==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-SEP-08 3EQB . COMPND 2 MOLECULE: DUAL SPECIFICITY MITOGEN-ACTIVATED PROTEIN . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.F.OHREN,A.PAVLOVSKY,E.ZHANG . 289 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14980.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 193 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 13.5 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 0.7 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 . 25 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 31.8 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+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 2 2 2 0 0 0 0 0 1 0 0 0 0 0 1 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 0 1 0 1 0 3 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 . 0 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 61 A M 0 0 155 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 135.5 37.1 -24.3 23.8 2 62 A E - 0 0 136 1,-0.1 2,-0.4 69,-0.0 69,-0.1 -0.475 360.0-127.0 -75.2 144.2 35.2 -21.2 22.6 3 63 A L - 0 0 19 -2,-0.2 2,-0.3 69,-0.2 69,-0.1 -0.755 29.0-177.9 -92.4 140.2 37.1 -18.0 22.0 4 64 A K - 0 0 93 -2,-0.4 3,-0.4 69,-0.1 4,-0.1 -0.910 36.1-116.0-133.8 158.2 35.9 -14.8 23.7 5 65 A D S > S+ 0 0 76 -2,-0.3 3,-1.0 1,-0.2 -1,-0.1 0.863 111.2 50.7 -64.8 -36.8 37.2 -11.2 23.5 6 66 A D T 3 S+ 0 0 91 1,-0.2 -1,-0.2 3,-0.0 -3,-0.0 0.698 94.3 71.4 -81.6 -19.3 38.2 -10.9 27.1 7 67 A D T 3 S+ 0 0 28 -3,-0.4 21,-2.0 21,-0.1 -1,-0.2 0.382 91.6 77.6 -73.9 4.2 40.3 -14.1 27.2 8 68 A F E < -A 27 0A 14 -3,-1.0 2,-0.3 19,-0.2 19,-0.2 -0.640 55.5-168.4-113.6 168.8 43.0 -12.4 25.0 9 69 A E E -A 26 0A 121 17,-0.9 17,-1.8 -2,-0.2 2,-0.1 -0.915 29.1-112.3-157.6 129.6 45.8 -9.9 25.6 10 70 A K E +A 25 0A 148 -2,-0.3 15,-0.2 15,-0.2 3,-0.1 -0.394 30.8 172.4 -68.1 133.8 47.8 -8.0 23.0 11 71 A I E - 0 0 85 13,-2.4 2,-0.2 1,-0.4 14,-0.2 0.824 63.0 -46.2 -98.2 -59.5 51.5 -8.9 22.7 12 72 A S E -A 24 0A 59 12,-1.5 12,-1.3 0, 0.0 2,-0.5 -0.826 59.8 -83.7-154.8-164.6 52.4 -6.9 19.6 13 73 A E E -A 23 0A 125 10,-0.2 10,-0.2 -2,-0.2 3,-0.1 -0.963 21.9-171.3-119.9 127.2 51.4 -6.0 16.1 14 74 A L E - 0 0 60 8,-2.5 2,-0.2 -2,-0.5 9,-0.2 0.482 59.6 -76.3 -96.1 -3.1 52.2 -8.2 13.1 15 75 A G E -A 22 0A 36 7,-0.8 7,-2.4 0, 0.0 -1,-0.4 -0.682 45.0-146.7 131.9 170.8 51.0 -5.8 10.4 16 76 A A E +A 21 0A 62 5,-0.2 5,-0.3 -2,-0.2 21,-0.0 -0.906 14.6 170.7-152.4-178.3 47.8 -4.5 8.8 17 77 A G - 0 0 54 3,-3.3 4,-0.1 -2,-0.3 -1,-0.0 0.312 59.9 -15.4 157.9 88.4 46.2 -3.2 5.6 18 78 A N S S- 0 0 157 2,-0.3 3,-0.1 1,-0.1 -2,-0.0 0.837 125.8 -7.8 98.0 37.1 42.7 -2.4 4.4 19 79 A G S S+ 0 0 47 1,-0.5 21,-1.6 19,-0.1 -1,-0.1 -0.053 124.1 93.6 172.8 -63.2 40.1 -3.8 6.8 20 80 A G E + B 0 39A 13 19,-0.2 -3,-3.3 0, 0.0 -1,-0.5 -0.351 45.3 155.3 141.9 77.7 42.1 -5.2 8.2 