==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 17-OCT-08 2W1G . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE 6; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.HOWARD,V.BERDINI,J.A.BOULSTRIDGE,M.G.CARR,D.M.CROSS, . 254 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12985.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 14.2 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 16 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 29.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 3 0 1 1 1 0 1 0 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 . 2 0 1 0 3 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 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 1 127 A Q 0 0 231 0, 0.0 2,-0.1 0, 0.0 73,-0.1 0.000 360.0 360.0 360.0 -67.6 -0.7 17.9 24.3 2 128 A W - 0 0 93 71,-0.4 2,-0.3 2,-0.0 71,-0.0 -0.353 360.0-177.0 -85.2 164.2 -2.1 19.0 20.9 3 129 A A > - 0 0 39 71,-0.1 3,-2.9 -2,-0.1 4,-0.2 -0.976 40.0-104.5-159.4 151.1 -4.0 17.1 18.2 4 130 A L G > S+ 0 0 69 1,-0.3 3,-2.0 -2,-0.3 -1,-0.0 0.767 113.6 65.7 -48.5 -36.2 -5.5 17.7 14.7 5 131 A E G 3 S+ 0 0 153 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.574 91.7 66.7 -67.2 -9.1 -9.1 17.8 15.9 6 132 A D G < S+ 0 0 35 -3,-2.9 21,-3.6 21,-0.1 2,-0.3 0.514 97.2 67.6 -85.3 -6.4 -8.1 20.9 17.9 7 133 A F E < -A 26 0A 7 -3,-2.0 2,-0.5 19,-0.3 19,-0.2 -0.824 64.1-145.5-124.0 151.1 -7.6 23.0 14.7 8 134 A E E -A 25 0A 91 17,-2.3 17,-2.2 -2,-0.3 2,-0.3 -0.975 28.1-142.7-113.8 116.7 -9.5 24.4 11.8 9 135 A I E +A 24 0A 82 -2,-0.5 15,-0.2 15,-0.2 2,-0.1 -0.585 24.3 174.1 -85.7 134.0 -7.3 24.4 8.6 10 136 A G E - 0 0 39 13,-3.2 -1,-0.1 -2,-0.3 14,-0.1 0.027 42.5 -17.4-114.5-138.7 -7.5 27.2 6.2 11 137 A R E - 0 0 161 11,-0.1 12,-2.5 1,-0.1 -1,-0.3 -0.432 68.7-103.7 -78.9 143.7 -5.7 28.3 3.1 12 138 A P E -A 22 0A 77 0, 0.0 10,-0.3 0, 0.0 -1,-0.1 -0.410 26.4-169.3 -57.1 135.6 -2.3 26.8 2.1 13 139 A L E - 0 0 64 8,-3.6 2,-0.3 1,-0.4 9,-0.2 0.625 60.4 -51.9-100.2 -28.0 0.4 29.3 2.8 14 140 A G E -A 21 0A 15 7,-1.6 7,-2.1 2,-0.0 -1,-0.4 -0.985 48.9 -99.9 172.8-171.0 2.9 27.2 0.8 15 141 A K + 0 0 173 -2,-0.3 2,-0.2 5,-0.2 5,-0.1 -0.278 21.0 166.6-119.6-163.2 4.8 24.1 -0.1 16 142 A G > - 0 0 50 -2,-0.1 3,-1.3 1,-0.1 -2,-0.0 -0.749 54.8 -84.7 149.5 156.1 8.1 22.2 