==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-MAR-10 3MBL . COMPND 2 MOLECULE: DUAL SPECIFICITY MITOGEN-ACTIVATED PROTEIN KINASE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.R.DOUGAN,C.D.MOL . 290 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14885.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 194 66.9 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 13.4 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 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 32.4 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+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 1 1 1 2 1 3 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 0 158 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 158.2 39.9 19.5 59.3 2 62 A E - 0 0 154 1,-0.0 2,-0.4 69,-0.0 69,-0.1 -0.577 360.0-134.7 -75.4 128.6 36.3 19.4 58.1 3 63 A L + 0 0 19 -2,-0.3 2,-0.3 67,-0.1 69,-0.1 -0.688 29.5 174.5 -82.8 133.2 34.6 22.8 57.3 4 64 A K > - 0 0 93 -2,-0.4 3,-1.4 69,-0.1 4,-0.2 -0.967 41.2-106.0-137.3 163.0 31.0 23.3 58.7 5 65 A D G > S+ 0 0 64 -2,-0.3 3,-1.3 1,-0.3 -1,-0.1 0.791 112.9 51.3 -55.2 -41.4 28.5 26.2 58.8 6 66 A D G 3 S+ 0 0 110 1,-0.3 -1,-0.3 3,-0.0 22,-0.0 0.630 97.5 68.7 -77.0 -10.9 28.7 27.1 62.5 7 67 A D G < S+ 0 0 30 -3,-1.4 21,-2.2 21,-0.1 -1,-0.3 0.507 90.5 82.7 -81.8 -3.7 32.5 27.3 62.4 8 68 A F E < -A 27 0A 17 -3,-1.3 2,-0.4 19,-0.2 19,-0.2 -0.660 55.9-164.6-104.1 156.2 32.3 30.5 60.2 9 69 A E E -A 26 0A 114 17,-1.4 17,-2.4 -2,-0.2 2,-0.1 -0.992 27.1-120.1-138.7 128.7 31.7 34.2 61.0 10 70 A K E +A 25 0A 152 -2,-0.4 15,-0.2 15,-0.2 3,-0.1 -0.448 31.6 172.4 -68.3 135.8 30.7 36.7 58.3 11 71 A I E - 0 0 85 13,-2.8 2,-0.3 1,-0.5 14,-0.2 0.775 60.9 -43.2-105.4 -58.4 33.2 39.6 57.9 12 72 A S E -A 24 0A 57 12,-1.5 12,-2.4 0, 0.0 2,-0.5 -0.899 60.8 -87.7-154.2-175.7 31.9 41.4 54.8 13 73 A E E -A 23 0A 111 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.920 24.6-169.1-104.1 125.1 30.4 40.8 51.3 14 74 A L E - 0 0 61 8,-2.6 2,-0.3 -2,-0.5 9,-0.2 0.809 60.2 -73.7 -83.2 -31.5 33.0 40.4 48.4 15 75 A G E -A 22 0A 28 7,-1.3 7,-2.7 2,-0.0 -1,-0.3 -0.933 41.8-113.3 167.6-172.1 30.3 40.6 45.8 16 76 A A E +A 21 0A 73 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.946 23.6 168.3-140.4 159.7 27.4 38.6 44.1 17 77 A G - 0 0 58 3,-1.8 2,-0.5 -2,-0.3 3,-0.2 -0.529 60.6 -19.4-137.3-148.1 26.6 37.1 40.6 18 78 A N S S- 0 0 87 1,-0.2 144,-0.1 -2,-0.2 146,-0.1 -0.579 126.2 -29.1 -67.9 115.7 23.9 34.8 39.3 19 79 A G S S+ 0 0 60 -2,-0.5 21,-1.9 1,-0.1 2,-0.4 0.436 121.6 98.2 55.6 4.1 22.3 32.8 42.3 20 80 A G E - B 0 39A 9 19,-0.2 -3,-1.8 -3,-0.2 2,-0.3 -0.967 50.7-168.7-130.2 119.3 25.7 33.1 44.2 21 81 A V E -AB 16 38A 44 17,-1.2 17,-2.7 -2,-0.4 2,-0.5 -0.786 12.5-148.8-100.9 149.8 26.9 35.4 47.0 22 82 A V E -AB 15 37A 26 -7,-2.7 -8,-2.6 -2,-0.3 -7,-1.3 -0.961 13.2-168.7-122.8 118.2 30.4 35.6 48.1 23 83 A F E -AB 13 36A 25 13,-3.2 13,-3.6 -2,-0.5 2,-0.6 -0.782 24.2-133.4-102.4 145.0 31.4 36.4 51.6 24 84 A K E +AB 12 35A 60 -12,-2.4 -13,-2.8 -2,-0.3 -12,-1.5 -0.891 48.0 173.3 -84.3 120.3 34.7 37.3 53.2 25 85 A V E -AB 10 34A 4 9,-2.9 9,-2.7 -2,-0.6 2,-0.5 -0.863 34.9-125.7-132.5 165.5 34.6 35.1 56.3 26 86 A S E -AB 9 33A 25 -17,-2.4 -17,-1.4 -2,-0.3 2,-1.2 -0.948 15.1-143.2-111.8 128.0 36.6 33.9 59.2 27 87 A H E >> -A 8 0A 5 5,-3.2 4,-3.0 -2,-0.5 3,-0.9 -0.763 19.6-157.3 -86.3 98.7 37.0 30.2 59.9 28 88 A K T 34 S+ 0 0 101 -21,-2.2 -1,-0.2 -2,-1.2 -20,-0.1 0.822 82.2 49.8 -53.1 -41.5 36.9 30.4 63.6 29 89 A P T 34 S+ 0 0 66 0, 0.0 -1,-0.3 0, 0.0 -21,-0.1 0.868 122.5 30.9 -70.4 -28.2 38.7 27.2 64.5 30 90 A S T <4 S- 0 0 60 -3,-0.9 -2,-0.2 2,-0.2 3,-0.1 0.744 97.2-129.5 -98.1 -29.7 41.7 27.8 62.3 31 91 A G < + 0 0 53 -4,-3.0 -3,-0.2 1,-0.3 2,-0.1 0.228 60.1 143.3 97.3 -7.3 41.8 31.6 62.4 32 92 A L - 0 0 74 -5,-0.4 -5,-3.2 -6,-0.1 2,-0.4 -0.340 48.7-135.1 -69.2 141.3 41.9 31.7 58.6 33 93 A V E +B 26 0A 55 -7,-0.2 52,-0.6 -3,-0.1 2,-0.3 -0.799 34.8 170.8 -92.4 133.0 40.2 34.2 56.4 34 94 A M E -BC 25 84A 1 -9,-2.7 -9,-2.9 -2,-0.4 2,-0.5 -0.889 37.6-117.7-135.8 164.9 38.4 32.7 53.4 35 95 A A E -BC 24 83A 6 48,-2.6 48,-2.9 -2,-0.3 2,-0.5 -0.937 31.5-160.3-102.1 131.0 36.0 33.6 50.6 36 96 A R E -BC 23 82A 21 -13,-3.6 -13,-3.2 -2,-0.5 2,-0.4 -0.960 3.0-162.3-118.4 117.8 32.9 31.6 51.0 37 97 A K E -BC 22 81A 41 44,-3.2 44,-2.9 -2,-0.5 2,-0.5 -0.854 5.3-159.9-102.6 132.8 30.6 31.3 47.9 38 98 A L E -BC 21 80A 23 -17,-2.7 -17,-1.2 -2,-0.4 2,-0.6 -0.959 4.1-165.7-116.8 127.6 27.0 30.2 48.5 39 99 A I E -BC 20 79A 13 40,-2.5 40,-1.7 -2,-0.5 2,-0.6 -0.948 10.8-150.8-117.7 113.0 24.9 28.7 45.7 40 100 A H E + C 0 78A 105 -21,-1.9 2,-0.4 -2,-0.6 38,-0.2 -0.676 26.2 170.4 -84.4 115.8 21.2 28.5 46.4 41 101 A L - 0 0 17 36,-1.6 2,-1.9 -2,-0.6 118,-0.1 -0.956 40.9-138.0-141.7 133.8 19.6 25.6 44.7 42 102 A E + 0 0 176 -2,-0.4 2,-0.4 116,-0.1 -2,-0.0 -0.526 57.5 142.4 -72.8 79.2 16.2 23.8 44.6 43 103 A I - 0 0 36 -2,-1.9 -2,-0.1 34,-0.1 34,-0.1 -0.982 53.6-105.3-135.7 139.8 17.6 20.3 44.5 44 104 A K > - 0 0 159 -2,-0.4 4,-1.7 1,-0.1 3,-0.0 -0.050 36.8-110.4 -51.5 153.8 16.8 16.8 45.9 45 105 A P H > S+ 0 0 78 0, 0.0 4,-0.8 0, 0.0 -1,-0.1 0.722 113.2 54.4 -63.2 -22.6 19.0 15.4 48.8 46 106 A A H > S+ 0 0 71 2,-0.2 4,-1.3 1,-0.2 3,-0.5 0.935 108.2 43.9 -80.5 -49.3 20.5 12.8 46.6 47 107 A I H > S+ 0 0 40 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.833 107.4 61.5 -67.6 -30.9 21.9 14.9 43.8 48 108 A R H X S+ 0 0 52 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.859 103.2 50.4 -61.6 -35.2 23.2 17.4 46.3 49 109 A N H X S+ 0 0 73 -4,-0.8 4,-1.7 -3,-0.5 -1,-0.2 0.818 108.4 52.1 -76.5 -30.7 25.5 14.8 47.8 50 110 A Q H X S+ 0 0 65 -4,-1.3 4,-3.4 2,-0.2 5,-0.3 0.953 109.5 50.6 -61.2 -48.9 26.6 13.9 44.3 51 111 A I H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.3 -2,-0.2 0.918 112.8 45.3 -55.0 -45.2 27.4 17.7 43.8 52 112 A I H < S+ 0 0 34 -4,-2.5 4,-0.4 2,-0.2 -1,-0.3 0.871 113.5 50.0 -68.9 -31.2 29.3 17.7 47.0 53 113 A R H >< S+ 0 0 164 -4,-1.7 3,-1.0 1,-0.2 4,-0.3 0.905 111.0 48.6 -77.1 -39.5 31.1 14.5 46.1 54 114 A E H >< S+ 0 0 52 -4,-3.4 3,-1.0 1,-0.2 -1,-0.2 0.786 104.6 61.5 -64.7 -32.1 32.0 15.9 42.7 55 115 A L G >< S+ 0 0 3 -4,-1.9 3,-1.4 -5,-0.3 -1,-0.2 0.612 84.3 79.4 -70.7 -11.1 33.3 19.1 44.3 56 116 A Q G X> S+ 0 0 62 -3,-1.0 3,-2.4 -4,-0.4 4,-0.5 0.768 72.9 76.0 -73.5 -20.4 35.9 17.2 46.3 57 117 A V G X4 S+ 0 0 63 -3,-1.0 3,-1.4 1,-0.3 4,-0.3 0.791 78.4 75.9 -62.7 -17.6 38.2 17.0 43.3 58 118 A L G X4 S+ 0 0 18 -3,-1.4 3,-1.7 1,-0.3 -1,-0.3 0.819 82.4 66.0 -63.1 -27.3 39.0 20.6 44.0 59 119 A H G <4 S+ 0 0 74 -3,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.846 100.3 51.7 -59.5 -32.0 41.2 19.3 46.9 60 120 A E G << S+ 0 0 129 -3,-1.4 2,-1.0 -4,-0.5 -1,-0.3 0.422 86.0 97.3 -83.6 -2.0 43.4 17.8 44.2 61 121 A C < + 0 0 5 -3,-1.7 2,-0.5 -4,-0.3 8,-0.3 -0.787 45.7 157.4 -89.5 101.6 43.6 21.2 42.3 62 122 A N + 0 0 115 -2,-1.0 5,-0.1 6,-0.1 6,-0.1 -0.948 13.1 128.4-133.2 108.3 46.9 22.7 43.4 63 123 A S > - 0 0 21 -2,-0.5 3,-1.5 3,-0.4 53,-0.0 -0.960 62.2-125.4-156.5 141.2 48.5 25.2 41.1 64 124 A P T 