21 81 A V E -AB 16 38A 43 17,-1.0 17,-2.9 -5,-0.3 2,-0.4 -0.965 19.3-149.1-168.7 142.6 44.7 -5.6 10.9 22 82 A V E -AB 15 37A 24 -7,-2.4 -8,-2.5 -2,-0.3 -7,-0.8 -0.951 6.6-167.9-135.0 125.9 46.5 -8.3 12.8 23 83 A F E -AB 13 36A 29 13,-2.7 13,-3.1 -2,-0.4 2,-0.6 -0.852 26.0-127.6-112.3 145.9 48.0 -8.8 16.3 24 84 A K E +AB 12 35A 65 -12,-1.3 -13,-2.4 -2,-0.3 -12,-1.5 -0.820 50.0 179.9 -79.6 120.4 50.2 -11.4 17.9 25 85 A V E -AB 10 34A 1 9,-3.2 9,-2.1 -2,-0.6 2,-0.5 -0.779 32.8-128.7-128.6 171.8 48.2 -12.3 20.9 26 86 A S E -AB 9 33A 32 -17,-1.8 2,-1.1 -2,-0.3 -17,-0.9 -0.981 12.9-148.2-121.6 124.1 48.1 -14.4 24.0 27 87 A H E >> -A 8 0A 6 5,-2.5 4,-2.9 -2,-0.5 3,-1.2 -0.786 16.7-159.2 -90.5 97.6 45.0 -16.6 24.7 28 88 A K T 34 S+ 0 0 113 -21,-2.0 -1,-0.2 -2,-1.1 -20,-0.1 0.872 82.2 53.2 -51.5 -49.0 45.2 -16.5 28.4 29 89 A P T 34 S+ 0 0 66 0, 0.0 -1,-0.3 0, 0.0 -21,-0.1 0.820 123.4 26.5 -58.0 -31.1 43.1 -19.6 29.2 30 90 A S T <4 S- 0 0 63 -3,-1.2 -2,-0.2 2,-0.2 3,-0.1 0.724 94.4-129.7-106.9 -26.7 45.2 -21.9 27.0 31 91 A G < + 0 0 55 -4,-2.9 -3,-0.1 1,-0.3 2,-0.0 0.153 59.7 137.4 96.1 -17.8 48.6 -20.2 26.9 32 92 A L - 0 0 81 -5,-0.3 -5,-2.5 -6,-0.1 2,-0.4 -0.281 53.5-130.6 -64.9 143.8 48.9 -20.3 23.1 33 93 A V E +B 26 0A 56 -7,-0.2 52,-0.7 -3,-0.1 2,-0.3 -0.810 36.9 177.8 -87.6 135.8 50.2 -17.5 21.1 34 94 A M E -BC 25 84A 2 -9,-2.1 -9,-3.2 -2,-0.4 2,-0.5 -0.808 33.6-119.1-130.2 167.0 47.8 -16.7 18.3 35 95 A A E -BC 24 83A 7 48,-3.2 48,-3.2 -2,-0.3 2,-0.6 -0.978 30.0-160.7-106.3 124.8 47.4 -14.3 15.4 36 96 A R E -BC 23 82A 25 -13,-3.1 -13,-2.7 -2,-0.5 2,-0.5 -0.945 2.3-162.5-109.7 121.1 44.2 -12.3 15.8 37 97 A K E -BC 22 81A 36 44,-2.8 44,-2.5 -2,-0.6 2,-0.5 -0.915 4.4-157.6-104.2 127.7 42.8 -10.6 12.7 38 98 A L E -BC 21 80A 26 -17,-2.9 -17,-1.0 -2,-0.5 2,-0.6 -0.902 7.0-171.8-106.5 123.6 40.2 -7.9 13.2 39 99 A I E -BC 20 79A 18 40,-2.9 40,-2.4 -2,-0.5 2,-0.3 -0.952 17.9-140.3-116.5 115.0 37.9 -6.9 10.4 40 100 A H E + C 0 78A 86 -21,-1.6 2,-0.3 -2,-0.6 38,-0.2 -0.558 28.8 168.9 -75.9 130.1 35.7 -3.9 11.0 41 101 A L - 0 0 22 36,-1.0 2,-1.0 -2,-0.3 36,-0.1 -0.818 27.2-156.3-149.3 102.8 32.2 -4.3 9.7 42 102 A E + 0 0 174 -2,-0.3 2,-0.3 35,-0.0 -2,-0.0 -0.682 51.6 125.7 -75.0 105.6 29.2 -2.0 10.3 43 103 A I - 0 0 41 -2,-1.0 34,-0.1 5,-0.0 -2,-0.1 -0.994 60.8 -82.0-164.9 164.1 26.4 -4.4 9.8 44 104 A K >> - 0 0 165 -2,-0.3 4,-1.4 1,-0.1 3,-1.3 -0.481 35.7-120.8 -82.6 135.9 23.2 -6.0 11.2 45 105 A P T 34 S+ 0 0 74 0, 0.0 5,-0.4 0, 0.0 4,-0.3 0.879 107.5 69.3 -30.6 -65.3 23.3 -9.0 13.6 46 106 A A T >> S+ 0 0 77 1,-0.2 4,-0.9 2,-0.2 3,-0.6 0.780 112.6 29.4 -24.9 -58.8 21.3 -11.1 11.1 47 107 A I H X> S+ 0 0 43 -3,-1.3 3,-2.6 1,-0.2 2,-2.2 0.994 111.5 60.8 -72.7 -64.6 24.3 -11.2 8.8 48 108 A R H 3< S+ 0 0 59 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.206 106.4 53.1 -57.2 24.4 27.3 -11.0 11.1 49 109 A N H <> S+ 0 0 63 -2,-2.2 4,-2.1 -3,-0.6 -1,-0.3 0.471 107.0 49.8-117.6 -36.3 26.0 -14.2 12.6 50 110 A Q H S+ 0 0 35 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.895 114.5 53.6 -49.4 -39.8 30.6 -16.1 11.9 53 113 A R H < S+ 0 0 156 -4,-2.1 3,-0.5 1,-0.2 -2,-0.2 0.866 109.6 47.2 -69.5 -32.7 28.4 -19.1 11.1 54 114 A E H >< S+ 0 0 53 -4,-3.1 3,-0.8 -3,-0.4 -1,-0.2 0.697 102.8 63.3 -79.8 -21.0 30.2 -19.5 7.7 55 115 A L H >< S+ 0 0 4 -4,-1.8 3,-1.6 -5,-0.3 4,-0.2 0.645 81.4 81.7 -78.0 -15.9 33.7 -19.2 9.2 56 116 A Q G >X S+ 0 0 61 -4,-0.7 3,-2.0 -3,-0.5 4,-0.5 0.746 74.9 72.6 -61.9 -23.7 33.2 -22.4 11.3 57 117 A V G X4 S+ 0 0 65 -3,-0.8 3,-1.4 1,-0.3 4,-0.3 0.814 80.4 74.9 -63.3 -25.5 34.1 -24.4 8.3 58 118 A L G X4 S+ 0 0 18 -3,-1.6 3,-1.1 1,-0.3 11,-0.3 0.782 84.9 63.9 -53.9 -27.5 37.6 -23.2 8.9 59 119 A H G <4 S+ 0 0 70 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.860 102.4 49.9 -62.7 -33.8 37.6 -25.7 11.8 60 120 A E G << S+ 0 0 120 -3,-1.4 2,-1.3 -4,-0.5 -1,-0.2 0.423 86.0 100.3 -83.7 -2.3 37.3 -28.4 9.2 61 121 A C < + 0 0 6 -3,-1.1 2,-0.6 -4,-0.3 8,-0.2 -0.665 47.3 161.5 -89.2 88.8 40.2 -27.0 7.1 62 122 A N + 0 0 114 -2,-1.3 5,-0.1 6,-0.1 -3,-0.0 -0.921 11.3 125.9-117.1 114.9 43.1 -29.3 8.0 63 123 A S > - 0 0 20 -2,-0.6 3,-2.1 3,-0.4 53,-0.0 -0.951 63.0-121.5-165.3 138.3 46.2 -29.4 5.8 64 124 A P T 3 S+ 0 0 84 0, 0.0 80,-0.2 0, 0.0 52,-0.1 0.643 117.5 50.3 -59.9 -10.3 49.9 -28.9 6.2 65 125 A Y T 3 S+ 0 0 64 50,-0.1 81,-2.4 80,-0.1 2,-0.5 0.325 96.8 79.9-111.5 6.3 49.6 -26.2 3.6 66 126 A I B < S-e 146 0B 5 -3,-2.1 -3,-0.4 79,-0.3 81,-0.2 -0.962 86.7-111.5-117.4 126.9 46.7 -24.3 5.2 67 127 A V - 0 0 11 79,-2.0 -2,-0.1 -2,-0.5 -6,-0.1 -0.289 44.0-106.8 -54.4 131.1 47.2 -21.9 8.1 68 128 A G - 0 0 20 -4,-0.1 16,-2.0 1,-0.1 2,-0.4 -0.296 30.5-146.6 -67.6 146.2 45.6 -23.3 11.3 69 129 A F E +D 83 0A 28 -11,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.905 22.4 174.3-118.4 138.8 42.3 -21.9 12.6 70 130 A Y E - 0 0 82 12,-2.7 2,-0.2 -2,-0.4 13,-0.1 0.745 59.4 -58.0-111.0 -42.0 41.2 -21.6 16.3 71 131 A G E -D 82 0A 1 11,-1.0 11,-2.5 -69,-0.1 2,-0.4 -0.886 35.6-126.1 171.1 166.2 37.9 -19.7 16.1 72 132 A A E +D 81 0A 14 -2,-0.2 2,-0.3 9,-0.2 9,-0.2 -0.970 27.4 161.9-129.3 147.7 36.0 -16.6 15.1 73 133 A F E -D 80 0A 20 7,-1.5 7,-3.1 -2,-0.4 2,-0.4 -0.951 32.9-115.1-152.9 168.8 33.8 -14.3 17.1 74 134 A Y E +D 79 0A 65 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.927 28.9 174.5-113.9 139.3 32.2 -10.8 17.0 75 135 A S - 0 0 31 3,-2.8 3,-0.2 -2,-0.4 -2,-0.0 -0.845 60.6 -40.3-152.3 109.2 33.1 -8.1 19.4 76 136 A D S S- 0 0 152 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 0.892 125.2 -25.0 31.9 80.2 31.9 -4.4 19.3 77 137 A G S S+ 0 0 13 -36,-0.1 -36,-1.0 1,-0.1 2,-0.3 0.639 123.5 86.3 75.8 17.3 32.0 -3.6 15.6 78 138 A E E -C 40 0A 57 -38,-0.2 -3,-2.8 -3,-0.2 2,-0.4 -0.982 61.0-148.2-148.4 131.6 34.7 -6.1 14.7 79 139 A I E -CD 39 74A 0 -40,-2.4 -40,-2.9 -2,-0.3 2,-0.4 -0.856 24.0-150.3 -97.1 142.3 34.7 -9.8 13.7 80 140 A S E -CD 38 73A 0 -7,-3.1 -7,-1.5 -2,-0.4 2,-0.5 -0.935 12.8-167.2-118.3 131.5 37.9 -11.6 14.8 81 141 A I E -CD 37 72A 23 -44,-2.5 -44,-2.8 -2,-0.4 2,-0.5 -0.987 13.0-155.8-117.7 122.7 39.5 -14.6 13.2 82 142 A C E +CD 36 71A 0 -11,-2.5 -12,-2.7 -2,-0.5 -11,-1.0 -0.854 20.3 168.0-104.0 127.3 42.1 -16.3 15.3 83 143 A M E -CD 35 69A 20 -48,-3.2 -48,-3.2 -2,-0.5 -14,-0.2 -0.858 42.9 -73.1-134.2 163.1 44.9 -18.3 13.6 84 144 A E E -C 34 0A 35 -16,-2.0 2,-0.5 -2,-0.3 -50,-0.2 -0.290 52.5-119.9 -42.9 130.6 48.2 -20.1 14.2 85 145 A H - 0 0 44 -52,-0.7 2,-0.7 -60,-0.1 -1,-0.1 -0.742 22.9-153.8 -77.6 124.2 50.9 -17.5 14.6 86 146 A M > - 0 0 13 -2,-0.5 3,-1.8 1,-0.1 52,-0.2 -0.903 0.8-158.5-104.1 111.4 53.5 -18.1 11.8 87 147 A D T 3 S+ 0 0 59 -2,-0.7 52,-0.2 1,-0.3 -1,-0.1 0.482 86.7 58.7 -76.5 -2.0 56.7 -16.7 13.1 88 148 A G T 3 S- 0 0 7 50,-1.8 -1,-0.3 1,-0.3 51,-0.2 0.546 94.8-152.8 -95.4 -13.7 58.3 -16.3 9.7 89 149 A G < - 0 0 17 -3,-1.8 49,-2.8 49,-0.5 2,-0.3 -0.382 37.3 -26.5 71.9-152.0 55.5 -13.9 8.5 90 150 A S B >> -F 137 0B 13 47,-0.2 4,-2.2 -2,-0.1 3,-0.8 -0.683 50.9-117.7-105.2 153.8 54.5 -13.5 4.9 91 151 A L H 3> S+ 0 0 2 45,-2.1 4,-2.0 42,-1.2 43,-0.2 0.819 116.1 59.2 -59.3 -32.6 56.4 -13.9 1.8 92 152 A D H 3> S+ 0 0 45 41,-0.7 4,-1.0 44,-0.2 -1,-0.3 0.899 108.2 47.4 -61.5 -38.8 56.0 -10.2 0.9 93 153 A Q H X> S+ 0 0 88 -3,-0.8 4,-1.4 2,-0.2 3,-0.5 0.930 111.9 47.0 -63.7 -49.8 57.8 -9.5 4.2 94 154 A V H 3X S+ 0 0 3 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.836 106.5 61.3 -65.6 -28.3 60.7 -12.0 3.6 95 155 A L H 3X S+ 0 0 12 -4,-2.0 4,-1.4 -5,-0.3 -1,-0.2 0.850 99.6 54.5 -64.7 -36.7 61.0 -10.6 0.1 96 156 A K H X< S+ 0 0 155 -4,-1.0 3,-0.9 -3,-0.5 -2,-0.2 0.993 116.5 35.7 -59.7 -61.3 61.9 -7.1 1.4 97 157 A K H 3< S+ 0 0 151 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.834 120.0 51.4 -60.7 -31.8 64.7 -8.4 3.6 98 158 A A H 3< S- 0 0 25 -4,-2.4 2,-3.1 -5,-0.2 -1,-0.2 0.670 84.8-154.2 -82.3 -15.9 65.7 -11.0 1.0 99 159 A G S << S+ 0 0 42 -4,-1.4 2,-0.3 -3,-0.9 -1,-0.2 -0.371 79.2 12.7 70.0 -61.7 65.8 -8.6 -2.0 100 160 A R S S- 0 0 83 -2,-3.1 95,-0.2 -3,-0.1 94,-0.1 -0.960 74.5-130.7-137.4 153.0 65.1 -11.7 -4.1 101 161 A I - 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0 0 36 -4,-1.3 -1,-0.2 -3,-0.1 0, 0.0 -0.974 67.9 -66.1-179.8-171.8 33.7 -9.2 -15.6 176 238 A T S S+ 0 0 118 -2,-0.3 2,-1.7 1,-0.2 -4,-0.1 0.537 94.8 100.3 -77.5 -8.3 31.7 -11.8 -13.7 177 239 A H + 0 0 169 -6,-0.2 2,-0.3 2,-0.0 -1,-0.2 -0.449 61.2 90.0 -87.7 67.6 33.1 -14.5 -16.0 178 240 A Y + 0 0 67 -2,-1.7 2,-0.2 -6,-0.1 -2,-0.0 -0.871 37.4 155.6-145.6 176.9 35.9 -16.1 -13.9 179 241 A S > - 0 0 66 -2,-0.3 