0.3 17 143 A K T 3 S+ 0 0 144 1,-0.3 3,-0.1 -2,-0.2 -1,-0.1 0.814 125.6 46.0 -59.2 -32.9 9.3 18.6 -0.3 18 144 A F T 3 S- 0 0 47 1,-0.3 21,-2.0 -3,-0.1 2,-0.3 0.506 124.4 -77.1 -92.5 -6.2 8.0 17.2 3.0 19 145 A G < - 0 0 14 -3,-1.3 -1,-0.3 19,-0.2 2,-0.3 -0.930 57.2 -47.4 143.6-163.6 4.6 18.8 2.7 20 146 A N - 0 0 51 -2,-0.3 17,-4.0 17,-0.2 2,-0.5 -0.689 27.3-135.5-110.3 155.1 2.6 22.0 3.1 21 147 A V E -AB 14 36A 26 -7,-2.1 -8,-3.6 15,-0.3 -7,-1.6 -0.951 28.3-168.7-104.9 129.6 2.1 24.9 5.6 22 148 A Y E -AB 12 35A 58 13,-3.2 13,-3.4 -2,-0.5 2,-0.1 -0.911 26.6-117.9-117.1 141.7 -1.5 25.9 6.2 23 149 A L E + B 0 34A 36 -12,-2.5 -13,-3.2 -2,-0.4 2,-0.3 -0.498 48.7 175.1 -62.3 142.4 -3.1 28.9 8.0 24 150 A A E -AB 9 33A 3 9,-2.5 9,-2.9 -15,-0.2 2,-0.4 -0.991 28.7-142.1-155.5 159.6 -5.1 27.4 10.9 25 151 A R E -AB 8 32A 94 -17,-2.2 -17,-2.3 -2,-0.3 2,-0.3 -0.990 23.3-125.1-131.7 124.7 -7.2 28.3 13.9 26 152 A E E > -A 7 0A 20 5,-2.6 4,-2.6 -2,-0.4 3,-0.4 -0.516 29.4-133.4 -69.7 124.5 -7.2 26.6 17.3 27 153 A K T 4 S+ 0 0 81 -21,-3.6 -1,-0.1 -2,-0.3 -20,-0.1 0.842 93.6 29.4 -56.4 -50.4 -10.8 25.7 17.9 28 154 A Q T 4 S+ 0 0 172 -22,-0.3 -1,-0.2 1,-0.2 -21,-0.1 0.655 127.0 42.7 -92.8 -13.6 -11.5 26.8 21.5 29 155 A S T 4 S- 0 0 69 -3,-0.4 -2,-0.2 2,-0.1 -1,-0.2 0.670 89.8-140.9 -95.0 -26.3 -9.0 29.7 21.6 30 156 A K < + 0 0 149 -4,-2.6 -3,-0.1 1,-0.2 2,-0.1 0.499 47.0 157.9 66.5 8.9 -9.7 31.1 18.2 31 157 A F - 0 0 102 -5,-0.3 -5,-2.6 -6,-0.1 2,-0.4 -0.389 37.5-133.0 -66.5 133.3 -5.9 31.7 18.0 32 158 A I E +B 25 0A 76 -7,-0.2 54,-0.5 -2,-0.1 2,-0.2 -0.770 40.0 144.3 -95.6 130.4 -4.4 32.0 14.5 33 159 A L E -B 24 0A 7 -9,-2.9 -9,-2.5 -2,-0.4 2,-0.5 -0.810 45.5-100.3-145.6-177.6 -1.3 30.0 13.6 34 160 A A E -BC 23 84A 6 50,-3.0 50,-3.3 -2,-0.2 2,-0.7 -0.984 23.3-150.9-120.6 127.3 0.4 28.1 10.8 35 161 A L E -BC 22 83A 0 -13,-3.4 -13,-3.2 -2,-0.5 2,-0.7 -0.888 5.5-160.0 -97.4 113.1 0.4 24.4 10.6 36 162 A K E -BC 21 82A 47 46,-2.6 46,-2.5 -2,-0.7 2,-0.6 -0.844 13.8-153.7 -91.9 111.8 3.5 23.0 8.9 37 163 A V E + C 0 81A 8 -17,-4.0 2,-0.5 -2,-0.7 -17,-0.2 -0.846 15.9 179.3 -99.2 117.5 2.5 19.5 7.8 38 164 A L E - C 0 80A 15 42,-3.5 42,-5.7 -2,-0.6 2,-0.3 -0.959 23.5-134.9-119.8 121.3 5.3 16.9 7.4 39 165 A F E > - C 0 79A 53 -21,-2.0 4,-1.3 -2,-0.5 40,-0.3 -0.557 2.5-152.3 -70.2 130.1 4.9 13.3 6.3 40 166 A K H >> S+ 0 0 47 38,-1.0 4,-2.2 -2,-0.3 3,-1.0 0.972 96.8 69.0 -62.8 -53.6 6.8 10.8 8.5 41 167 A A H 3> S+ 0 0 58 37,-0.7 4,-1.6 1,-0.3 3,-0.2 0.796 107.7 31.9 -17.8 -68.0 6.8 8.8 5.4 42 168 A Q H 3> S+ 0 0 73 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.700 111.4 63.1 -79.4 -23.3 9.2 11.2 3.6 43 169 A L H <<>S+ 0 0 7 -4,-1.3 5,-2.6 -3,-1.0 6,-0.8 0.825 109.4 42.3 -71.6 -33.2 11.2 12.4 6.6 44 170 A E H ><5S+ 0 0 98 -4,-2.2 3,-2.1 -3,-0.2 -2,-0.2 0.939 110.6 56.9 -74.8 -54.4 12.5 8.8 7.1 45 171 A K H 3<5S+ 0 0 196 -4,-1.6 -2,-0.2 -5,-0.3 -3,-0.1 0.916 114.6 36.1 -37.6 -67.5 13.0 8.3 3.4 46 172 A A T 3<5S- 0 0 54 -4,-2.0 -1,-0.3 1,-0.0 -2,-0.1 0.109 111.5-122.8 -83.8 21.8 15.4 11.3 3.0 47 173 A G T < 5S+ 0 0 32 -3,-2.1 -3,-0.2 1,-0.1 -2,-0.1 0.833 70.9 126.7 34.1 69.6 16.9 10.7 6.4 48 174 A V >>< + 0 0 20 -5,-2.6 4,-2.6 2,-0.1 3,-0.9 0.328 31.5 106.1-125.6 0.5 16.2 14.0 8.1 49 175 A E H 3> S+ 0 0 67 -6,-0.8 4,-1.9 1,-0.3 5,-0.1 0.788 81.6 54.1 -58.6 -31.0 14.4 12.9 11.3 50 176 A H H 34 S+ 0 0 122 2,-0.2 4,-0.3 1,-0.2 -1,-0.3 0.858 110.8 46.6 -69.5 -37.1 17.5 13.7 13.3 51 177 A Q H X> S+ 0 0 42 -3,-0.9 4,-1.9 2,-0.2 3,-0.8 0.896 109.7 54.8 -67.1 -43.2 17.5 17.2 11.8 52 178 A L H 3X S+ 0 0 17 -4,-2.6 4,-2.1 1,-0.3 3,-0.3 0.930 104.7 50.5 -60.1 -49.1 13.7 17.7 12.4 53 179 A R H 3X S+ 0 0 197 -4,-1.9 4,-1.1 1,-0.3 -1,-0.3 0.602 111.2 52.3 -70.3 -8.5 13.9 16.9 16.2 54 180 A R H <> S+ 0 0 85 -3,-0.8 4,-2.2 -4,-0.3 5,-0.3 0.778 103.9 53.8 -92.5 -35.6 16.7 19.4 16.3 55 181 A E H X S+ 0 0 14 -4,-1.9 4,-1.8 -3,-0.3 5,-0.2 0.898 112.2 47.9 -60.8 -39.1 14.6 22.1 14.5 56 182 A V H X S+ 0 0 16 -4,-2.1 4,-1.5 2,-0.2 5,-0.2 0.941 112.5 47.5 -70.6 -47.8 12.0 21.5 17.2 57 183 A E H X S+ 0 0 93 -4,-1.1 4,-2.0 2,-0.2 3,-0.4 0.980 117.9 37.9 -52.4 -66.5 14.4 21.7 20.1 58 184 A I H < S+ 0 0 3 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.893 118.9 45.0 -60.1 -48.5 16.2 24.8 19.2 59 185 A Q H >< S+ 0 0 2 -4,-1.8 11,-0.7 -5,-0.3 3,-0.5 0.734 111.8 55.6 -74.5 -22.3 13.4 26.8 17.8 60 186 A S H 3< S+ 0 0 35 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.925 107.3 45.6 -73.7 -47.7 11.2 25.9 20.8 61 187 A H T 3< S+ 0 0 117 -4,-2.0 2,-0.4 -5,-0.2 -1,-0.2 0.117 98.8 99.6 -86.1 19.8 13.5 27.1 23.5 62 188 A L < + 0 0 8 -3,-0.5 2,-0.3 8,-0.1 8,-0.3 -0.882 47.5 178.6-110.0 142.9 14.0 30.2 21.5 63 189 A R + 0 0 135 -2,-0.4 5,-0.1 6,-0.1 -3,-0.1 -0.830 22.6 129.7-148.4 100.0 12.2 33.4 22.3 64 190 A H > - 0 0 35 3,-0.5 3,-2.0 -2,-0.3 -2,-0.0 -0.980 58.7-124.8-155.7 140.4 12.8 36.5 20.3 65 191 A P T 3 S+ 0 0 89 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.740 114.7 48.4 -55.7 -23.4 10.6 39.1 18.5 66 192 A N T 3 S+ 0 0 17 47,-0.1 80,-1.7 79,-0.1 2,-0.3 -0.144 98.3 78.5-113.4 32.7 12.6 38.4 15.3 67 193 A I B < S-e 146 0B 3 -3,-2.0 -3,-0.5 78,-0.2 80,-0.2 -0.930 86.4-114.9-141.1 121.8 12.4 34.6 15.5 68 194 A L - 0 0 5 78,-1.9 2,-0.1 -2,-0.3 -6,-0.1 -0.279 37.9-123.4 -56.3 125.8 9.3 32.7 14.4 69 195 A R - 0 0 65 -4,-0.1 16,-2.4 17,-0.1 2,-0.5 -0.451 15.4-154.9 -70.4 144.3 7.9 31.0 17.4 70 196 A L E -D 84 0A 2 -11,-0.7 14,-0.2 -8,-0.3 -8,-0.1 -0.999 10.8-176.0-112.7 120.7 7.4 27.3 17.4 71 197 A Y E - 0 0 82 12,-2.9 2,-0.3 -2,-0.5 13,-0.1 0.765 54.2 -58.7 -89.2 -28.9 4.6 26.5 19.9 72 198 A G E -D 83 0A 14 11,-0.9 11,-1.7 2,-0.0 2,-0.3 -0.973 46.5-123.4 172.3-165.0 4.6 22.8 19.8 73 199 A Y E +D 82 0A 140 -2,-0.3 -71,-0.4 9,-0.2 2,-0.3 -0.970 16.7 176.9-162.5 166.6 4.3 19.7 17.6 74 200 A F E -D 81 0A 16 7,-1.8 7,-4.3 -2,-0.3 2,-0.3 -0.970 6.1-161.9-172.2 168.2 2.4 16.5 17.2 75 201 A H E +D 80 0A 119 -2,-0.3 5,-0.2 5,-0.3 2,-0.1 -0.893 9.5 178.5-147.9 174.3 1.9 13.5 15.0 76 202 A D - 0 0 74 3,-1.8 -73,-0.0 -2,-0.3 5,-0.0 -0.366 60.7 -49.4-143.5-130.3 -0.2 10.5 14.1 77 203 A A S S+ 0 0 84 -2,-0.1 -37,-0.2 1,-0.1 -1,-0.1 0.955 128.7 25.7 -77.1 -71.2 0.1 7.8 11.5 78 204 A T S S+ 0 0 77 -38,-0.1 -38,-1.0 -39,-0.1 -37,-0.7 0.659 120.7 11.9 -76.0 -19.7 0.9 9.5 8.2 79 205 A R E -C 39 0A 84 -40,-0.3 -3,-1.8 -39,-0.2 2,-0.4 -0.965 53.8-116.8-162.5 165.2 2.6 12.7 9.5 80 206 A V E -CD 38 75A 20 -42,-5.7 -42,-3.5 -2,-0.3 2,-0.5 -0.906 28.8-151.1-112.4 136.6 4.2 15.3 11.8 81 207 A Y E -CD 37 74A 3 -7,-4.3 -7,-1.8 -2,-0.4 2,-0.5 -0.935 5.1-161.0-119.9 125.0 2.7 18.7 12.6 82 208 A L E -CD 36 73A 0 -46,-2.5 -46,-2.6 -2,-0.5 2,-1.1 -0.914 11.5-148.6-105.0 124.2 4.5 21.9 13.6 83 209 A I E -CD 35 72A 4 -11,-1.7 -12,-2.9 -2,-0.5 -11,-0.9 -0.784 30.5-177.8 -91.1 95.9 2.4 24.5 15.3 84 210 A L E -CD 34 70A 7 -50,-3.3 -50,-3.0 -2,-1.1 -14,-0.2 -0.702 33.9-105.2-100.4 144.9 4.1 27.8 14.1 