3 S+ 0 0 82 0, 0.0 80,-0.3 0, 0.0 52,-0.1 0.547 115.0 55.7 -66.5 -5.8 49.8 28.8 41.6 65 125 A Y T 3 S+ 0 0 71 50,-0.1 81,-2.1 80,-0.1 2,-0.4 0.236 98.0 69.6-108.1 14.4 47.4 29.7 38.8 66 126 A I B < S-e 146 0B 3 -3,-1.5 -3,-0.4 79,-0.3 81,-0.2 -0.998 91.3-103.8-137.3 131.8 44.2 28.3 40.4 67 127 A V - 0 0 10 79,-3.1 -2,-0.1 -2,-0.4 -6,-0.1 -0.224 45.2-105.7 -57.0 134.6 42.5 29.7 43.4 68 128 A G - 0 0 20 -4,-0.1 16,-2.0 -6,-0.1 2,-0.4 -0.352 32.0-147.6 -60.2 149.7 43.1 27.7 46.5 69 129 A F E +D 83 0A 29 -8,-0.3 14,-0.2 14,-0.3 3,-0.1 -0.982 21.8 176.7-126.0 135.0 40.2 25.5 47.8 70 130 A Y E - 0 0 85 12,-3.3 2,-0.3 -2,-0.4 13,-0.2 0.755 59.8 -58.2-104.6 -41.5 39.5 24.6 51.4 71 131 A G E -D 82 0A 4 11,-1.3 11,-2.6 -69,-0.1 2,-0.4 -0.894 37.1-121.5 168.1 171.6 36.3 22.6 51.2 72 132 A A E +D 81 0A 12 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.986 31.6 155.6-135.9 138.0 32.7 22.2 50.1 73 133 A F E -D 80 0A 23 7,-1.9 7,-3.7 -2,-0.4 2,-0.4 -0.948 35.6-111.7-155.8 173.6 29.6 21.5 52.1 74 134 A Y E +D 79 0A 72 -2,-0.3 5,-0.2 5,-0.2 -69,-0.2 -0.943 39.4 149.7-117.5 134.8 25.8 21.8 52.2 75 135 A S - 0 0 30 3,-2.7 2,-0.6 -2,-0.4 -1,-0.1 0.547 62.9 -0.9-130.4 -91.1 23.9 24.0 54.7 76 136 A D S S- 0 0 131 1,-0.1 3,-0.1 0, 0.0 -2,-0.0 -0.516 125.8 -52.5-114.9 69.6 20.6 25.9 54.5 77 137 A G S S+ 0 0 21 -2,-0.6 -36,-1.6 1,-0.3 2,-0.4 0.560 121.2 115.8 67.6 13.3 19.5 25.2 51.0 78 138 A E E -C 40 0A 39 -38,-0.2 -3,-2.7 -40,-0.0 2,-0.6 -0.878 60.4-148.8-117.6 139.2 23.0 26.5 50.2 79 139 A I E -CD 39 74A 0 -40,-1.7 -40,-2.5 -2,-0.4 2,-0.5 -0.949 23.6-151.9-104.0 127.0 26.1 24.8 48.7 80 140 A S E -CD 38 73A 0 -7,-3.7 -7,-1.9 -2,-0.6 2,-0.5 -0.887 15.4-174.1-105.0 127.4 29.2 26.3 50.2 81 141 A I E -CD 37 72A 21 -44,-2.9 -44,-3.2 -2,-0.5 2,-0.6 -0.992 12.2-159.1-114.9 124.1 32.4 26.5 48.4 82 142 A C E +CD 36 71A 0 -11,-2.6 -12,-3.3 -2,-0.5 -11,-1.3 -0.918 19.4 168.9-110.8 121.0 35.3 27.9 50.5 83 143 A M E -CD 35 69A 19 -48,-2.9 -48,-2.6 -2,-0.6 -14,-0.3 -0.718 43.1 -76.0-122.8 169.7 38.3 29.3 48.8 84 144 A E E -C 34 0A 37 -16,-2.0 2,-0.5 -2,-0.2 -50,-0.2 -0.407 53.3-119.2 -58.8 137.6 41.4 31.3 49.4 85 145 A H - 0 0 44 -52,-0.6 2,-0.8 -2,-0.1 -1,-0.1 -0.719 20.2-151.7 -89.9 125.2 40.5 34.9 49.8 86 146 A M > - 0 0 13 -2,-0.5 3,-2.3 1,-0.1 52,-0.2 -0.849 3.0-162.1-104.3 107.1 42.2 37.1 47.1 87 147 A D T 3 S+ 0 0 61 -2,-0.8 52,-0.2 1,-0.3 -1,-0.1 0.537 86.7 61.0 -67.7 -9.1 42.6 40.5 48.6 88 148 A G T 3 S- 0 0 4 50,-1.4 -1,-0.3 1,-0.3 51,-0.2 0.564 95.8-147.5 -91.2 -11.1 43.1 42.0 45.1 89 149 A G < - 0 0 16 -3,-2.3 49,-2.6 49,-0.3 -1,-0.3 -0.325 36.9 -41.2 75.1-163.3 39.6 41.0 43.9 90 150 A S B >> -F 137 0B 10 47,-0.2 4,-2.2 -2,-0.1 3,-0.5 -0.594 54.1-108.4 -97.6 163.8 38.8 40.1 40.3 91 151 A L H 3> S+ 0 0 1 45,-2.0 4,-3.3 42,-1.4 43,-0.2 0.739 116.9 59.4 -68.6 -28.8 40.1 41.8 37.2 92 152 A D H 3> S+ 0 0 58 41,-0.4 4,-1.3 2,-0.2 -1,-0.3 0.875 108.9 45.9 -62.9 -36.2 36.8 43.4 36.4 93 153 A Q H <> S+ 0 0 93 -3,-0.5 4,-1.6 2,-0.2 -2,-0.2 0.909 114.2 48.9 -68.4 -42.0 36.9 45.1 39.8 94 154 A V H X S+ 0 0 2 -4,-2.2 4,-2.9 1,-0.2 3,-0.3 0.937 110.0 50.7 -61.5 -49.6 40.5 46.0 39.0 95 155 A L H X S+ 0 0 13 -4,-3.3 4,-2.1 1,-0.2 -1,-0.2 0.817 105.4 58.4 -54.1 -34.0 39.6 47.4 35.5 96 156 A K H < S+ 0 0 187 -4,-1.3 -1,-0.2 2,-0.2 -2,-0.2 0.922 114.5 34.4 -69.8 -40.8 36.8 49.5 37.1 97 157 A K H < S+ 0 0 172 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.874 124.3 44.7 -76.7 -37.9 39.3 51.3 39.3 98 158 A A H < S- 0 0 32 -4,-2.9 2,-1.6 -5,-0.2 -2,-0.2 0.642 87.3-150.2 -82.4 -20.3 42.2 