79.6 209.2 245 310 A P G >4 S+ 0 0 49 0, 0.0 3,-3.1 0, 0.0 -1,-0.2 0.947 97.6 50.9 -44.4 -76.0 215.5 81.6 206.0 246 311 A T G 34 S+ 0 0 129 1,-0.3 -2,-0.0 0, 0.0 -4,-0.0 0.656 111.2 52.5 -39.4 -21.6 213.0 84.2 207.2 247 312 A Q G <4 S+ 0 0 120 -3,-1.3 -1,-0.3 2,-0.1 -4,-0.1 0.787 91.7 98.2 -86.9 -28.8 215.3 84.8 210.1 248 313 A R S << S- 0 0 29 -3,-3.1 -8,-0.2 -4,-1.4 -9,-0.1 -0.197 84.1 -94.2 -62.8 148.5 218.3 85.5 207.9 249 314 A M - 0 0 26 -10,-2.4 2,-0.2 -13,-0.2 -1,-0.1 -0.148 38.1-120.3 -60.8 152.5 219.4 89.0 207.0 250 315 A T > - 0 0 65 1,-0.1 4,-1.9 -62,-0.0 5,-0.2 -0.629 17.5-118.0 -96.5 156.3 218.3 90.7 203.8 251 316 A I H > S+ 0 0 11 1,-0.2 4,-2.4 -2,-0.2 5,-0.1 0.865 118.8 51.1 -59.9 -34.4 220.6 91.9 200.9 252 317 A T H > S+ 0 0 80 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.897 110.2 48.1 -69.8 -38.7 219.3 95.4 201.6 253 318 A E H > S+ 0 0 114 1,-0.2 4,-0.8 2,-0.2 -2,-0.2 0.775 111.6 52.3 -71.8 -23.1 220.1 95.0 205.3 254 319 A F H >< S+ 0 0 0 -4,-1.9 3,-0.8 2,-0.2 6,-0.3 0.929 103.3 54.2 -77.1 -48.3 223.5 93.7 204.4 255 320 A M H 3< S+ 0 0 14 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.702 112.5 47.5 -61.4 -15.8 224.5 96.5 202.1 256 321 A N H 3< S+ 0 0 89 -4,-0.7 -1,-0.2 -5,-0.1 -2,-0.2 0.683 79.3 112.4 -98.3 -20.1 223.7 98.9 204.9 257 322 A H S XX S- 0 0 29 -4,-0.8 4,-3.3 -3,-0.8 3,-1.0 -0.331 76.2-122.2 -54.8 132.0 225.5 97.2 207.7 258 323 A P H 3> S+ 0 0 76 0, 0.0 4,-3.1 0, 0.0 -1,-0.1 0.864 108.6 58.0 -41.6 -57.1 228.4 99.5 208.7 259 324 A W H 34 S+ 0 0 7 1,-0.2 -141,-0.1 2,-0.2 -2,-0.1 0.888 119.1 34.0 -45.3 -43.8 231.2 97.0 208.1 260 325 A I H X4 S+ 0 0 0 -3,-1.0 3,-0.8 -6,-0.3 -1,-0.2 0.921 118.9 49.0 -80.1 -47.8 230.0 96.8 204.5 261 326 A M H 3< S+ 0 0 83 -4,-3.3 -2,-0.2 1,-0.3 -1,-0.1 0.720 120.5 36.2 -68.5 -21.0 228.8 100.3 204.0 262 327 A Q T >< + 0 0 107 -4,-3.1 3,-0.7 -5,-0.3 -1,-0.3 -0.399 63.9 149.1-130.0 58.5 232.0 101.9 205.3 263 328 A S G X S+ 0 0 7 -3,-0.8 3,-2.1 1,-0.2 -1,-0.1 0.950 70.6 65.2 -54.0 -53.4 234.9 99.6 204.2 264 329 A T G 3 S+ 0 0 94 1,-0.3 2,-0.3 -3,-0.1 -1,-0.2 0.837 102.5 50.2 -36.6 -45.3 237.3 102.6 203.9 265 330 A K G < S+ 0 0 77 -3,-0.7 -1,-0.3 -6,-0.0 -2,-0.1 -0.142 89.0 112.0 -91.8 39.6 236.9 103.0 207.7 266 331 A V S < S- 0 0 5 -3,-2.1 -155,-0.2 -2,-0.3 -152,-0.0 -0.964 76.9 -92.8-121.4 129.9 237.6 99.3 208.5 267 332 A P - 0 0 73 0, 0.0 -156,-1.2 0, 0.0 -157,-0.1 0.096 19.9-140.3 -34.2 128.7 240.7 98.0 210.4 268 333 A Q + 0 0 109 -158,-0.2 -2,-0.0 -159,-0.1 0, 0.0 0.064 47.4 158.1 -84.2 26.0 243.6 96.9 208.2 269 334 A T - 0 0 30 -160,-0.1 -159,-2.2 1,-0.1 -158,-0.1 -0.307 44.2-116.5 -54.6 121.7 244.0 94.1 210.7 270 335 A P - 0 0 101 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.164 25.5-148.9 -59.7 154.7 245.9 91.2 209.0 271 336 A L - 0 0 30 1,-0.0 3,-0.3 -162,-0.0 -71,-0.1 -0.976 17.8-135.2-127.5 143.1 244.2 87.9 208.5 272 337 A H S >> S+ 0 0 75 -2,-0.4 4,-1.6 -73,-0.4 3,-0.6 0.534 70.9 119.1 -71.2 -7.5 245.8 84.4 208.5 273 338 A T H 3> + 0 0 14 -74,-0.3 4,-4.3 1,-0.2 5,-0.4 0.756 66.6 45.5 -24.4 -82.8 243.7 83.6 205.4 274 339 A S H 3> S+ 0 0 46 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.854 115.8 49.3 -35.7 -55.8 246.3 82.9 202.6 275 340 A R H X> S+ 0 0 135 -3,-0.6 3,-1.2 2,-0.2 4,-1.1 0.974 119.6 34.3 -49.8 -69.9 248.3 80.7 205.0 276 341 A V H >X S+ 0 0 39 -4,-1.6 3,-2.2 1,-0.3 4,-1.1 0.945 114.8 60.5 -50.4 -50.9 245.5 78.6 206.2 277 342 A L H 3< S+ 0 0 26 -4,-4.3 -1,-0.3 1,-0.3 -2,-0.2 0.795 109.9 42.4 -48.9 -32.6 243.9 78.8 202.8 278 343 A K H << S+ 0 0 161 -4,-2.1 -1,-0.3 -3,-1.2 -2,-0.2 0.638 101.5 72.3 -86.8 -15.5 247.0 77.2 201.4 279 344 A E H << 0 0 152 -3,-2.2 -2,-0.2 -4,-1.1 -1,-0.1 0.825 360.0 360.0 -77.9 -34.0 247.3 74.5 204.2 280 345 A D < 0 0 166 -4,-1.1 0, 0.0 -3,-0.1 0, 0.0 -0.551 360.0 360.0-134.9 360.0 244.3 72.3 203.3