==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-APR-12 4EKL . COMPND 2 MOLECULE: RAC-ALPHA SERINE/THREONINE-PROTEIN KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.-I.WU,G.P.A VIGERS,T.H.MORALES,B.J.BRANDHUBER . 330 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16253.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 207 62.7 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 . 48 14.5 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 . 3 0.9 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 . 24 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 3 1 0 1 0 2 0 0 1 0 1 0 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 . 3 0 2 0 1 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 . 0 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 1 144 A R 0 0 221 0, 0.0 2,-0.3 0, 0.0 325,-0.0 0.000 360.0 360.0 360.0 108.4 22.4 -7.7 -10.2 2 145 A V + 0 0 25 71,-0.1 2,-0.2 3,-0.0 71,-0.0 -0.723 360.0 164.1 -99.6 135.3 24.5 -5.2 -8.1 3 146 A T > - 0 0 44 -2,-0.3 3,-1.4 71,-0.1 4,-0.1 -0.761 54.9 -89.0-129.0 179.3 28.4 -5.1 -7.5 4 147 A M G > S+ 0 0 29 1,-0.3 3,-1.4 -2,-0.2 72,-0.0 0.809 121.1 66.5 -58.6 -34.4 31.0 -2.5 -6.2 5 148 A N G 3 S+ 0 0 121 1,-0.3 -1,-0.3 3,-0.0 22,-0.1 0.635 86.2 70.1 -61.2 -23.7 31.4 -1.2 -9.8 6 149 A E G < S+ 0 0 65 -3,-1.4 21,-2.5 21,-0.1 22,-0.5 0.502 94.7 65.4 -75.0 -3.0 27.8 0.1 -9.8 7 150 A F E < -A 26 0A 3 -3,-1.4 2,-0.5 19,-0.2 19,-0.2 -0.877 69.4-138.3-126.2 150.9 28.7 2.9 -7.3 8 151 A E E -A 25 0A 90 17,-2.4 17,-2.3 -2,-0.3 2,-0.6 -0.944 26.3-136.9-103.7 130.6 30.8 6.1 -7.2 9 152 A Y E +A 24 0A 52 -2,-0.5 15,-0.2 15,-0.2 295,-0.1 -0.813 32.8 166.4 -96.6 115.8 32.6 6.3 -3.8 10 153 A L E - 0 0 49 13,-3.0 2,-0.3 -2,-0.6 -1,-0.2 0.919 49.6 -6.1-103.4 -56.4 32.4 9.9 -2.6 11 154 A K E -A 23 0A 62 12,-1.0 12,-3.0 292,-0.1 2,-0.5 -0.997 60.4-113.0-148.8 142.6 33.3 10.6 1.0 12 155 A L E -A 22 0A 6 290,-0.4 10,-0.2 287,-0.4 290,-0.2 -0.698 29.3-177.6 -73.0 122.0 34.2 8.6 4.1 13 156 A L E - 0 0 13 8,-3.0 2,-0.3 -2,-0.5 283,-0.3 0.789 59.0 -36.6 -92.4 -31.9 31.3 9.2 6.6 14 157 A G E -A 21 0A 16 7,-1.4 7,-2.7 285,-0.2 -1,-0.4 -0.965 43.8-130.9-178.6 166.2 32.8 7.2 9.5 15 158 A K E -A 20 0A 108 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.989 23.3-176.0-132.0 137.7 34.8 4.2 10.7 16 159 A G - 0 0 55 