85 211 A E - 0 0 26 -16,-2.4 2,-0.4 -2,-0.3 -52,-0.1 -0.342 43.2-123.0 -47.8 144.3 3.5 31.4 14.8 86 212 A Y - 0 0 66 -54,-0.5 -1,-0.1 -53,-0.0 -54,-0.1 -0.879 17.1-154.3-103.3 130.0 1.8 32.9 11.7 87 213 A A > - 0 0 10 -2,-0.4 3,-1.4 1,-0.1 51,-0.3 -0.893 6.0-153.9-110.8 105.0 3.6 35.8 10.1 88 214 A P T 3 S+ 0 0 56 0, 0.0 51,-0.2 0, 0.0 -1,-0.1 0.669 82.5 54.2 -63.3 -20.3 1.0 37.9 8.3 89 215 A L T 3 S- 0 0 95 49,-2.3 50,-0.1 1,-0.3 6,-0.1 0.137 95.3-132.8-105.8 23.6 3.2 39.5 5.6 90 216 A G < - 0 0 33 -3,-1.4 48,-1.1 48,-0.3 -1,-0.3 -0.070 45.8 -27.0 69.0-163.2 4.8 36.5 4.0 91 217 A T B > -F 137 0B 37 46,-0.2 4,-1.5 1,-0.1 46,-0.2 -0.514 42.8-129.4 -92.3 153.4 8.4 36.0 3.1 92 218 A V H > S+ 0 0 0 44,-2.6 4,-1.9 41,-0.7 42,-0.2 0.795 110.8 66.7 -67.1 -28.8 11.1 38.5 2.3 93 219 A Y H > S+ 0 0 93 40,-1.3 4,-2.2 43,-0.4 3,-0.5 0.974 102.3 45.2 -52.9 -52.1 11.7 36.4 -0.8 94 220 A R H > S+ 0 0 145 1,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.894 110.4 52.3 -63.1 -39.4 8.2 37.4 -2.1 95 221 A E H X S+ 0 0 32 -4,-1.5 4,-3.1 1,-0.2 5,-0.3 0.853 110.1 51.4 -64.9 -28.1 8.7 41.0 -1.2 96 222 A L H X S+ 0 0 9 -4,-1.9 4,-2.3 -3,-0.5 -2,-0.2 0.856 110.3 44.8 -82.4 -41.2 11.9 40.9 -3.2 97 223 A Q H < S+ 0 0 101 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.893 115.7 53.0 -58.7 -41.2 10.4 39.4 -6.3 98 224 A K H < S+ 0 0 138 -4,-2.5 -2,-0.3 -5,-0.3 -3,-0.2 0.959 128.8 16.5 -62.4 -53.0 7.7 41.9 -5.7 99 225 A L H < S- 0 0 78 -4,-3.1 2,-1.5 -5,-0.1 -3,-0.2 0.575 89.6-146.8 -98.2 -13.7 10.1 44.9 -5.6 100 226 A S S < S+ 0 0 58 -4,-2.3 2,-0.3 -5,-0.3 -4,-0.1 0.043 78.7 24.5 70.7 -31.9 13.0 43.1 -7.1 101 227 A K S S- 0 0 106 -2,-1.5 88,-0.2 -6,-0.2 2,-0.1 -0.930 73.8-137.7-163.9 140.5 15.2 45.2 -4.9 102 228 A F - 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0 0 62 -2,-0.4 3,-0.9 0, 0.0 4,-0.2 0.008 63.4 -59.3-109.8-146.6 31.8 28.5 13.9 174 308 A E T 3 S+ 0 0 28 1,-0.2 4,-0.4 2,-0.2 -46,-0.1 0.324 114.2 86.4 -93.6 8.2 29.1 31.3 14.3 175 309 A K T >> S+ 0 0 22 1,-0.2 4,-1.4 2,-0.2 3,-0.9 0.719 72.1 76.5 -73.9 -19.9 30.9 33.5 11.8 176 310 A V H X> S+ 0 0 0 -3,-0.9 4,-2.5 1,-0.3 3,-1.4 0.966 89.5 55.8 -53.3 -50.8 29.0 31.6 9.1 177 311 A D H 3> S+ 0 0 0 1,-0.3 4,-1.3 -4,-0.2 -1,-0.3 0.718 103.9 54.2 -59.1 -25.0 25.9 33.6 10.0 178 312 A L H <> S+ 0 0 