3,-2.9 -50,-0.0 4,-0.3 -0.849 63.7 -19.0-176.0-146.9 36.5 -18.8 -11.3 180 242 A V T >> S+ 0 0 36 1,-0.3 3,-2.3 -2,-0.2 4,-0.6 0.798 120.2 67.6 -55.3 -34.4 39.2 -21.1 -9.8 181 243 A Q H 3> S+ 0 0 36 1,-0.3 4,-1.1 2,-0.2 -1,-0.3 0.661 87.2 72.6 -56.3 -15.9 41.5 -20.7 -12.8 182 244 A S H <> S+ 0 0 2 -3,-2.9 4,-1.5 1,-0.2 -1,-0.3 0.834 87.1 60.1 -73.1 -29.0 41.8 -17.1 -11.6 183 245 A D H <> S+ 0 0 6 -3,-2.3 4,-2.1 -4,-0.3 -1,-0.2 0.806 97.5 60.5 -66.7 -29.1 43.9 -18.3 -8.6 184 246 A I H X S+ 0 0 2 -4,-0.6 4,-2.6 -3,-0.3 -1,-0.2 0.912 102.2 51.6 -66.7 -43.3 46.6 -19.7 -11.0 185 247 A W H X S+ 0 0 1 -4,-1.1 4,-2.5 1,-0.2 5,-0.2 0.949 109.4 49.9 -57.6 -47.3 47.1 -16.3 -12.6 186 248 A S H X S+ 0 0 8 -4,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.895 111.2 48.7 -60.8 -41.3 47.7 -14.8 -9.1 187 249 A M H X S+ 0 0 4 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.935 109.4 53.1 -63.6 -44.1 50.2 -17.4 -8.2 188 250 A G H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.948 112.2 44.1 -52.7 -53.3 52.0 -17.0 -11.4 189 251 A L H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.858 109.8 56.3 -64.6 -37.0 52.4 -13.2 -10.9 190 252 A S H X S+ 0 0 1 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.901 108.7 47.2 -62.4 -40.6 53.4 -13.7 -7.2 191 253 A L H X S+ 0 0 2 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.915 109.6 51.4 -69.7 -43.0 56.2 -16.0 -8.2 192 254 A V H X S+ 0 0 2 -4,-2.3 4,-1.2 -5,-0.2 6,-0.3 0.829 112.1 50.2 -62.5 -26.3 57.5 -13.6 -10.9 193 255 A E H X>S+ 0 0 7 -4,-1.6 4,-2.8 -5,-0.2 5,-0.5 0.954 113.5 42.6 -73.0 -48.3 57.4 -10.9 -8.3 194 256 A M H <5S+ 0 0 0 -4,-2.4 -93,-2.2 1,-0.2 -2,-0.2 0.857 113.6 52.8 -69.0 -33.4 59.3 -12.9 -5.7 195 257 A A H <5S+ 0 0 0 -4,-3.1 -1,-0.2 -95,-0.2 -2,-0.2 0.844 119.3 34.5 -64.1 -35.4 61.8 -14.2 -8.3 196 258 A V H <5S- 0 0 9 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.710 103.0-118.7-102.9 -24.3 62.6 -10.7 -9.5 197 259 A G T <5S+ 0 0 30 -4,-2.8 2,-0.3 1,-0.1 -3,-0.1 0.383 83.1 52.6 100.6 -6.8 62.4 -8.4 -6.4 198 260 A R S - 0 0 99 -2,-0.1 4,-2.9 1,-0.1 5,-0.2 -0.339 35.1 -91.5 -81.4 166.6 63.5 -2.4 -19.5 206 268 A A H > S+ 0 0 73 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.843 126.8 54.1 -44.5 -38.3 66.9 -3.6 -20.7 207 269 A K H > S+ 0 0 155 2,-0.2 4,-2.0 1,-0.2 3,-0.2 0.964 111.2 39.2 -65.7 -57.5 68.5 -1.1 -18.4 208 270 A E H > S+ 0 0 64 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.879 112.2 61.6 -58.8 -39.5 66.9 -2.1 -15.1 209 271 A L H X S+ 0 0 62 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.899 109.7 38.5 -52.9 -47.7 67.3 -5.8 -16.2 210 272 A E H < S+ 0 0 159 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.808 112.6 58.5 -77.7 -30.0 71.1 -5.5 -16.3 211 273 A L H < S+ 0 0 129 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.868 112.0 39.8 -65.7 -39.6 71.1 -3.2 -13.2 212 274 A M H < 0 0 65 -4,-2.5 -2,-0.2 -5,-0.1 -1,-0.2 0.872 360.0 360.0 -76.1 -38.9 69.4 -6.0 -11.1 213 275 A F < 0 0 97 -4,-1.9 -2,-0.2 -5,-0.3 -3,-0.2 0.479 360.0 360.0-113.7 360.0 71.4 -8.8 -12.7 214 ! 