3,-2.4 3,-0.2 -2,-0.4 -2,-0.0 -0.460 48.3 -80.0-116.9-168.6 33.7 1.8 13.4 17 160 A T S S+ 0 0 114 1,-0.2 3,-0.0 -2,-0.2 -2,-0.0 0.900 126.3 30.8 -65.0 -38.8 35.5 -1.1 15.1 18 161 A F S S- 0 0 67 20,-0.0 21,-0.7 30,-0.0 2,-0.3 0.420 125.7 -35.4-105.7 0.3 34.7 -3.6 12.2 19 162 A G E - B 0 38A 29 -3,-0.2 -3,-2.4 19,-0.2 2,-0.3 -0.957 61.9 -79.5 174.1-157.8 34.5 -1.5 9.1 20 163 A K E -AB 15 37A 24 17,-2.3 17,-3.6 -2,-0.3 2,-0.4 -0.934 16.5-138.1-141.3 159.2 33.7 1.7 7.3 21 164 A V E -AB 14 36A 42 -7,-2.7 -8,-3.0 -2,-0.3 -7,-1.4 -0.986 20.9-170.7-122.3 126.0 30.8 3.7 5.9 22 165 A I E -AB 12 35A 5 13,-2.6 13,-3.3 -2,-0.4 2,-0.5 -0.925 27.3-123.6-117.1 133.9 31.1 5.6 2.5 23 166 A L E -AB 11 34A 0 -12,-3.0 -13,-3.0 -2,-0.4 -12,-1.0 -0.701 45.5-177.7 -67.6 120.3 28.7 8.2 0.9 24 167 A V E -AB 9 33A 0 9,-2.9 9,-2.2 -2,-0.5 2,-0.5 -0.847 26.0-144.5-121.8 159.7 28.1 6.5 -2.5 25 168 A K E -AB 8 32A 51 -17,-2.3 -17,-2.4 -2,-0.3 2,-0.6 -0.998 21.4-130.8-118.8 128.3 26.1 7.4 -5.6 26 169 A E E >>> -AB 7 31A 11 5,-3.2 4,-2.6 -2,-0.5 3,-0.6 -0.683 20.0-149.9 -72.9 119.1 24.5 4.7 -7.5 27 170 A K T 345S+ 0 0 117 -21,-2.5 -1,-0.2 -2,-0.6 -20,-0.1 0.911 89.0 53.0 -64.4 -44.2 25.7 5.5 -11.1 28 171 A A T 345S+ 0 0 92 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.815 124.4 23.6 -59.4 -32.4 22.6 4.1 -13.0 29 172 A T T <45S- 0 0 58 -3,-0.6 -1,-0.2 2,-0.1 -2,-0.2 0.586 92.9-125.2-116.1 -18.2 20.1 6.1 -11.0 30 173 A G T <5 + 0 0 31 -4,-2.6 2,-0.2 1,-0.3 -3,-0.1 0.551 62.1 143.8 79.5 6.3 21.9 9.2 -9.5 31 174 A R E < -B 26 0A 133 -5,-0.5 -5,-3.2 -6,-0.0 2,-0.4 -0.556 44.3-135.4 -86.8 145.1 20.7 8.2 -6.0 32 175 A Y E +B 25 0A 66 -7,-0.2 54,-0.6 -2,-0.2 2,-0.3 -0.824 29.3 164.1-103.7 138.2 22.8 8.7 -2.9 33 176 A Y E -BC 24 85A 22 -9,-2.2 -9,-2.9 -2,-0.4 2,-0.6 -0.882 39.3-114.0-139.2 164.2 23.3 6.0 -0.2 34 177 A A E -BC 23 84A 10 50,-2.6 50,-2.6 -2,-0.3 2,-0.7 -0.957 32.0-155.7 -99.7 116.2 25.5 5.2 2.8 35 178 A M E -BC 22 83A 0 -13,-3.3 -13,-2.6 -2,-0.6 2,-0.5 -0.845 2.3-156.3 -97.2 113.5 27.4 2.1 2.0 36 179 A K E -BC 21 82A 31 46,-2.9 46,-2.6 -2,-0.7 2,-0.5 -0.772 14.7-165.1 -83.7 125.0 28.6 0.1 5.1 37 180 A I E -BC 20 81A 11 -17,-3.6 -17,-2.3 -2,-0.5 2,-0.4 -0.964 7.7-176.3-122.1 119.7 31.6 -2.0 4.0 38 181 A L E -BC 19 80A 9 42,-2.9 42,-2.6 -2,-0.5 2,-0.5 -0.950 25.4-128.1-112.5 139.8 32.9 -4.9 6.2 39 182 A K E > - C 0 79A 72 -21,-0.7 4,-2.4 -2,-0.4 3,-0.3 -0.762 13.1-146.1 -82.4 123.2 36.0 -7.1 5.5 40 183 A K H > S+ 0 0 1 38,-2.0 4,-2.7 -2,-0.5 5,-0.2 0.889 100.0 56.1 -51.7 -42.3 35.0 -10.8 5.8 41 184 A E H > S+ 0 0 70 37,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.847 108.9 45.1 -61.2 -40.9 38.4 -11.5 7.2 42 185 A V H > S+ 0 0 47 -3,-0.3 4,-2.1 2,-0.2 6,-0.2 0.940 112.2 50.8 -73.5 -46.5 37.9 -9.0 10.0 43 186 A I H <>S+ 0 0 1 -4,-2.4 5,-2.8 2,-0.2 6,-0.6 0.902 114.7 44.5 -52.4 -50.8 34.4 -10.2 10.9 44 187 A V H ><5S+ 0 0 27 -4,-2.7 3,-1.4 274,-0.3 -2,-0.2 0.958 114.5 48.1 -56.9 -55.8 35.5 -13.8 11.0 45 188 A A H 3<5S+ 0 0 55 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.769 115.3 44.2 -60.4 -30.5 38.7 -13.0 13.1 46 189 A K T 3<5S- 0 0 119 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.268 111.6-116.8 -98.7 7.1 36.7 -10.8 15.6 47 190 A D T < 5S+ 0 0 139 -3,-1.4 3,-0.3 -4,-0.2 4,-0.3 0.769 75.7 131.3 62.4 33.7 33.8 -13.3 16.0 48 191 A E >< + 0 0 34 -5,-2.8 4,-2.1 -6,-0.2 -4,-0.2 0.236 34.8 101.2-101.3 11.7 31.4 -10.8 14.5 49 192 A V H > S+ 0 0 42 -6,-0.6 4,-2.3 1,-0.2 5,-0.2 0.932 80.0 47.8 -64.0 -53.0 29.9 -13.1 12.0 50 193 A A H > S+ 0 0 67 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.886 113.9 47.6 -58.7 -42.2 26.7 -13.9 14.0 51 194 A H H > S+ 0 0 55 -4,-0.3 4,-3.1 2,-0.2 -1,-0.2 0.891 110.4 52.9 -62.3 -41.3 26.0 -10.1 14.7 52 195 A T H X S+ 0 0 9 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.928 111.6 45.1 -64.3 -45.5 26.6 -9.2 11.0 53 196 A L H X S+ 0 0 33 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.850 112.3 52.1 -67.9 -37.3 24.1 -11.9 9.8 54 197 A T H X S+ 0 0 16 -4,-2.1 4,-3.0 -5,-0.2 5,-0.3 0.951 109.9 48.5 -60.8 -47.5 21.6 -10.7 12.5 55 198 A E H X S+ 0 0 7 -4,-3.1 4,-2.9 1,-0.2 5,-0.3 0.960 112.7 49.4 -58.6 -46.7 22.0 -7.1 11.2 56 199 A N H X S+ 0 0 1 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.938 114.1 45.3 -53.7 -51.7 21.5 -8.3 7.7 57 200 A R H X S+ 0 0 77 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.921 113.1 47.8 -60.1 -47.7 18.4 -10.3 8.7 58 201 A V H X S+ 0 0 5 -4,-3.0 4,-0.7 1,-0.2 -1,-0.2 0.904 111.6 50.6 -67.8 -40.6 16.8 -7.6 10.8 59 202 A L H >< S+ 0 0 1 -4,-2.9 3,-0.7 -5,-0.3 11,-0.4 0.922 112.1 47.8 -60.2 -43.7 17.3 -5.0 8.1 60 203 A Q H 3< S+ 0 0 33 