==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 31-AUG-07 2VAG . COMPND 2 MOLECULE: DUAL SPECIFICITY PROTEIN KINASE CLK1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.C.W.PIKE,A.N.BULLOCK,O.FEDOROV,E.S.PILKA,E.UGOCHUKWU,F.VON . 332 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15414.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 217 65.4 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 . 55 16.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 4 1.2 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 . 17 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 28.6 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 2 0 1 1 0 1 0 0 1 1 0 0 1 0 0 0 2 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 . 1 3 1 0 2 1 0 2 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 . 3 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 0 A M >> 0 0 65 0, 0.0 3,-1.9 0, 0.0 4,-0.5 0.000 360.0 360.0 360.0 -47.6 -5.0 22.8 15.8 2 148 A H G >4 + 0 0 71 1,-0.3 3,-0.6 2,-0.2 4,-0.1 0.842 360.0 60.0 -46.7 -38.3 -4.0 26.5 16.5 3 149 A L G 34 S+ 0 0 158 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.553 109.3 37.2 -72.6 -11.3 -7.3 26.9 18.2 4 150 A I G <4 S+ 0 0 14 -3,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.372 103.7 60.6-127.6 7.0 -6.9 24.2 20.9 5 151 A C << + 0 0 15 -3,-0.6 2,-0.2 -4,-0.5 -2,-0.1 0.030 63.8 129.4-133.8 28.5 -3.3 24.2 22.2 6 152 A Q > - 0 0 103 1,-0.1 3,-2.3 -4,-0.1 11,-0.3 -0.543 68.5 -90.0 -87.7 151.3 -2.4 27.6 23.7 7 153 A S T 3 S+ 0 0 78 1,-0.3 11,-0.2 -2,-0.2 -1,-0.1 -0.302 116.2 31.1 -60.7 139.3 -0.9 28.1 27.1 8 154 A G T 3 S+ 0 0 45 9,-3.2 -1,-0.3 1,-0.4 10,-0.1 0.137 86.9 131.5 93.0 -23.1 -3.5 28.4 29.8 9 155 A D < - 0 0 51 -3,-2.3 8,-2.8 7,-0.1 2,-0.5 -0.405 51.1-142.1 -57.5 138.0 -5.9 26.1 27.8 10 156 A V E -A 16 0A 79 6,-0.2 2,-0.4 -3,-0.1 3,-0.3 -0.950 13.0-159.2-105.6 128.6 -7.4 23.4 30.1 11 157 A L E >> S-A 15 0A 0 4,-3.0 4,-3.0 -2,-0.5 3,-2.1 -0.880 71.8 -4.8-108.2 134.7 -7.9 19.9 28.5 12 158 A S T 34 S- 0 0 57 -2,-0.4 -1,-0.2 1,-0.3 75,-0.0 0.807 115.8 -77.9 58.0 32.7 -10.3 17.3 29.9 13 159 A A T 34 S+ 0 0 93 -3,-0.3 -1,-0.3 1,-0.1 3,-0.1 0.746 132.2 65.0 47.3 31.9 -11.0 19.6 32.8 14 160 A R T <4 S+ 0 0 60 -3,-2.1 21,-2.7 1,-0.2 2,-0.6 0.586 78.0 70.0-145.9 -42.9 -7.7 18.4 34.2 15 161 A Y E < -AB 11 34A 2 -4,-3.0 -4,-3.0 