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 0.0 215 306 A P 0 0 176 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 155.8 57.6 5.6 -10.1 216 307 A P - 0 0 117 0, 0.0 2,-0.3 0, 0.0 -52,-0.0 -0.441 360.0-131.1 -77.9 158.2 54.0 4.6 -9.4 217 308 A M - 0 0 47 -53,-0.2 2,-0.1 -2,-0.1 3,-0.0 -0.760 25.9-105.1 -99.3 156.2 51.5 3.8 -12.2 218 309 A A > - 0 0 54 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.415 33.3-109.5 -76.1 160.2 48.0 5.2 -12.5 219 310 A I H > S+ 0 0 112 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.914 117.6 35.7 -61.3 -46.1 45.1 2.9 -11.6 220 311 A F H > S+ 0 0 154 2,-0.2 4,-3.0 1,-0.2 5,-0.4 0.927 112.2 59.8 -73.4 -45.3 43.8 2.6 -15.2 221 312 A E H > S+ 0 0 101 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.918 111.2 44.0 -40.2 -49.7 47.3 2.6 -16.7 222 313 A L H X S+ 0 0 8 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.969 116.3 41.7 -66.0 -55.6 48.0 -0.5 -14.6 223 314 A L H X S+ 0 0 50 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.772 113.5 55.5 -68.6 -25.4 44.8 -2.5 -15.1 224 315 A D H X S+ 0 0 53 -4,-3.0 4,-1.6 2,-0.2 5,-0.3 0.895 107.5 48.9 -73.7 -39.3 44.8 -1.6 -18.8 225 316 A Y H >X S+ 0 0 51 -4,-1.7 4,-2.9 -5,-0.4 3,-0.5 0.969 109.0 53.1 -60.1 -53.2 48.3 -3.0 -19.1 226 317 A I H 3< S+ 0 0 5 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.900 118.3 34.4 -48.9 -49.1 47.3 -6.2 -17.4 227 318 A V H 3< S+ 0 0 23 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.649 129.2 31.0 -90.0 -13.2 44.4 -6.9 -19.6 228 319 A N H << S+ 0 0 105 -4,-1.6 -2,-0.2 -3,-0.5 -3,-0.2 0.539 107.5 64.1-122.3 -10.9 45.6 -5.6 -22.9 229 320 A E S < S- 0 0 84 -4,-2.9 0, 0.0 -5,-0.3 0, 0.0 -0.638 95.4 -79.8-109.6 169.6 49.4 -6.0 -23.0 230 321 A P - 0 0 89 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.395 54.3-104.4 -69.1 151.9 51.4 -9.3 -23.0 231 322 A P - 0 0 46 0, 0.0 20,-0.0 0, 0.0 -5,-0.0 -0.243 43.3 -89.4 -68.8 159.6 51.9 -10.9 -19.5 232 323 A P - 0 0 12 0, 0.0 2,-0.3 0, 0.0 19,-0.1 -0.318 41.6-155.7 -70.9 159.8 55.1 -10.7 -17.7 233 324 A K - 0 0 155 -33,-0.1 11,-0.1 -3,-0.1 3,-0.0 -0.916 25.7-102.4-129.6 152.7 57.8 -13.3 -18.2 234 325 A L - 0 0 7 -2,-0.3 2,-0.1 10,-0.2 5,-0.1 -0.573 51.8-103.8 -67.7 137.5 60.7 -14.5 -16.1 235 326 A P - 0 0 25 0, 0.0 3,-0.3 0, 0.0 4,-0.2 -0.462 43.1-116.9 -65.5 141.0 63.8 -12.9 -17.6 236 327 A S S S+ 0 0 97 1,-0.2 2,-0.8 2,-0.1 4,-0.1 -0.270 85.4 31.0 -77.5 166.1 65.7 -15.5 -19.6 237 328 A G S S+ 0 0 73 2,-0.4 -1,-0.2 1,-0.1 4,-0.1 -0.254 110.2 62.2 89.6 -46.9 69.2 -16.8 -18.9 238 329 A V S S+ 0 0 73 -2,-0.8 2,-0.3 -3,-0.3 -2,-0.1 0.316 98.7 57.2-100.9 8.9 69.1 -16.5 -15.1 