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.862 115.8 45.0 -64.9 -30.2 15.7 -7.2 5.4 61 204 A N H 3< S+ 0 0 105 -4,-1.8 2,-0.4 -5,-0.2 -1,-0.2 0.474 103.0 73.7 -95.7 -3.3 12.7 -8.1 7.6 62 205 A S << + 0 0 6 -4,-0.7 2,-0.4 -3,-0.7 59,-0.0 -0.890 43.7 176.7-122.6 145.1 11.9 -4.6 9.0 63 206 A R + 0 0 113 -2,-0.4 5,-0.1 6,-0.1 6,-0.1 -0.923 25.5 143.3-145.2 106.9 10.2 -1.5 7.4 64 207 A H > - 0 0 15 3,-0.4 3,-1.5 -2,-0.4 53,-0.1 -0.984 55.9-123.7-148.7 143.2 9.7 1.4 9.8 65 208 A P T 3 S+ 0 0 25 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.784 113.1 43.2 -57.6 -26.6 9.9 5.2 9.4 66 209 A F T 3 S+ 0 0 0 47,-0.1 81,-2.5 80,-0.1 2,-0.4 0.272 97.8 82.1-111.3 17.9 12.5 5.4 12.2 67 210 A L B < S-f 147 0B 5 -3,-1.5 -3,-0.4 79,-0.2 81,-0.2 -0.954 92.4-101.7-115.4 136.3 14.7 2.4 11.4 68 211 A T - 0 0 9 79,-2.2 2,-0.4 -2,-0.4 -2,-0.1 -0.369 40.0-129.6 -58.4 125.7 17.4 2.8 8.7 69 212 A A - 0 0 31 -4,-0.1 16,-2.4 -2,-0.1 2,-0.5 -0.686 11.7-141.1 -85.3 131.3 16.2 1.3 5.4 70 213 A L E +D 84 0A 3 -2,-0.4 14,-0.3 -11,-0.4 3,-0.1 -0.792 19.3 178.8 -91.9 128.7 18.4 -1.2 3.6 71 214 A K E - 0 0 51 12,-3.4 258,-3.1 -2,-0.5 2,-0.3 0.879 67.4 -2.3 -93.6 -51.5 18.4 -0.9 -0.3 72 215 A Y E -DE 83 328A 19 11,-1.3 11,-3.2 256,-0.2 -1,-0.4 -0.975 51.0-167.6-136.3 146.4 20.9 -3.7 -1.2 73 216 A S E +DE 82 327A 1 254,-1.8 254,-1.7 -2,-0.3 2,-0.3 -0.982 26.8 150.5-128.9 138.1 23.2 -6.2 0.5 74 217 A F E -DE 81 326A 8 7,-1.8 7,-3.3 -2,-0.4 2,-0.3 -0.937 27.4-140.4-156.7 167.3 25.8 -8.0 -1.5 75 218 A Q E -D 80 0A 23 250,-0.5 5,-0.2 -2,-0.3 2,-0.2 -0.940 4.2-160.8-138.6 152.1 29.2 -9.5 -1.1 76 219 A T - 0 0 37 3,-2.5 236,-0.0 -2,-0.3 5,-0.0 -0.566 52.5 -83.5-115.9-171.2 32.4 -9.9 -2.9 77 220 A H S S+ 0 0 69 -2,-0.2 3,-0.0 1,-0.2 235,-0.0 0.854 130.1 18.6 -66.4 -31.4 35.1 -12.4 -2.3 78 221 A D S S+ 0 0 23 -38,-0.1 -38,-2.0 -39,-0.0 -37,-0.4 0.476 119.5 60.5-117.3 -2.2 36.5 -10.3 0.5 79 222 A R E -C 39 0A 24 -40,-0.2 -3,-2.5 -39,-0.1 2,-0.5 -0.908 52.1-151.7-134.0 152.3 33.7 -7.8 1.5 80 223 A L E -CD 38 75A 0 -42,-2.6 -42,-2.9 -2,-0.3 2,-0.5 -0.997 24.6-161.6-117.6 131.7 30.2 -7.5 2.8 81 224 A C E -CD 37 74A 0 -7,-3.3 -7,-1.8 -2,-0.5 2,-0.6 -0.957 13.5-171.3-124.1 119.1 28.3 -4.4 1.6 82 225 A F E -CD 36 73A 0 -46,-2.6 -46,-2.9 -2,-0.5 2,-0.8 -0.957 9.4-162.8-104.8 117.5 25.2 -2.9 3.1 83 226 A V E +CD 