19,-0.2 2,-0.6 -0.855 56.2-159.8-107.3 114.5 -4.6 19.4 32.1 16 162 A E E -AB 10 33A 65 17,-2.5 17,-2.3 -2,-0.6 2,-0.3 -0.837 20.8-128.9 -96.8 118.1 -3.4 23.0 32.0 17 163 A I E + B 0 32A 1 -8,-2.8 -9,-3.2 -2,-0.6 15,-0.3 -0.484 36.0 163.9 -66.9 127.1 -1.2 23.8 29.1 18 164 A V E - 0 0 49 13,-3.0 2,-0.3 1,-0.4 14,-0.2 0.555 63.1 -5.2-113.5 -16.9 2.0 25.5 30.1 19 165 A D E - B 0 31A 76 12,-1.4 12,-3.0 -13,-0.1 2,-0.5 -0.974 60.9-112.6-170.2 154.7 4.2 25.1 27.0 20 166 A T E - B 0 30A 76 -2,-0.3 10,-0.3 10,-0.3 3,-0.1 -0.890 23.8-173.7 -97.7 128.9 4.5 23.5 23.5 21 167 A L E - 0 0 68 8,-3.0 2,-0.3 -2,-0.5 9,-0.2 0.725 59.1 -34.8 -93.3 -26.7 7.2 20.8 23.4 22 168 A G E - B 0 29A 30 7,-1.5 7,-2.6 2,-0.0 2,-0.4 -0.966 46.5-126.7 175.9 165.9 7.2 20.1 19.7 23 169 A E E + B 0 28A 109 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.992 28.4 162.8-134.9 141.4 5.3 19.8 16.5 24 170 A G E > - B 0 27A 35 3,-2.9 3,-0.9 -2,-0.4 -2,-0.0 -0.748 56.6 -78.5-140.5-170.8 5.2 16.9 14.0 25 171 A A T 3 S+ 0 0 60 1,-0.2 28,-0.1 -2,-0.2 3,-0.1 0.838 126.8 54.3 -62.8 -34.3 3.1 15.6 11.1 26 172 A F T 3 S- 0 0 41 1,-0.1 22,-3.5 21,-0.1 2,-0.3 0.614 122.6 -92.6 -75.5 -19.7 0.6 14.2 13.6 27 173 A G E < -BC 24 47A 5 -3,-0.9 -3,-2.9 20,-0.3 2,-0.3 -0.983 61.5 -41.5 140.9-129.7 0.0 17.5 15.4 28 174 A K E -BC 23 46A 8 18,-2.1 18,-3.5 -2,-0.3 2,-0.4 -0.926 32.3-138.8-141.9 152.6 1.7 18.9 18.5 29 175 A V E -BC 22 45A 29 -7,-2.6 -8,-3.0 -2,-0.3 -7,-1.5 -0.990 26.3-172.2-115.6 129.1 3.0 17.8 21.9 30 176 A V E -BC 20 44A 0 14,-2.9 14,-3.4 -2,-0.4 2,-0.5 -0.838 23.2-124.4-118.3 154.7 2.3 20.2 24.9 31 177 A E E -BC 19 43A 37 -12,-3.0 -13,-3.0 -2,-0.3 -12,-1.4 -0.873 36.8-178.7 -94.8 131.3 3.5 20.2 28.5 32 178 A C E -BC 17 42A 0 10,-2.6 10,-2.7 -2,-0.5 2,-0.5 -0.950 31.5-123.6-130.8 150.3 0.6 20.4 31.0 33 179 A I E -BC 16 41A 35 -17,-2.3 -17,-2.5 -2,-0.3 2,-0.9 -0.831 28.2-139.2 -83.3 125.0 0.1 20.5 34.8 34 180 A D E > > -BC 15 40A 6 6,-3.5 5,-2.5 -2,-0.5 3,-1.1 -0.803 17.0-171.3 -89.7 106.3 -2.1 17.6 35.8 35 181 A H T 3 5S+ 0 0 105 -21,-2.7 3,-0.4 -2,-0.9 -1,-0.2 0.669 83.5 51.6 -77.0 -14.8 -4.5 19.1 38.4 36 182 A K T 3 5S+ 0 0 110 -22,-0.3 -1,-0.2 1,-0.2 -21,-0.1 0.291 107.2 54.6-100.5 9.4 -5.9 15.7 39.4 37 183 A A T X 5S- 0 0 44 -3,-1.1 3,-0.9 -23,-0.2 -1,-0.2 -0.187 129.0 -85.2-130.2 35.5 -2.5 14.2 40.0 38 184 A G T 3 5S- 0 0 82 -3,-0.4 -3,-0.2 1,-0.2 -2,-0.1 0.645 82.8 -58.4 73.3 17.5 -1.1 16.8 42.4 39 185 A G T 3 > S- 0 0 53 -2,-2.1 4,-2.4 1,-0.1 3,-1.2 -0.990 72.2-122.0-142.2 126.6 -7.5 14.1 10.1 51 197 A D H 3> S+ 0 0 133 -2,-0.4 4,-2.8 1,-0.3 5,-0.2 0.833 109.9 51.7 -36.3 -61.6 -8.4 10.4 9.3 52 198 A R H 3> S+ 0 0 135 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.847 116.2 40.5 -42.4 -47.7 -4.8 9.3 8.7 53 199 A Y H <> S+ 0 0 37 -3,-1.2 4,-2.2 2,-0.2 -1,-0.2 0.847 112.3 52.1 -83.0 -35.8 -3.6 10.7 12.0 54 200 A C H X S+ 0 0 27 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.913 110.8 51.3 -63.0 -44.9 -6.6 9.7 14.2 55 201 A E H X S+ 0 0 139 -4,-2.8 4,-2.1 -5,-0.3 -2,-0.2 0.931 110.4 47.5 -54.7 -50.7 -6.1 6.2 12.9 56 202 A A H X S+ 0 0 32 -4,-1.6 4,-2.2 -5,-0.2 -2,-0.2 0.858 111.4 51.9 -60.6 -38.4 -2.4 6.2 13.8 57 203 A A H X S+ 0 0 2 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.893 108.1 49.7 -67.8 -42.5 -3.2 7.6 17.3 58 204 A R H X S+ 0 0 98 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.891 112.9 49.0 -60.1 -41.3 -5.8 4.9 18.0 59 205 A S H X S+ 0 0 36 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.904 109.3 51.2 -63.1 -43.1 -3.1 2.4 17.0 60 206 A E H X S+ 0 0 1 -4,-2.2 4,-3.1 1,-0.2 5,-0.2 0.910 108.0 53.1 -64.9 -41.6 -0.5 4.0 19.2 61 207 A I H X S+ 0 0 11 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.893 109.8 47.7 -58.4 -43.3 -2.9 3.8 22.1 62 208 A Q H X S+ 0 0 82 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.944 114.3 46.7 -65.0 -45.0 -3.4 0.1 21.6 63 209 A V H X S+ 0 0 1 -4,-2.5 4,-3.1 1,-0.2 3,-0.3 0.974 113.8 47.6 -57.8 -55.2 0.4 -0.5 21.3 64 210 A L H X S+ 0 0 0 -4,-3.1 4,-2.6 1,-0.2 5,-0.2 0.823 108.4 54.4 -60.6 -32.1 1.2 1.6 24.3 65 211 A E H X S+ 0 0 56 -4,-2.1 4,-1.5 -5,-0.2 -1,-0.2 0.908 112.9 44.7 -64.3 -40.5 -1.6 -0.2 26.4 66 212 A H H X S+ 0 0 60 -4,-1.9 4,-2.5 -3,-0.3 -2,-0.2 0.964 115.7 45.8 -68.3 -50.2 0.1 -3.5 25.5 67 213 A L H X S+ 0 0 1 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.902 111.7 50.8 -61.7 -42.6 3.6 -2.2 26.2 68 214 A N H < S+ 0 0 31 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.835 113.2 45.6 -71.4 -29.1 2.8 -0.6 29.5 69 215 A T H < S+ 0 0 117 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.890 114.5 48.8 -73.9 -38.3 1.1 -3.7 30.8 70 216 A T H < S+ 0 0 61 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.824 126.4 