239 330 A F S S- 0 0 15 -4,-0.2 -2,-0.4 -5,-0.1 5,-0.1 -0.999 94.3 -96.4-138.0 142.6 66.3 -18.9 -14.4 240 331 A S > - 0 0 28 -2,-0.3 4,-2.0 1,-0.2 3,-0.3 -0.133 32.2-121.1 -53.2 150.0 65.9 -22.6 -15.4 241 332 A L H > S+ 0 0 140 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.772 113.6 59.6 -65.0 -23.5 63.9 -23.1 -18.6 242 333 A E H > S+ 0 0 80 2,-0.2 4,-1.6 1,-0.2 27,-0.4 0.863 103.7 47.9 -72.3 -39.7 61.5 -25.2 -16.5 243 334 A F H > S+ 0 0 0 -3,-0.3 4,-2.1 2,-0.2 3,-0.4 0.966 110.9 53.0 -60.9 -51.6 60.7 -22.3 -14.2 244 335 A Q H X S+ 0 0 30 -4,-2.0 4,-1.8 1,-0.3 -2,-0.2 0.863 111.0 45.3 -51.7 -42.0 60.2 -20.1 -17.2 245 336 A D H X S+ 0 0 70 -4,-1.8 4,-2.1 2,-0.2 -1,-0.3 0.830 109.8 57.7 -72.8 -29.7 57.7 -22.6 -18.7 246 337 A F H X S+ 0 0 0 -4,-1.6 4,-0.9 -3,-0.4 3,-0.2 0.988 111.7 37.1 -66.7 -60.6 55.9 -23.0 -15.4 247 338 A V H >X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 3,-0.6 0.880 114.6 57.4 -57.3 -40.1 55.0 -19.4 -14.9 248 339 A N H 3< S+ 0 0 59 -4,-1.8 -1,-0.2 -5,-0.4 -2,-0.2 0.898 106.4 48.9 -59.0 -38.1 54.4 -19.0 -18.6 249 340 A K H 3< S+ 0 0 83 -4,-2.1 10,-2.2 -3,-0.2 3,-0.3 0.707 115.6 46.5 -70.4 -20.1 51.9 -21.8 -18.3 250 341 A C H << S+ 0 0 0 -4,-0.9 -2,-0.2 -3,-0.6 -1,-0.2 0.809 107.7 54.3 -87.1 -35.4 50.4 -19.9 -15.3 251 342 A L S < S+ 0 0 2 -4,-2.7 2,-0.5 -5,-0.1 -1,-0.2 -0.087 70.4 134.8 -99.4 32.0 50.3 -16.4 -16.9 252 343 A I - 0 0 42 -3,-0.3 6,-0.2 1,-0.1 -67,-0.1 -0.738 54.4-138.2 -88.8 123.6 48.3 -17.2 -20.0 253 344 A K S S+ 0 0 61 -2,-0.5 -82,-0.2 4,-0.1 -1,-0.1 0.745 83.6 77.1 -57.3 -26.8 45.6 -14.6 -20.4 254 345 A N S > S- 0 0 81 1,-0.2 4,-2.4 -84,-0.1 3,-0.3 -0.744 72.1-149.2 -94.0 119.7 42.9 -17.0 -21.4 255 346 A P T 4 S+ 0 0 40 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.855 95.8 45.1 -55.6 -41.2 41.5 -18.9 -18.4 256 347 A A T 4 S+ 0 0 93 1,-0.2 -2,-0.0 4,-0.0 4,-0.0 0.835 115.6 46.4 -76.7 -29.0 40.6 -22.1 -20.3 257 348 A E T 4 S+ 0 0 144 -3,-0.3 -1,-0.2 -5,-0.1 3,-0.1 0.813 96.6 93.5 -77.4 -30.3 44.0 -22.2 -22.2 258 349 A R S < S- 0 0 5 -4,-2.4 -8,-0.2 -6,-0.2 -9,-0.1 -0.142 89.4 -95.7 -58.3 155.1 45.9 -21.5 -18.9 259 350 A A - 0 0 3 -10,-2.2 2,-0.2 1,-0.1 -1,-0.1 -0.255 36.8-147.1 -66.8 161.6 47.1 -24.5 -16.9 260 351 A D > - 0 0 55 -3,-0.1 4,-2.3 -76,-0.1 5,-0.2 -0.655 33.1 -91.0-120.0-175.0 45.1 -25.9 -14.0 261 352 A L H > S+ 0 0 27 -2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.919 121.4 57.7 -66.7 -45.4 46.1 -27.5 -10.8 262 353 A K H 4 S+ 0 0 172 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.920 113.3 39.2 -43.5 -55.9 46.1 -31.0 -12.2 263 354 A Q H >4 S+ 0 0 108 1,-0.2 3,-1.1 2,-0.2 -1,-0.2 0.871 112.9 53.5 -71.9 -40.7 48.6 -30.1 -14.9 264 355 A L H >< S+ 0 0 2 -4,-2.3 3,-1.1 1,-0.2 -1,-0.2 0.789 100.7 64.6 -62.2 -28.0 50.8 -27.8 -12.8 265 356 A M T 3< S+ 0 0 64 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.740 