35 72A 0 -11,-3.2 -12,-3.4 -2,-0.6 -11,-1.3 -0.860 24.7 166.5-101.8 110.1 23.7 -0.1 0.9 84 227 A M E -CD 34 70A 14 -50,-2.6 -50,-2.6 -2,-0.8 -14,-0.2 -0.733 44.1 -77.0-119.4 166.0 21.4 1.9 3.1 85 228 A E E -C 33 0A 65 -16,-2.4 2,-0.6 -2,-0.2 -52,-0.2 -0.353 53.1-114.2 -59.0 144.1 19.6 5.2 3.0 86 229 A Y - 0 0 13 -54,-0.6 2,-1.2 -62,-0.1 55,-0.4 -0.735 17.8-145.0 -82.9 119.2 22.0 8.1 3.7 87 230 A A > - 0 0 9 -2,-0.6 3,-1.8 1,-0.2 52,-0.2 -0.729 18.1-172.9 -89.5 93.4 21.1 9.8 7.1 88 231 A N T 3 S+ 0 0 20 -2,-1.2 206,-0.4 1,-0.3 52,-0.2 0.661 74.9 66.6 -64.5 -25.1 22.1 13.3 6.0 89 232 A G T 3 S- 0 0 0 50,-1.8 -1,-0.3 1,-0.2 51,-0.2 0.447 97.3-143.4 -77.9 -2.0 21.6 14.8 9.5 90 233 A G < - 0 0 0 -3,-1.8 49,-2.1 49,-0.4 -1,-0.2 -0.082 42.9 -26.5 67.5-168.4 24.5 12.8 10.9 91 234 A E B >> -G 138 0B 74 203,-0.5 3,-0.9 47,-0.2 4,-0.8 -0.515 56.3-124.7 -77.6 143.8 24.7 11.2 14.4 92 235 A L H 3> S+ 0 0 0 45,-2.8 4,-2.9 42,-0.4 3,-0.3 0.796 109.6 66.8 -59.6 -31.4 22.7 12.8 17.2 93 236 A F H 3> S+ 0 0 119 44,-0.4 4,-3.4 41,-0.3 5,-0.3 0.874 91.0 61.3 -54.5 -42.3 25.9 13.1 19.2 94 237 A F H <> S+ 0 0 25 -3,-0.9 4,-1.2 1,-0.2 -1,-0.2 0.925 114.4 36.0 -48.6 -49.6 27.3 15.6 16.6 95 238 A H H X S+ 0 0 5 -4,-0.8 4,-2.4 -3,-0.3 -2,-0.2 0.933 117.5 48.5 -72.0 -49.2 24.3 17.8 17.6 96 239 A L H X S+ 0 0 11 -4,-2.9 4,-1.7 1,-0.2 -2,-0.2 0.878 108.8 56.0 -66.6 -41.2 24.1 17.1 21.3 97 240 A S H < S+ 0 0 55 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.900 113.2 41.0 -37.8 -58.9 27.9 17.7 21.7 98 241 A R H < S+ 0 0 155 -4,-1.2 -2,-0.2 -5,-0.3 -1,-0.2 0.844 122.2 37.8 -72.3 -38.5 27.7 21.1 20.2 99 242 A E H < S- 0 0 83 -4,-2.4 2,-1.9 1,-0.1 -1,-0.2 0.531 90.2-146.8 -97.4 -7.7 24.5 22.2 21.9 100 243 A R S < S+ 0 0 167 -4,-1.7 2,-0.3 -5,-0.2 -1,-0.1 -0.359 74.0 19.4 79.1 -52.1 25.2 20.5 25.3 101 244 A V S S- 0 0 39 -2,-1.9 2,-0.3 100,-0.1 99,-0.2 -0.965 71.4-132.9-146.9 142.1 21.5 19.7 26.0 102 245 A F - 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0 0 82 -4,-2.1 2,-0.1 -5,-0.4 3,-0.1 -0.591 68.3-126.1 -84.4 127.4 23.0 4.3 42.8 222 365 A E - 0 0 159 -2,-0.4 -1,-0.1 1,-0.1 -2,-0.1 -0.417 36.2-104.0 -63.7 137.9 19.7 6.1 42.8 223 366 A I - 0 0 23 18,-0.2 2,-0.3 15,-0.1 -1,-0.1 -0.325 38.2-166.5 -56.9 138.8 19.2 8.4 39.6 224 367 A R - 0 0 177 -19,-0.2 3,-0.0 -3,-0.1 -3,-0.0 -0.949 