26.6 -69.3 -32.9 4.0 -5.9 29.6 71 217 A D >< + 0 0 13 -4,-2.3 3,-1.9 -5,-0.2 -1,-0.3 -0.607 68.6 163.4-132.0 68.5 6.6 -3.7 31.2 72 218 A P T 3 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.730 78.8 52.8 -62.8 -23.6 4.9 -1.9 34.1 73 219 A N T 3 S- 0 0 141 1,-0.0 -5,-0.1 0, 0.0 -2,-0.0 0.335 106.4-126.5 -88.4 4.3 8.3 -0.9 35.7 74 220 A S X + 0 0 16 -3,-1.9 3,-2.0 -6,-0.2 -6,-0.0 0.712 56.2 153.4 44.1 32.9 9.4 0.7 32.3 75 221 A T T 3 + 0 0 95 1,-0.3 -1,-0.1 2,-0.1 54,-0.0 0.766 68.8 49.4 -50.3 -31.8 12.6 -1.4 32.5 76 222 A F T 3 S- 0 0 75 -5,-0.1 -1,-0.3 2,-0.1 56,-0.2 0.299 108.0-121.5-103.5 10.5 12.8 -1.3 28.7 77 223 A R < + 0 0 61 -3,-2.0 98,-2.3 1,-0.2 2,-0.4 0.759 55.2 147.4 64.9 35.7 12.5 2.5 28.2 78 224 A C B -f 175 0B 2 96,-0.2 -1,-0.2 -7,-0.1 98,-0.2 -0.798 63.2 -90.0 -92.5 144.8 9.4 2.9 25.9 79 225 A V - 0 0 4 96,-2.4 2,-0.6 -2,-0.4 -1,-0.1 -0.221 42.5-126.5 -54.5 141.0 7.5 6.1 26.7 80 226 A Q - 0 0 49 16,-0.1 16,-2.4 -3,-0.0 2,-0.4 -0.873 15.6-150.2-100.4 119.5 4.8 5.5 29.3 81 227 A M E -E 95 0A 25 -2,-0.6 14,-0.3 14,-0.2 3,-0.1 -0.730 9.1-170.7 -83.3 137.6 1.2 6.6 28.4 82 228 A L E - 0 0 63 12,-3.5 2,-0.3 1,-0.5 13,-0.2 0.850 61.1 -48.3 -98.3 -44.6 -0.8 7.7 31.4 83 229 A E E -E 94 0A 60 11,-0.9 11,-2.7 2,-0.0 -1,-0.5 -0.922 50.2-134.3-169.8-179.0 -4.2 7.9 29.7 84 230 A W E +E 93 0A 96 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.954 22.1 166.2-144.0 164.2 -5.9 9.4 26.6 85 231 A F E -E 92 0A 16 7,-2.1 7,-2.9 -2,-0.3 2,-0.4 -0.902 34.2 -98.3-161.6 179.7 -9.0 11.4 25.9 86 232 A E E -E 91 0A 109 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.939 27.3-173.5-117.9 143.7 -10.8 13.5 23.3 87 233 A H E > S-E 90 0A 26 3,-2.2 3,-2.0 -2,-0.4 -76,-0.0 -0.956 75.9 -21.9-143.8 111.3 -10.7 17.3 23.1 88 234 A H T 3 S- 0 0 145 -2,-0.4 3,-0.1 1,-0.3 -1,-0.0 0.832 129.6 -51.3 50.6 34.7 -12.8 19.3 20.6 89 235 A G T 3 S+ 0 0 42 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.409 114.0 121.4 89.1 -0.9 -12.8 16.0 18.5 90 236 A H E < - E 0 87A 20 -3,-2.0 -3,-2.2 -41,-0.1 2,-0.3 -0.832 65.0-123.3-100.1 133.2 -9.0 15.6 18.7 91 237 A I E - E 0 86A 4 -2,-0.4 -44,-2.7 -5,-0.2 2,-0.5 -0.542 29.7-166.3 -70.8 130.1 -7.4 12.5 20.2 92 238 A C E -DE 46 85A 0 -7,-2.9 -7,-2.1 -2,-0.3 2,-0.5 -0.985 5.6-161.0-125.6 126.5 -5.0 13.5 23.0 93 239 A I E -DE 45 84A 0 -48,-2.2 -48,-3.4 -2,-0.5 2,-0.5 -0.955 