109.9 35.7 -69.0 -21.1 51.1 -30.7 -10.3 266 357 A V T < S+ 0 0 100 -3,-1.1 -1,-0.2 -4,-0.5 2,-0.2 -0.017 89.2 126.6-121.7 27.3 53.0 -32.9 -12.8 267 358 A H S X> S- 0 0 19 -3,-1.1 4,-1.9 1,-0.1 3,-1.2 -0.605 72.6-108.1 -93.3 148.4 55.0 -30.2 -14.6 268 359 A A H 3> S+ 0 0 35 1,-0.3 4,-3.3 -2,-0.2 5,-0.2 0.827 116.7 53.1 -41.7 -50.0 58.8 -30.5 -15.0 269 360 A F H 3> S+ 0 0 0 -27,-0.4 4,-2.3 2,-0.2 -1,-0.3 0.837 111.1 47.1 -61.7 -35.7 59.6 -27.7 -12.5 270 361 A I H <> S+ 0 0 4 -3,-1.2 4,-4.5 -6,-0.2 5,-0.2 0.978 113.5 46.0 -66.8 -57.3 57.5 -29.3 -9.8 271 362 A K H X S+ 0 0 119 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.939 115.8 47.4 -52.7 -49.8 58.9 -32.8 -10.3 272 363 A R H X S+ 0 0 65 -4,-3.3 4,-1.9 -5,-0.3 -1,-0.2 0.926 116.6 43.0 -57.7 -44.1 62.4 -31.3 -10.3 273 364 A S H < S+ 0 0 13 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.880 108.7 59.5 -70.6 -37.8 61.6 -29.2 -7.2 274 365 A D H < S+ 0 0 98 -4,-4.5 -2,-0.2 1,-0.2 -1,-0.2 0.949 109.3 43.3 -50.8 -52.9 59.9 -32.2 -5.6 275 366 A A H < S+ 0 0 78 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.919 94.2 103.3 -58.3 -46.4 63.2 -34.2 -5.8 276 367 A E < - 0 0 51 -4,-1.9 2,-0.6 -5,-0.2 -3,-0.0 0.103 64.7-137.3 -54.0 150.2 65.4 -31.4 -4.7 277 368 A E + 0 0 194 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.923 36.1 155.5-111.2 110.3 67.0 -31.2 -1.2 278 369 A V - 0 0 59 -2,-0.6 2,-1.2 -174,-0.1 3,-0.2 -0.988 44.1-132.1-136.6 147.2 66.9 -27.7 0.4 279 370 A D > + 0 0 113 -2,-0.3 4,-3.4 1,-0.2 5,-0.2 -0.688 33.4 166.0 -96.5 80.8 66.9 -26.4 3.9 280 371 A F H > S+ 0 0 3 -2,-1.2 4,-3.2 2,-0.2 5,-0.3 0.948 79.2 53.5 -59.1 -49.1 64.1 -23.9 3.7 281 372 A A H > S+ 0 0 26 -3,-0.2 4,-1.8 1,-0.2 5,-0.2 0.909 113.4 46.0 -50.0 -43.7 64.0 -23.6 7.5 282 373 A G H > S+ 0 0 26 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.954 113.3 45.8 -64.1 -53.0 67.7 -22.8 7.2 283 374 A W H X S+ 0 0 51 -4,-3.4 4,-2.5 1,-0.2 -2,-0.2 0.880 112.0 53.8 -59.6 -38.5 67.4 -20.3 4.4 284 375 A L H X S+ 0 0 0 -4,-3.2 4,-1.7 -5,-0.2 -1,-0.2 0.929 113.0 39.0 -63.2 -50.5 64.5 -18.5 6.0 285 376 A C H X S+ 0 0 7 -4,-1.8 4,-2.3 -5,-0.3 5,-0.5 0.901 113.1 57.3 -72.0 -42.0 66.1 -17.9 9.4 286 377 A S H < S+ 0 0 98 -4,-2.4 3,-0.3 -5,-0.2 -2,-0.2 0.965 113.4 39.7 -43.7 -59.3 69.4 -17.1 7.8 287 378 A T H < S+ 0 0 48 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.727 128.2 30.1 -74.2 -22.9 67.8 -14.3 5.7 288 379 A I H < S- 0 0 35 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.372 104.0-119.0-118.3 5.1 65.5 -12.9 8.4 289 380 A G S < S+ 0 0 66 -4,-2.3 -3,-0.2 -3,-0.3 -4,-0.1 0.984 71.4 113.6 59.9 80.5 67.4 -13.6 11.6 290 381 A L 0 0 78 -5,-0.5 -5,-0.1 -150,-0.0 -4,-0.1 0.552 360.0 360.0-141.0 -54.3 65.3 -15.9 13.8 291 382 A N 0 0 163 -10,-0.2 -2,-0.1 -9,-0.1 -6,-0.0 -0.160 360.0 360.0 -61.0 360.0 66.8 -19.4 14.4