2.0-155.6-126.8 159.6 19.7 12.1 40.1 225 368 A F - 0 0 21 -2,-0.3 -24,-0.0 4,-0.1 9,-0.0 -0.951 31.6 -96.9-129.4 143.7 18.7 15.1 37.8 226 369 A P > - 0 0 32 0, 0.0 3,-1.8 0, 0.0 0, 0.0 -0.370 43.5-120.0 -52.3 142.5 19.9 18.6 37.3 227 370 A R T 3 S+ 0 0 235 1,-0.3 0, 0.0 -3,-0.0 0, 0.0 0.499 108.9 68.7 -77.4 -2.0 17.4 20.7 39.3 228 371 A T T 3 S+ 0 0 134 2,-0.1 -1,-0.3 0, 0.0 2,-0.1 0.633 75.3 113.4 -78.4 -14.8 16.3 22.7 36.2 229 372 A L S < S- 0 0 12 -3,-1.8 -4,-0.1 1,-0.1 -28,-0.0 -0.360 73.1-117.1 -65.3 134.2 14.6 19.4 34.9 230 373 A G > - 0 0 13 1,-0.1 4,-2.1 -2,-0.1 5,-0.2 -0.238 22.2-112.4 -68.3 158.6 10.9 19.7 34.8 231 374 A P H > S+ 0 0 89 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.839 113.7 49.6 -64.2 -38.6 8.7 17.3 36.9 232 375 A E H > S+ 0 0 78 2,-0.2 4,-2.7 1,-0.2 32,-0.3 0.885 111.8 48.6 -70.0 -40.0 7.2 15.2 34.1 233 376 A A H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.910 112.7 48.8 -61.9 -45.6 10.7 14.6 32.5 234 377 A K H X S+ 0 0 65 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.877 111.4 49.9 -62.2 -41.5 12.0 13.6 35.9 235 378 A S H X S+ 0 0 37 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.944 113.0 46.2 -62.2 -47.6 9.0 11.3 36.4 236 379 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.960 115.8 44.7 -59.5 -54.3 9.5 9.7 32.9 237 380 A L H X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.865 112.9 50.5 -61.3 -43.3 13.3 9.2 33.3 238 381 A S H < S+ 0 0 35 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.862 112.5 48.2 -60.6 -40.3 12.9 7.9 36.9 239 382 A G H >< S+ 0 0 13 -4,-2.2 10,-2.6 1,-0.2 3,-0.9 0.868 113.9 45.9 -66.7 -41.0 10.3 5.4 35.7 240 383 A L H 3< S+ 0 0 0 -4,-2.4 -47,-0.3 1,-0.2 -2,-0.2 0.801 113.4 50.8 -71.5 -27.6 12.6 4.3 32.7 241 384 A L T 3< S+ 0 0 7 -4,-1.8 -1,-0.2 -5,-0.2 2,-0.2 0.105 73.6 136.6-105.3 20.9 15.6 4.0 34.9 242 385 A K < - 0 0 88 -3,-0.9 6,-0.1 1,-0.1 -3,-0.1 -0.496 53.9-138.6 -55.8 135.3 14.1 1.8 37.7 243 386 A K S S+ 0 0 54 -2,-0.2 -67,-0.3 -68,-0.1 -1,-0.1 0.857 88.8 68.1 -69.4 -36.4 16.7 -0.9 38.5 244 387 A D S >> S- 0 0 45 1,-0.2 3,-1.5 -69,-0.1 4,-0.9 -0.769 75.6-150.6 -90.4 117.1 14.1 -3.6 38.7 245 388 A P T 34 S+ 0 0 32 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.829 96.4 61.0 -61.7 -26.8 12.7 -4.3 35.2 246 389 A K T 34 S+ 0 0 166 1,-0.2 4,-0.1 -3,-0.1 