51.3 36.7 99 159 A G S < S+ 0 0 43 -4,-2.1 2,-0.3 -5,-0.2 -1,-0.1 -0.192 76.7 16.6 80.1 -47.6 40.1 52.3 33.7 100 160 A R S S- 0 0 101 -2,-1.6 97,-0.2 -6,-0.1 96,-0.1 -0.974 77.3-128.1-158.9 137.3 42.4 50.3 31.3 101 161 A I - 0 0 3 95,-3.0 5,-0.1 -2,-0.3 -6,-0.0 -0.824 30.5-115.5 -97.9 130.4 44.9 47.7 32.0 102 162 A P > - 0 0 54 0, 0.0 4,-2.7 0, 0.0 3,-0.4 -0.312 19.2-121.6 -63.9 145.2 48.5 48.1 30.5 103 163 A E H > S+ 0 0 31 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.859 111.2 56.7 -44.4 -48.6 49.7 45.7 27.8 104 164 A Q H > S+ 0 0 111 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.919 111.9 44.1 -57.6 -41.5 52.8 44.6 29.8 105 165 A I H > S+ 0 0 9 -3,-0.4 4,-2.3 2,-0.2 3,-0.5 0.905 107.8 55.3 -70.9 -43.1 50.4 43.6 32.6 106 166 A L H X S+ 0 0 0 -4,-2.7 4,-3.2 1,-0.2 -1,-0.2 0.850 101.1 64.1 -56.1 -29.7 47.9 41.9 30.3 107 167 A G H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.922 105.3 42.5 -57.2 -46.2 51.0 40.0 29.3 108 168 A K H X S+ 0 0 41 -4,-1.0 4,-2.5 -3,-0.5 -2,-0.2 0.902 112.4 52.6 -71.1 -37.2 51.2 38.5 32.8 109 169 A V H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.945 108.0 53.0 -61.1 -43.5 47.5 37.9 33.0 110 170 A S H X S+ 0 0 0 -4,-3.2 4,-2.3 1,-0.2 -1,-0.2 0.869 108.3 49.1 -64.0 -35.6 47.7 36.0 29.7 111 171 A I H X S+ 0 0 12 -4,-1.6 4,-2.6 1,-0.2 -1,-0.2 0.931 110.8 50.0 -68.7 -45.9 50.4 33.8 30.9 112 172 A A H X S+ 0 0 5 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.868 112.2 48.4 -59.4 -36.2 48.6 33.0 34.1 113 173 A V H X S+ 0 0 2 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.959 113.2 45.2 -72.4 -44.5 45.4 32.2 32.2 114 174 A I H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.912 114.2 49.8 -63.6 -38.4 47.1 29.9 29.7 115 175 A K H X S+ 0 0 72 -4,-2.6 4,-1.8 -5,-0.2 -1,-0.2 0.863 113.1 47.1 -72.1 -32.8 49.0 28.2 32.5 116 176 A G H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.912 112.0 47.9 -72.6 -41.7 45.8 27.7 34.5 117 177 A L H X S+ 0 0 7 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.897 112.6 51.4 -65.4 -33.8 43.8 26.4 31.6 118 178 A T H X S+ 0 0 27 -4,-2.1 4,-3.4 -5,-0.3 5,-0.4 0.914 108.6 51.1 -70.3 -41.8 46.7 24.0 30.8 119 179 A Y H X>S+ 0 0 41 -4,-1.8 4,-2.6 1,-0.2 5,-0.6 0.949 110.8 47.3 -61.6 -48.3 46.8 22.8 34.3 120 180 A L H X>S+ 0 0 1 -4,-2.6 4,-1.3 1,-0.2 6,-1.3 0.895 117.3 43.1 -60.3 -41.3 43.1 22.1 34.4 121 181 A R H X5S+ 0 0 89 -4,-2.4 4,-1.0 4,-0.3 -2,-0.2 0.952 119.2 40.5 -69.1 -50.9 43.3 20.2 31.0 122 182 A E H <5S+ 0 0 110 -4,-3.4 -2,-0.2 1,-0.2 -3,-0.2 0.916 128.2 27.9 -68.8 -45.1 46.5 18.3 31.6 123 183 A K H <5S+ 0 0 132 -4,-2.6 -3,-0.2 -5,-0.4 -1,-0.2 0.757 137.3 21.7 -92.9 -26.1 45.9 17.2 35.2 124 184 A H H < S- 0 0 46 -2,-0.5 3,-2.2 1,-0.1 -41,-0.2 -0.933 72.3 -89.5-165.9 163.8 36.0 36.2 32.1 133 193 A P G > S+ 0 0 1 0, 0.0 3,-1.8 0, 0.0 -42,-1.4 0.827 121.2 56.7 -51.7 -37.4 37.5 39.1 34.1 134 194 A S G 3 S+ 0 0 35 1,-0.3 -3,-0.1 -43,-0.2 -41,-0.0 0.644 103.9 53.5 -72.4 -16.0 35.5 38.5 37.2 135 195 A N G < S+ 0 0 6 -3,-2.2 12,-1.8 -5,-0.1 2,-0.6 0.104 91.4 85.1-102.4 16.8 36.7 34.9 37.4 136 196 A I E < - G 0 146B 4 -3,-1.8 -45,-2.0 10,-0.2 2,-0.3 -0.970 66.8-168.2-115.0 111.7 40.4 36.0 37.3 137 197 A L E -FG 90 145B 22 8,-3.0 8,-3.2 -2,-0.6 2,-0.3 -0.713 6.3-170.8-103.8 148.3 41.4 36.9 40.8 138 198 A V E - G 0 144B 0 -49,-2.6 -50,-1.4 -2,-0.3 -49,-0.3 -0.907 3.1-161.8-135.1 158.1 44.6 38.7 41.8 139 199 A N > - 0 0 8 4,-1.4 3,-1.7 -2,-0.3 146,-0.1 -0.874 35.6 -98.1-140.8 176.8 46.3 39.4 45.2 140 200 A S T 3 S+ 0 0 46 1,-0.3 146,-0.1 -2,-0.3 