0 -3,-0.9 4,-1.2 -4,-0.4 -1,-0.3 0.793 107.0 49.0 -79.8 -29.1 27.9 36.9 9.4 179 313 A W H XX S+ 0 0 0 -3,-1.4 4,-2.5 -4,-1.4 3,-0.5 0.953 110.9 52.5 -68.5 -49.2 28.9 35.9 5.9 180 314 A S H 3X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.2 -2,-0.2 0.848 105.4 53.6 -45.2 -43.8 25.3 35.0 5.4 181 315 A L H 3X S+ 0 0 0 -4,-1.3 4,-2.5 -5,-0.2 -1,-0.2 0.841 108.0 51.6 -66.5 -33.2 24.3 38.5 6.6 182 316 A G H - 0 0 9 0, 0.0 3,-1.8 0, 0.0 -9,-0.1 -0.345 36.5-116.5 -73.8 151.1 23.0 37.2 -4.3 194 328 A P T 3 S+ 0 0 1 0, 0.0 19,-0.2 0, 0.0 -11,-0.0 0.643 110.7 43.7 -64.1 -16.3 26.6 38.3 -4.9 195 329 A F T 3 S+ 0 0 0 -35,-0.3 12,-0.2 17,-0.1 11,-0.1 0.216 78.4 148.4-116.6 16.7 27.8 34.8 -5.9 196 330 A E < + 0 0 96 -3,-1.8 2,-0.3 10,-0.1 -4,-0.0 -0.174 15.7 157.2 -56.7 140.7 25.0 33.8 -8.2 197 331 A A - 0 0 32 1,-0.0 -37,-0.1 9,-0.0 -2,-0.1 -0.877 50.8-110.8-155.6 178.0 25.9 31.5 -11.1 198 332 A N S S+ 0 0 172 -2,-0.3 2,-0.4 1,-0.1 3,-0.1 0.631 96.4 46.3 -97.7 -17.1 24.3 29.0 -13.4 199 333 A T S > S- 0 0 63 1,-0.1 4,-2.5 -3,-0.0 5,-0.2 -0.942 72.7-131.3-128.7 149.7 26.0 26.0 -12.0 200 334 A Y H > S+ 0 0 125 -2,-0.4 4,-2.3 1,-0.2 5,-0.1 0.928 113.4 54.7 -46.6 -46.7 26.7 24.5 -8.6 201 335 A Q H > S+ 0 0 134 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.861 108.7 43.0 -66.9 -42.6 30.2 24.2 -9.8 202 336 A E H > S+ 0 0 39 2,-0.2 4,-3.3 1,-0.2 -1,-0.2 0.889 112.3 54.0 -74.0 -41.0 30.8 27.9 -10.8 203 337 A T H X S+ 0 0 9 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.927 105.9 55.0 -54.9 -42.5 29.1 29.2 -7.7 204 338 A Y H X S+ 0 0 75 -4,-2.3 4,-2.9 -5,-0.2 -2,-0.2 0.949 111.1 43.1 -57.9 -51.1 31.5 27.0 -5.7 205 339 A K H X S+ 0 0 124 -4,-1.6 4,-2.0 1,-0.2 5,-0.2 0.982 113.5 53.0 -55.6 -53.5 34.4 28.6 -7.4 206 340 A R H <>S+ 0 0 66 -4,-3.3 5,-2.3 1,-0.2 -2,-0.2 0.842 115.2 38.9 -55.8 -40.1 32.9 32.0 -7.1 207 341 A I H ><5S+ 0 0 0 -4,-2.9 3,-1.4 3,-0.2 -1,-0.2 0.924 111.0 60.1 -72.1 -46.9 32.3 31.7 -3.3 208 342 A S H 3<5S+ 0 0 24 -4,-2.9 -2,-0.2 -5,-0.3 -1,-0.2 0.800 116.1 32.8 -47.7 -36.7 35.6 30.0 -2.8 209 343 A R T 3<5S- 0 0 152 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.286 105.8-123.0-113.0 5.9 37.4 33.0 -4.2 210 344 A V T < 5 + 0 0 34 -3,-1.4 2,-1.2 -5,-0.2 -3,-0.2 0.881 44.5 174.0 54.6 45.2 35.1 35.6 -2.9 211 345 A E < + 0 0 