5,-0.1 0.795 110.7 40.2 -66.7 -27.3 9.4 -5.4 36.8 247 390 A Q T <4 S+ 0 0 136 -3,-1.5 -1,-0.2 2,-0.1 2,-0.1 0.504 96.1 107.6 -93.6 -4.9 9.0 -1.9 38.3 248 391 A R S >< S- 0 0 2 -4,-0.9 3,-2.5 -3,-0.5 4,-0.2 -0.416 83.8-100.3 -75.7 144.3 10.3 -0.0 35.2 249 392 A L T 3 S+ 0 0 22 -10,-2.6 -1,-0.1 1,-0.3 -2,-0.1 -0.470 116.4 19.8 -59.5 130.2 8.1 2.0 32.9 250 393 A G T 3 S+ 0 0 1 5,-0.2 -1,-0.3 -2,-0.1 6,-0.1 0.420 95.9 111.0 82.2 2.0 7.4 -0.4 30.0 251 394 A G < + 0 0 25 -3,-2.5 -65,-0.2 -7,-0.1 -2,-0.1 0.527 61.7 70.5 -86.9 -4.8 8.4 -3.4 32.0 252 395 A G S > S- 0 0 33 -4,-0.2 3,-1.2 3,-0.2 6,-0.1 -0.111 106.2 -75.4-100.0-164.3 5.0 -5.0 32.3 253 396 A S T 3 S+ 0 0 107 1,-0.2 -94,-0.1 2,-0.1 -1,-0.0 0.782 125.0 62.8 -69.6 -22.7 2.7 -6.8 29.9 254 397 A E T > S- 0 0 111 1,-0.2 3,-2.0 2,-0.1 -1,-0.2 0.630 80.6-179.2 -77.5 -12.4 1.7 -3.5 28.1 255 398 A D T X> + 0 0 4 -3,-1.2 3,-1.4 1,-0.3 4,-0.6 -0.196 67.9 5.9 53.5-126.0 5.3 -2.8 27.0 256 399 A A H >> S+ 0 0 0 1,-0.3 4,-2.9 2,-0.2 3,-0.7 0.739 119.5 73.6 -57.2 -28.6 5.6 0.5 25.1 257 400 A K H <> S+ 0 0 73 -3,-2.0 4,-1.8 1,-0.3 -1,-0.3 0.835 91.8 57.7 -58.7 -32.7 1.9 1.5 25.8 258 401 A E H <4 S+ 0 0 72 -3,-1.4 -1,-0.3 2,-0.2 4,-0.2 0.861 111.3 41.2 -64.8 -37.6 2.9 2.2 29.4 259 402 A I H X< S+ 0 0 0 -3,-0.7 3,-1.4 -4,-0.6 6,-0.3 0.907 110.6 57.4 -74.5 -43.7 5.5 4.8 28.1 260 403 A M H 3< S+ 0 0 27 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.831 109.2 46.6 -54.4 -36.1 3.1 6.1 25.4 261 404 A Q T 3< S+ 0 0 146 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.464 83.2 118.3 -87.8 -3.7 0.6 7.0 28.1 262 405 A H S X S- 0 0 19 -3,-1.4 3,-1.8 -4,-0.2 -3,-0.1 -0.366 77.2-118.3 -61.8 144.2 3.0 8.6 30.5 263 406 A R G > S+ 0 0 135 1,-0.3 3,-1.8 2,-0.2 -1,-0.1 0.721 109.6 72.6 -64.4 -18.9 2.1 12.3 31.1 264 407 A F G 3 S+ 0 0 4 -32,-0.3 -1,-0.3 1,-0.3 -31,-0.1 0.887 103.4 43.9 -56.1 -36.5 5.5 13.4 29.6 265 408 A F G X S+ 0 0 3 -3,-1.8 3,-2.1 -6,-0.3 -1,-0.3 0.195 84.4 142.8 -93.2 17.1 4.0 12.4 26.3 266 409 A A T < S+ 0 0 72 -3,-1.8 3,-0.1 1,-0.3 -3,-0.1 -0.250 70.9 21.3 -58.9 138.5 0.5 14.0 27.0 267 410 A G T 3 S+ 0 0 82 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.257 91.7 127.2 87.2 -19.2 -1.0 15.5 23.8 268 411 A I < - 0 0 35 -3,-2.1 2,-0.7 -8,-0.1 -1,-0.3 -0.623 51.6-149.6 -74.0 128.4 1.2 13.3 21.5 269 412 A V > - 0 0 