145,-0.1 0.697 116.9 62.7 -72.1 -20.2 48.9 41.6 46.9 141 201 A R T 3 S- 0 0 196 2,-0.1 -1,-0.3 1,-0.0 141,-0.2 0.450 121.3-107.4 -88.7 10.2 51.6 39.1 46.7 142 202 A G < + 0 0 20 -3,-1.7 2,-0.2 1,-0.3 -2,-0.1 0.484 68.1 146.2 93.4 6.0 51.2 39.4 42.9 143 203 A E - 0 0 61 138,-0.1 -4,-1.4 139,-0.0 2,-0.4 -0.472 34.8-154.1 -83.1 148.2 49.5 36.2 42.0 144 204 A I E + G 0 138B 14 -80,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.987 22.9 176.1-126.0 120.7 47.0 35.7 39.2 145 205 A K E - G 0 137B 16 -8,-3.2 -8,-3.0 -2,-0.4 2,-0.3 -0.948 26.9-130.5-138.7 144.9 44.5 32.9 39.6 146 206 A L E +eG 66 136B 2 -81,-2.1 -79,-3.1 -2,-0.3 2,-0.3 -0.681 29.3 172.2 -88.9 144.3 41.5 31.3 37.9 147 207 A C + 0 0 6 -12,-1.8 -17,-0.1 -2,-0.3 -12,-0.0 -0.821 48.5 46.2-137.8 175.2 38.3 30.5 39.8 148 208 A D + 0 0 52 -2,-0.3 2,-0.2 1,-0.2 -1,-0.1 0.809 67.3 155.6 58.4 36.6 34.8 29.3 39.1 149 209 A F - 0 0 28 -3,-0.1 2,-1.1 -20,-0.1 3,-0.2 -0.582 51.0-101.2 -88.7 159.6 35.7 26.5 36.7 150 210 A G + 0 0 17 -22,-1.9 -23,-0.1 -23,-0.5 3,-0.1 -0.684 55.3 148.5 -90.4 101.2 33.3 23.5 36.1 151 211 A V + 0 0 27 -2,-1.1 2,-0.7 1,-0.2 -1,-0.2 0.636 59.7 71.1 -96.6 -20.9 34.5 20.5 38.1 152 212 A S >> - 0 0 2 -3,-0.2 4,-2.9 1,-0.2 3,-0.6 -0.865 57.3-166.5-114.1 109.6 31.1 19.1 38.7 153 213 A G H 3> S+ 0 0 42 -2,-0.7 4,-1.7 1,-0.3 -1,-0.2 0.923 95.6 47.9 -49.9 -50.7 29.0 17.6 35.9 154 214 A Q H 3> S+ 0 0 42 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.774 110.2 51.6 -64.4 -28.1 25.9 17.7 38.0 155 215 A L H <> S+ 0 0 19 -3,-0.6 4,-1.2 2,-0.2 -2,-0.2 0.907 102.6 57.6 -79.9 -42.6 26.5 21.3 39.1 156 216 A I H < S+ 0 0 63 -4,-2.9 3,-0.5 1,-0.2 -2,-0.2 0.937 110.2 50.5 -43.4 -45.1 26.9 22.5 35.6 157 217 A D H >< S+ 0 0 102 -4,-1.7 3,-2.7 -5,-0.2 4,-0.4 0.978 107.2 46.3 -60.9 -60.5 23.4 20.9 35.2 158 218 A S H 3< S+ 0 0 37 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.617 115.1 51.5 -65.9 -5.0 21.5 22.5 38.1 159 219 A M T >< S+ 0 0 81 -4,-1.2 3,-0.9 -3,-0.5 -1,-0.3 0.341 78.9 96.7-109.8 6.1 23.0 25.8 37.1 160 220 A A T < + 0 0 54 -3,-2.7 -2,-0.1 1,-0.2 -1,-0.1 0.836 63.7 83.6 -64.0 -32.1 21.9 25.6 33.4 161 221 A N T 3 S+ 0 0 161 -4,-0.4 2,-0.3 -3,-0.2 -1,-0.2 0.358 92.6 29.9 -61.5 -0.8 18.8 27.7 34.0 162 222 A S < + 0 0 69 -3,-0.9 2,-0.3 -144,-0.1 -144,-0.1 -0.984 51.8 176.5-160.8 148.1 20.4 31.3 33.8 163 223 A F - 0 0 126 -2,-0.3 2,-0.3 5,-0.0 5,-0.1 -0.941 50.4 -72.0-144.1 164.1 23.2 33.4 32.3 164 224 A V - 0 0 57 -2,-0.3 -2,-0.0 1,-0.1 -147,-0.0 -0.444 41.2-152.4 -62.6 116.6 24.3 37.1 32.3 165 225 A G S S+ 0 0 48 -2,-0.3 -1,-0.1 3,-0.0 3,-0.1 0.555 81.6 33.8 -76.7 -13.9 21.7 38.9 30.2 166 226 A T S S+ 0 0 102 1,-0.3 2,-0.1 57,-0.0 57,-0.0 0.534 113.4 36.5-100.2-102.3 24.0 41.8 28.9 167 227 A R - 0 0 101 1,-0.1 2,-0.4 2,-0.0 -1,-0.3 -0.279 64.8-167.1 -59.0 126.2 27.7 40.8 28.3 168 228 A S - 0 0 14 -2,-0.1 -1,-0.1 -3,-0.1 -3,-0.0 -0.929 20.6-179.9-109.3 135.4 28.5 37.4 26.9 169 229 A Y + 0 0 22 -2,-0.4 2,-0.2 2,-0.1 -38,-0.1 0.151 47.3 126.4-106.4 15.7 32.0 35.9 26.8 170 230 A M - 0 0 31 1,-0.1 -2,-0.1 17,-0.1 15,-0.1 -0.544 64.0-114.0 -80.8 143.7 30.6 32.8 25.2 171 231 A S > - 0 0 0 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.285 25.5-113.0 -69.1 155.1 32.2 31.6 21.9 172 232 A P H > S+ 0 0 4 0, 0.0 4,-1.1 0, 0.0 -1,-0.1 0.863 118.5 53.0 -56.8 -35.8 30.1 31.6 18.8 173 233 A E H > S+ 0 0 18 81,-0.2 4,-1.1 1,-0.2 3,-0.2 0.905 110.9 46.2 -68.9 -38.2 30.2 27.8 18.7 174 234 A R H 4 S+ 0 0 39 1,-0.2 3,-0.2 2,-0.2 -1,-0.2 0.844 108.9 55.2 -69.3 -38.2 28.9 27.6 22.2 175 235 A L H < S+ 0 0 45 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.793 113.6 43.8 -61.6 -24.8 26.2 30.2 21.6 176 236 A Q H < S- 0 0 132 -4,-1.1 2,-0.3 -5,-0.2 -2,-0.2 0.645 121.6 -47.8 -98.4 -13.6 25.0 28.1 18.6 177 237 A G < - 0 0 38 -4,-1.1 -1,-0.1 -3,-0.2 0, 0.0 -0.958 67.7 -59.3 177.9-167.1 24.9 24.6 20.0 178 238 A T S S+ 0 0 118 -2,-0.3 2,-3.2 1,-0.1 -1,-0.1 0.704 92.4 103.7 -73.7 -28.8 26.5 21.6 21.8 179 239 A H + 0 0 165 -6,-0.2 2,-0.3 -3,-0.1 -1,-0.1 -0.268 60.3 94.2 -66.8 70.2 29.4 21.5 19.4 180 240 A Y + 0 0 64 -2,-3.2 2,-0.2 -6,-0.1 0, 0.0 -0.956 35.0 152.2-148.7 168.6 32.1 23.1 21.6 181 241 A S > - 0 0 69 -2,-0.3 3,-2.2 0, 0.0 4,-0.3 -0.712 67.9 -21.3-165.8-144.3 34.8 22.1 24.1 182 242 A V T >> S+ 0 0 49 1,-0.3 3,-1.5 -2,-0.2 4,-0.5 0.743 121.7 68.1 -56.4 -32.0 38.2 23.5 25.4 183 243 A Q H >> S+ 0 0 35 1,-0.3 4,-1.3 2,-0.2 3,-1.1 0.791 88.2 69.6 -60.3 -27.2 38.7 25.8 22.3 184 244 A S H <> S+ 0 0 1 -3,-2.2 4,-1.8 1,-0.3 -1,-0.3 0.837 91.3 57.7 -55.3 -36.5 35.8 27.8 23.6 185 245 A D H <> S+ 0 0 5 -3,-1.5 4,-2.0 -4,-0.3 -1,-0.3 0.738 99.1 60.0 -67.9 -24.5 37.8 29.0 26.6 186 246 A I H S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.7 0.923 115.4 42.8 -58.5 -42.9 38.0 44.3 27.2 196 256 A M H <5S+ 0 0 1 -4,-2.2 -95,-3.0 1,-0.3 -1,-0.2 0.798 113.2 52.1 -77.0 -31.6 40.7 44.8 29.7 197 257 A A H <5S+ 0 0 0 -4,-2.6 -1,-0.3 -97,-0.2 -2,-0.2 0.774 120.1 34.5 -65.2 -30.5 43.0 46.4 27.2 198 258 A V H <5S- 0 0 5 -4,-1.5 -2,-0.2 -3,-0.2 -3,-0.2 0.687 104.3-115.0-113.6 -24.9 40.4 48.8 26.1 199 259 A G T <5S+ 0 0 27 -4,-2.6 2,-0.3 -5,-0.2 -3,-0.2 0.395 84.0 47.5 104.7 -2.3 38.4 49.8 29.1 200 260 A R S - 0 0 103 -3,-0.1 4,-1.3 1,-0.1 3,-0.1 -0.141 33.0-101.5 -51.9 149.0 33.2 53.9 16.9 208 268 A A H > S+ 0 0 85 1,-0.2 4,-0.6 2,-0.2 3,-0.5 0.902 124.8 28.6 -41.2 -57.9 35.7 55.6 14.4 209 269 A K H > S+ 0 0 181 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.659 109.7 70.6 -82.9 -15.8 35.9 58.8 16.5 210 270 A E H > S+ 0 0 71 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.698 92.4 64.5 -69.7 -18.6 35.2 57.0 19.8 211 271 A L H X S+ 0 0 55 -4,-1.3 4,-2.6 -3,-0.5 -1,-0.2 0.934 105.4 36.7 -70.8 -54.4 38.7 55.5 19.4 212 272 A E H < S+ 0 0 175 -4,-0.6 -1,-0.2 3,-0.3 -2,-0.2 0.520 110.7 67.1 -81.1 -3.2 40.8 58.6 19.7 213 273 A L H < S+ 0 0 144 -4,-0.6 -2,-0.2 2,-0.2 -1,-0.2 0.929 110.0 33.2 -69.6 -54.4 38.2 59.7 22.3 214 274 A M H < 0 0 52 -4,-1.8 -2,-0.2 1,-0.1 -3,-0.1 0.924 360.0 360.0 -61.9 -47.3 39.5 56.8 24.6 215 275 A F < 0 0 83 -4,-2.6 -3,-0.3 -5,-0.1 -2,-0.2 0.410 360.0 360.0-108.9 360.0 43.0 57.4 23.2 216 ! 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 0.0 217 307 A P 0 0 190 0, 0.0 2,-0.3 0, 0.0 -51,-0.0 0.000 360.0 360.0 360.0 94.0 22.9 50.0 25.4 218 308 A M - 0 0 64 1,-0.0 2,-0.1 2,-0.0 3,-0.0 -0.827 360.0-117.6-113.0 150.1 22.4 46.7 23.2 219 309 A A > - 0 0 55 -2,-0.3 4,-2.8 1,-0.1 5,-0.3 -0.406 27.5-110.8 -86.4 162.8 19.6 44.1 23.0 220 310 A I H > S+ 0 0 115 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.945 115.8 35.5 -57.7 -61.6 20.0 40.4 23.8 221 311 A F H > S+ 0 0 156 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.906 115.4 56.9 -59.4 -45.0 19.6 39.0 20.3 222 312 A E H > S+ 0 0 106 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.902 109.8 45.6 -49.6 -46.9 21.4 41.9 18.8 223 313 A L H X S+ 0 0 12 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.925 115.5 44.4 -67.6 -44.3 24.4 41.3 20.9 224 314 A L H X S+ 0 0 53 -4,-2.2 4,-2.0 -5,-0.3 -2,-0.2 0.899 111.5 54.1 -70.1 -37.8 24.5 37.5 20.3 225 315 A D H X S+ 0 0 