86 -5,-2.3 2,-0.3 -6,-0.2 -1,-0.2 -0.688 15.0 137.6 -88.8 94.2 34.5 37.0 -6.4 212 346 A F - 0 0 36 -2,-1.2 2,-0.3 -3,-0.1 -17,-0.1 -0.988 28.2-168.0-135.4 147.8 31.8 39.7 -6.2 213 347 A T - 0 0 110 -2,-0.3 -2,-0.0 -19,-0.2 0, 0.0 -0.929 18.0-126.5-130.3 156.8 31.3 43.1 -7.7 214 348 A F - 0 0 37 -2,-0.3 -2,-0.0 4,-0.1 9,-0.0 -0.829 18.7-121.9-104.8 137.3 28.9 45.9 -7.1 215 349 A P > - 0 0 41 0, 0.0 3,-1.5 0, 0.0 -1,-0.0 -0.358 39.1-103.4 -68.0 161.7 26.6 47.7 -9.5 216 350 A D T 3 S+ 0 0 158 1,-0.3 -2,-0.0 3,-0.0 0, 0.0 0.812 115.4 61.6 -55.5 -37.2 27.2 51.4 -9.6 217 351 A F T 3 S+ 0 0 113 2,-0.1 2,-0.6 -27,-0.0 -1,-0.3 0.567 75.9 101.8 -73.1 -9.8 24.2 52.4 -7.5 218 352 A V S < S- 0 0 6 -3,-1.5 -4,-0.1 1,-0.1 2,-0.0 -0.710 76.0-128.3 -80.3 122.7 25.3 50.5 -4.5 219 353 A T >> - 0 0 53 -2,-0.6 4,-2.4 1,-0.1 3,-0.7 -0.218 14.0-106.4 -79.3 164.4 26.7 53.2 -2.2 220 354 A E H 3> S+ 0 0 139 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.778 117.0 51.8 -62.0 -38.6 30.0 53.4 -0.4 221 355 A G H 3> S+ 0 0 23 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.847 110.9 48.8 -68.4 -35.5 28.7 52.7 3.0 222 356 A A H <> S+ 0 0 0 -3,-0.7 4,-2.6 2,-0.2 5,-0.3 0.902 110.2 50.9 -70.8 -42.7 26.9 49.5 1.7 223 357 A R H X S+ 0 0 62 -4,-2.4 4,-3.2 1,-0.2 5,-0.2 0.927 110.0 53.2 -56.8 -44.5 30.1 48.4 -0.1 224 358 A D H X S+ 0 0 58 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.962 111.5 41.4 -58.7 -54.6 31.9 48.9 3.1 225 359 A L H X S+ 0 0 1 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.870 118.6 45.6 -66.8 -37.3 29.7 46.8 5.3 226 360 A I H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.899 111.2 54.1 -73.1 -39.3 29.3 44.0 2.8 227 361 A S H < S+ 0 0 51 -4,-3.2 -2,-0.2 -5,-0.3 -1,-0.2 0.890 110.4 46.2 -61.2 -36.9 33.0 44.1 2.1 228 362 A R H < S+ 0 0 116 -4,-2.2 3,-0.3 -5,-0.2 -1,-0.2 0.804 114.4 48.2 -76.5 -28.6 33.7 43.6 5.8 229 363 A L H < S+ 0 0 0 -4,-1.3 2,-1.5 -5,-0.2 -2,-0.2 0.873 100.5 66.3 -79.6 -36.3 31.2 40.9 6.1 230 364 A L < + 0 0 5 -4,-2.5 2,-0.4 -48,-0.1 -1,-0.2 -0.448 68.7 146.6 -93.4 65.9 32.3 38.8 3.0 231 365 A K - 0 0 84 -2,-1.5 6,-0.1 -3,-0.3 -21,-0.1 -0.816 50.7-141.9-104.6 137.3 35.8 37.7 4.2 232 366 A H S S+ 0 0 73 -2,-0.4 -67,-0.3 1,-0.1 -1,-0.1 0.886 95.3 64.4 -62.3 -34.8 37.3 34.4 3.2 233 367 A N S > S- 0 0 70 1,-0.1 