71 -2,-0.4 4,-1.5 1,-0.1 3,-0.5 -0.895 5.2-155.1 -98.8 114.0 -0.9 11.5 19.0 270 413 A W H > S+ 0 0 50 -2,-0.7 4,-2.1 1,-0.3 -1,-0.1 0.782 90.7 55.2 -70.5 -28.9 1.0 8.2 18.3 271 414 A Q H > S+ 0 0 109 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.860 108.1 51.3 -67.5 -32.8 -0.4 7.6 14.8 272 415 A H H 4>S+ 0 0 81 -3,-0.5 5,-2.6 2,-0.2 6,-0.5 0.854 106.4 53.6 -72.3 -33.5 0.9 11.0 13.9 273 416 A V H ><5S+ 0 0 1 -4,-1.5 3,-1.9 1,-0.2 5,-0.2 0.975 110.4 48.1 -58.8 -55.0 4.4 10.2 15.3 274 417 A Y H 3<5S+ 0 0 97 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.835 111.4 49.3 -53.3 -37.8 4.4 7.1 13.1 275 418 A E T 3<5S- 0 0 88 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.348 112.0-117.7 -89.1 3.5 3.3 9.1 10.0 276 419 A K T < 5S+ 0 0 70 -3,-1.9 -3,-0.2 -4,-0.2 -2,-0.1 0.788 70.2 139.0 65.4 31.1 5.9 11.8 10.5 277 420 A K < + 0 0 128 -5,-2.6 2,-0.6 -6,-0.2 -4,-0.2 0.406 43.5 90.9 -86.4 0.0 3.2 14.4 11.0 278 421 A L S S- 0 0 40 -6,-0.5 -10,-0.0 -5,-0.2 0, 0.0 -0.871 84.6-124.3 -95.6 123.2 5.1 16.1 13.9 279 422 A S - 0 0 109 -2,-0.6 -2,-0.1 1,-0.1 -136,-0.1 -0.529 27.4-116.2 -67.2 123.4 7.4 18.8 12.5 280 423 A P - 0 0 12 0, 0.0 -136,-0.1 0, 0.0 3,-0.1 -0.316 13.3-137.2 -56.5 140.0 11.0 18.1 13.6 281 424 A P S S+ 0 0 72 0, 0.0 2,-0.4 0, 0.0 -175,-0.1 0.758 93.4 41.9 -72.4 -17.8 12.3 20.9 15.9 282 425 A F S S- 0 0 39 -139,-0.2 0, 0.0 -176,-0.1 0, 0.0 -0.981 70.2-163.5-131.0 125.5 15.6 20.9 14.0 283 426 A K - 0 0 93 -2,-0.4 -140,-0.1 -3,-0.1 -141,-0.1 -0.920 30.7-116.4-105.3 122.0 15.9 20.6 10.2 284 427 A P - 0 0 9 0, 0.0 2,-0.7 0, 0.0 -195,-0.1 -0.407 20.7-141.9 -56.3 130.7 19.3 19.6 8.9 285 428 A Q + 0 0 122 -2,-0.1 2,-0.2 -196,-0.1 8,-0.0 -0.335 41.0 155.1 -95.6 51.1 20.6 22.5 6.8 286 429 A V - 0 0 36 -2,-0.7 3,-0.1 -145,-0.2 -197,-0.0 -0.552 29.6-162.3 -76.3 143.2 22.3 20.5 4.1 287 430 A T + 0 0 121 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.519 68.6 25.2-109.5 -8.7 22.6 22.3 0.8 288 431 A S S > S- 0 0 53 1,-0.0 3,-0.8 0, 0.0 -1,-0.1 -0.940 81.4-106.7-145.8 170.8 23.2 19.4 -1.5 289 432 A E T 3 S+ 0 0 129 -2,-0.3 -1,-0.0 1,-0.2 -3,-0.0 0.601 124.3 42.4 -71.1 -15.8 22.6 15.7 -1.7 290 433 A T T 3 S+ 0 0 45 -267,-0.0 -1,-0.2 -280,-0.0 2,-0.2 0.221 79.8 130.1-111.7 6.8 26.4 15.2 -0.9 291 434 A D < - 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