55 -4,-3.3 4,-2.3 1,-0.2 5,-0.3 0.805 106.3 54.2 -65.2 -31.5 23.9 38.0 16.6 226 316 A Y H X S+ 0 0 53 -4,-1.6 4,-2.1 -5,-0.3 -2,-0.2 0.962 108.1 47.4 -61.9 -53.5 26.8 40.2 16.6 227 317 A I H < S+ 0 0 4 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.872 120.1 39.3 -57.3 -36.5 29.1 37.6 18.2 228 318 A V H < S+ 0 0 23 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.938 128.0 24.0 -84.5 -45.7 28.0 34.9 15.8 229 319 A N H < S+ 0 0 96 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.511 106.1 76.3-105.0 -5.9 27.6 36.6 12.5 230 320 A E S < S- 0 0 84 -4,-2.1 -4,-0.0 -5,-0.3 0, 0.0 -0.724 90.5 -85.9-110.6 158.7 29.9 39.6 12.6 231 321 A P - 0 0 86 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.314 56.1-104.0 -60.3 142.9 33.6 39.9 12.3 232 322 A P - 0 0 46 0, 0.0 20,-0.0 0, 0.0 -5,-0.0 -0.202 42.5 -87.6 -63.6 155.9 35.3 39.4 15.7 233 323 A P - 0 0 9 0, 0.0 2,-0.3 0, 0.0 19,-0.1 -0.304 42.7-161.7 -65.2 149.4 36.7 42.4 17.7 234 324 A K - 0 0 166 -32,-0.1 12,-0.1 -3,-0.1 11,-0.1 -0.858 26.0-105.7-122.6 153.2 40.3 43.5 17.0 235 325 A L - 0 0 8 -2,-0.3 2,-0.1 10,-0.2 3,-0.1 -0.601 51.4 -94.7 -68.4 146.3 42.6 45.6 19.1 236 326 A P - 0 0 24 0, 0.0 4,-0.3 0, 0.0 3,-0.2 -0.462 45.0-109.6 -59.7 137.4 42.9 49.1 17.7 237 327 A S S S+ 0 0 112 1,-0.2 2,-0.4 -2,-0.1 4,-0.1 -0.414 90.3 24.7 -66.3 140.6 45.9 49.5 15.4 238 328 A G S S+ 0 0 69 2,-0.5 -1,-0.2 -2,-0.1 4,-0.1 -0.384 105.3 63.6 110.5 -54.8 48.8 51.6 16.7 239 329 A V S S+ 0 0 85 -2,-0.4 2,-0.4 -3,-0.2 -2,-0.1 0.371 97.9 59.7 -92.8 5.5 48.8 51.8 20.5 240 330 A F S S- 0 0 17 -4,-0.3 -2,-0.5 -5,-0.0 5,-0.0 -0.989 95.0 -97.6-127.6 147.2 49.4 48.1 21.1 241 331 A S > - 0 0 28 -2,-0.4 4,-1.9 1,-0.1 3,-0.4 -0.172 31.1-118.7 -53.1 147.9 52.3 46.0 19.9 242 332 A L H > S+ 0 0 140 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.815 114.2 59.1 -56.4 -32.2 51.8 44.0 16.7 243 333 A E H > S+ 0 0 81 2,-0.2 4,-1.8 1,-0.2 27,-0.4 0.859 105.3 46.4 -70.5 -37.2 52.4 40.8 18.7 244 334 A F H > S+ 0 0 0 -3,-0.4 4,-2.5 2,-0.2 5,-0.3 0.942 111.0 52.7 -67.4 -47.5 49.5 41.5 21.1 245 335 A Q H X S+ 0 0 31 -4,-1.9 4,-1.9 1,-0.3 -10,-0.2 0.863 113.0 44.5 -56.9 -37.6 47.2 42.3 18.2 246 336 A D H X S+ 0 0 60 -4,-1.8 4,-2.8 2,-0.2 -1,-0.3 0.844 108.7 57.3 -80.0 -33.1 48.0 39.1 16.6 247 337 A F H X S+ 0 0 0 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.980 111.9 40.3 -63.7 -51.7 47.7 37.1 19.8 248 338 A V H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.894 112.4 57.5 -64.8 -35.4 44.2 38.2 20.4 249 339 A N H < S+ 0 0 72 -4,-1.9 3,-0.3 -5,-0.3 -1,-0.2 0.940 106.1 50.0 -55.0 -42.9 43.5 37.8 16.6 250 340 A K H >< S+ 0 0 82 -4,-2.8 10,-2.2 1,-0.2 3,-0.5 0.818 113.0 47.0 -67.1 -28.7 44.6 34.2 17.0 251 341 A C H 3< S+ 0 0 0 -4,-1.5 -1,-0.2 1,-0.2 -61,-0.2 0.758 108.7 54.1 -79.2 -28.5 42.2 33.8 20.0 252 342 A L T 3< + 0 0 2 -4,-2.0 2,-0.3 -3,-0.3 -1,-0.2 0.072 69.6 132.6-103.4 24.8 39.2 35.4 18.4 253 343 A I < - 0 0 35 -3,-0.5 6,-0.2 1,-0.1 -66,-0.1 -0.590 54.3-139.9 -74.6 130.7 39.0 33.3 15.2 254 344 A K S S+ 0 0 63 -2,-0.3 -81,-0.2 4,-0.1 -1,-0.1 0.880 84.9 76.0 -64.0 -38.0 35.4 32.2 14.8 255 345 A N S > S- 0 0 81 1,-0.2 4,-2.4 -83,-0.1 3,-0.2 -0.661 74.7-150.2 -78.3 119.7 36.2 28.7 13.6 256 346 A P T 4 S+ 0 0 42 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.757 93.8 51.1 -65.4 -26.3 37.2 26.7 16.7 257 347 A A T 4 S+ 0 0 92 1,-0.2 4,-0.1 -3,-0.0 -2,-0.0 0.864 114.4 42.4 -78.8 -36.6 39.6 24.4 14.8 258 348 A E T 4 S+ 0 0 145 -3,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.834 96.4 97.1 -73.4 -35.2 41.5 