3,-1.7 -69,-0.1 4,-0.4 -0.803 76.3-151.3 -97.3 115.7 38.7 34.3 6.7 234 368 A P G > S+ 0 0 15 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.832 90.3 67.7 -53.9 -34.4 36.1 34.1 9.5 235 369 A S G 3 S+ 0 0 99 1,-0.3 -3,-0.0 -3,-0.0 -2,-0.0 0.715 96.6 52.5 -63.6 -24.9 38.3 35.9 11.9 236 370 A Q G < S+ 0 0 105 -3,-1.7 -1,-0.3 -7,-0.0 -4,-0.1 0.524 83.4 106.4 -92.5 -5.9 38.2 39.2 10.1 237 371 A R S < S- 0 0 3 -3,-1.7 -8,-0.2 -4,-0.4 -58,-0.1 -0.560 77.6-111.7 -73.5 135.0 34.4 39.3 10.0 238 372 A P - 0 0 9 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.097 28.7-107.8 -58.2 162.5 33.0 41.8 12.4 239 373 A M >> - 0 0 86 1,-0.1 4,-1.5 -61,-0.0 3,-0.9 -0.559 34.7-104.9 -83.8 160.8 31.0 40.9 15.4 240 374 A L H 3> S+ 0 0 7 1,-0.3 4,-2.5 -2,-0.2 3,-0.3 0.894 120.2 63.6 -55.7 -38.0 27.4 41.5 15.4 241 375 A R H 3> S+ 0 0 193 1,-0.3 4,-1.9 2,-0.2 -1,-0.3 0.882 102.8 47.8 -53.2 -42.9 27.9 44.4 17.7 242 376 A E H <> S+ 0 0 97 -3,-0.9 4,-0.9 2,-0.2 -1,-0.3 0.812 107.0 56.1 -73.5 -31.3 30.0 46.2 15.0 243 377 A V H >< S+ 0 0 1 -4,-1.5 3,-0.6 -3,-0.3 -1,-0.2 0.934 109.9 45.6 -62.9 -47.0 27.4 45.6 12.4 244 378 A L H 3< S+ 0 0 41 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.884 116.1 48.0 -59.1 -39.8 24.8 47.3 14.6 245 379 A E H 3< S+ 0 0 130 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.593 83.2 121.9 -80.2 -10.9 27.4 50.1 15.2 246 380 A H S+ 0 0 91 0, 0.0 4,-0.9 0, 0.0 -1,-0.1 0.595 105.1 52.6 -72.4 -11.6 27.6 54.1 10.2 248 382 A W H > S+ 0 0 15 -27,-0.2 4,-0.6 2,-0.2 5,-0.1 0.799 111.4 48.1 -88.9 -32.6 25.7 53.1 7.2 249 383 A I H >> S+ 0 0 4 -3,-0.2 4,-4.0 -6,-0.2 3,-2.1 0.994 114.3 44.7 -60.0 -64.3 23.4 51.0 9.3 250 384 A T H 3< S+ 0 0 90 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.845 110.0 55.6 -53.3 -40.0 22.8 53.8 11.9 251 385 A A H 3< S+ 0 0 76 -4,-0.9 -1,-0.3 -5,-0.2 -2,-0.2 0.786 127.5 18.1 -63.5 -22.8 22.3 56.4 9.1 252 386 A N H << S+ 0 0 29 -3,-2.1 2,-1.9 -4,-0.6 -143,-0.2 0.637 87.5 109.0-125.2 -24.6 19.5 54.3 7.6 253 387 A S < - 0 0 18 -4,-4.0 -147,-0.1 -145,-0.2 -148,-0.1 -0.465 39.4-175.3 -75.2 83.7 18.2 51.7 10.0 254 388 A S 0 0 108 -2,-1.9 -1,-0.2 -149,-0.4 -148,-0.1 0.914 360.0 360.0 -30.8 -76.1 14.7 53.0 10.9 255 389 A K 0 0 170 -3,-0.1 -145,-0.1 0, 0.0 -146,-0.0 0.752 360.0 360.0 -54.5 360.0 14.1 50.2 13.5