27.3 13.1 259 349 A R S < S- 0 0 4 -4,-2.4 -8,-0.2 -6,-0.2 -9,-0.1 -0.161 90.2 -96.8 -49.5 149.9 41.5 29.2 16.4 260 350 A A - 0 0 3 -10,-2.2 2,-0.2 -13,-0.1 -1,-0.1 -0.383 38.8-143.2 -68.4 150.4 44.8 28.9 18.3 261 351 A D >> - 0 0 54 -3,-0.1 4,-2.3 -4,-0.1 3,-1.1 -0.615 30.6 -91.7-107.9 176.0 45.0 26.3 21.1 262 352 A L H 3> S+ 0 0 13 1,-0.3 4,-1.9 2,-0.2 -144,-0.1 0.881 123.0 53.3 -52.6 -43.9 46.8 26.4 24.5 263 353 A K H 34 S+ 0 0 154 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.779 111.7 44.7 -70.3 -21.1 49.9 24.7 23.1 264 354 A Q H <4 S+ 0 0 110 -3,-1.1 3,-0.5 2,-0.2 -1,-0.2 0.825 111.8 50.5 -88.0 -35.5 50.3 27.3 20.3 265 355 A L H >< S+ 0 0 1 -4,-2.3 3,-1.6 1,-0.2 6,-0.3 0.823 100.5 65.3 -68.5 -32.5 49.6 30.3 22.4 266 356 A M T 3< S+ 0 0 51 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.809 110.3 37.2 -58.6 -30.5 52.2 29.1 25.0 267 357 A V T 3 S+ 0 0 100 -3,-0.5 -1,-0.3 -4,-0.4 -2,-0.2 0.163 91.0 129.7-109.9 18.1 54.9 29.6 22.4 268 358 A H X> - 0 0 23 -3,-1.6 4,-2.6 1,-0.1 3,-0.9 -0.467 69.9-116.8 -72.6 144.4 53.4 32.8 20.8 269 359 A A H 3> S+ 0 0 35 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.802 114.9 56.3 -46.7 -38.7 55.6 35.9 20.4 270 360 A F H 3> S+ 0 0 0 -27,-0.4 4,-2.8 2,-0.2 -1,-0.3 0.877 112.8 40.8 -68.1 -35.7 53.5 37.9 22.8 271 361 A I H <> S+ 0 0 0 -3,-0.9 4,-3.4 -6,-0.3 5,-0.3 0.941 112.1 53.1 -76.3 -52.2 54.0 35.3 25.6 272 362 A K H X S+ 0 0 135 -4,-2.6 4,-1.3 2,-0.2 -2,-0.2 0.963 115.9 43.8 -42.8 -58.1 57.8 34.7 24.8 273 363 A R H >X S+ 0 0 67 -4,-2.6 4,-1.2 -5,-0.2 3,-0.8 0.955 116.4 43.4 -53.3 -57.6 58.1 38.5 25.1 274 364 A S H 3< S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.839 107.2 62.5 -64.3 -28.1 55.9 39.0 28.3 275 365 A D H 3< S+ 0 0 92 -4,-3.4 -1,-0.3 1,-0.2 -2,-0.2 0.885 105.4 46.4 -64.5 -35.0 57.6 36.0 29.8 276 366 A A H << S+ 0 0 88 -4,-1.3 -1,-0.2 -3,-0.8 -2,-0.2 0.807 91.4 106.8 -69.1 -31.3 61.0 37.8 29.7 277 367 A E < - 0 0 42 -4,-1.2 2,-1.1 1,-0.1 -3,-0.0 -0.168 66.5-138.7 -68.9 138.8 59.6 41.1 31.1 278 368 A E + 0 0 207 2,-0.1 2,-0.5 0, 0.0 -1,-0.1 -0.832 38.1 170.4 -92.4 97.7 60.4 42.2 34.7 279 369 A V - 0 0 33 -2,-1.1 2,-1.5 -5,-0.1 3,-0.2 -0.948 35.6-142.6-117.0 129.5 57.1 43.5 35.6 280 370 A D > + 0 0 114 -2,-0.5 4,-2.8 1,-0.2 5,-0.2 -0.537 33.1 163.0 -90.0 69.7 56.1 44.6 39.1 281 371 A F H > S+ 0 0 12 -2,-1.5 4,-2.4 1,-0.2 5,-0.2 0.938 74.8 53.4 -53.6 -50.2 52.6 43.3 39.0 282 372 A A H > S+ 0 0 29 -3,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.925 112.3 44.0 -45.3 -54.3 52.4 43.4 42.8 283 373 A G H > S+ 0 0 22 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.842 113.2 51.6 -66.6 -36.7 53.5 47.1 42.9 284 374 A W H X S+ 0 0 47 -4,-2.8 4,-1.5 2,-0.2 -1,-0.2 0.853 106.0 54.2 -64.8 -38.5 51.2 48.0 40.0 285 375 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.2 5,-0.2 0.890 113.7 40.6 -71.0 -37.9 48.1 46.5 41.6 286 376 A C H X S+ 0 0 32 -4,-1.6 4,-2.8 -5,-0.2 -2,-0.2 0.952 110.0 57.6 -76.1 -47.2 48.5 48.4 44.8 287 377 A S H < S+ 0 0 110 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.808 117.5 37.3 -48.2 -31.9 49.5 51.7 43.0 288 378 A T H < S+ 0 0 45 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.812 131.0 23.4 -93.5 -32.0 46.1 51.4 41.2 289 379 A I H < S- 0 0 51 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.2 0.686 106.5 -98.5-113.0 -19.7 43.8 50.0 43.9 290 380 A G < 0 0 63 -4,-2.8 -3,-0.1 -5,-0.2 -4,-0.1 0.912 360.0 360.0 102.8 62.7 45.1 50.9 47.3 291 381 A L 0 0 117 -5,-0.2 -5,-0.1 -151,-0.0 -4,-0.1 0.467 360.0 360.0-133.0 360.0 47.1 48.2 49.3