9.3-146.3-112.0 126.0 -2.5 11.1 24.5 94 240 A V E -DE 44 83A 0 -11,-2.7 -12,-3.5 -2,-0.5 -11,-0.9 -0.771 21.9-179.4 -94.1 126.9 -1.0 11.8 28.0 95 241 A F E -DE 43 81A 17 -52,-3.8 -52,-2.9 -2,-0.5 -14,-0.2 -0.882 38.7 -96.4-121.1 149.8 2.6 10.8 28.6 96 242 A E E -D 42 0A 32 -16,-2.4 2,-0.3 -2,-0.3 -54,-0.2 -0.404 63.3 -95.8 -50.6 141.5 5.1 10.9 31.4 97 243 A L - 0 0 58 -56,-0.7 2,-0.2 -18,-0.1 -1,-0.1 -0.516 50.2-179.0 -71.4 128.8 7.1 14.1 30.7 98 244 A L - 0 0 18 -2,-0.3 53,-0.2 1,-0.2 54,-0.1 -0.752 20.2-113.0-119.9 172.3 10.4 13.6 28.8 99 245 A G - 0 0 22 51,-2.6 -1,-0.2 -2,-0.2 53,-0.1 0.094 55.1 -39.4 -88.7-163.1 13.1 15.9 27.6 100 246 A L - 0 0 49 49,-0.1 50,-2.5 1,-0.1 -1,-0.2 -0.290 62.5-109.0 -64.7 142.4 14.4 17.1 24.3 101 247 A S B > -G 149 0B 6 48,-0.3 4,-2.3 1,-0.1 48,-0.3 -0.295 27.9-114.2 -64.0 158.3 14.7 14.7 21.4 102 248 A T H > S+ 0 0 0 46,-2.9 4,-2.1 43,-1.1 44,-0.2 0.839 118.6 54.9 -64.0 -31.7 18.2 13.7 20.4 103 249 A Y H > S+ 0 0 97 42,-0.9 4,-2.2 45,-0.3 -1,-0.2 0.947 108.7 46.4 -62.2 -52.9 17.6 15.5 17.1 104 250 A D H > S+ 0 0 54 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.869 110.3 54.2 -60.6 -37.3 16.7 18.8 18.8 105 251 A F H X S+ 0 0 1 -4,-2.3 4,-0.6 2,-0.2 -1,-0.2 0.949 109.0 46.5 -64.2 -47.7 19.7 18.5 21.1 106 252 A I H ><>S+ 0 0 4 -4,-2.1 5,-2.5 2,-0.2 6,-0.7 0.877 113.6 51.1 -59.3 -39.5 22.2 18.1 18.2 107 253 A K H ><5S+ 0 0 48 -4,-2.2 3,-1.5 1,-0.2 -2,-0.2 0.952 110.5 46.4 -63.0 -50.3 20.4 21.1 16.5 108 254 A E H 3<5S+ 0 0 94 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.506 109.2 58.4 -74.9 -3.8 20.6 23.3 19.6 109 255 A N T X<5S- 0 0 11 -4,-0.6 3,-1.1 -3,-0.5 -1,-0.3 -0.047 125.3 -99.9-110.3 24.9 24.3 22.2 19.9 110 256 A G T < 5S- 0 0 36 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.2 0.824 71.1 -64.3 58.1 37.9 25.2 23.5 16.4 111 257 A F T 3 > - 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0 0 68 -2,-1.7 2,-0.8 -6,-0.1 3,-0.1 -0.957 44.4-148.9-126.7 127.2 21.6 6.2 -11.9 272 420 A D > - 0 0 98 -2,-0.4 3,-1.2 1,-0.2 6,-0.4 -0.845 9.9-167.9 -97.0 106.3 23.2 9.1 -13.9 273 421 A E T 3 S+ 0 0 44 -2,-0.8 9,-0.2 1,-0.2 -1,-0.2 0.706 83.9 55.8 -68.4 -20.4 26.3 10.1 -11.9 274 422 A H T 3 S+ 0 0 155 4,-0.2 -1,-0.2 5,-0.1 2,-0.1 0.407 86.8 96.9 -98.4 1.9 26.7 13.3 -13.9 275 423 A S S <> S- 0 0 37 -3,-1.2 4,-3.2 1,-0.1 5,-0.3 -0.332 94.4 -94.7 -77.5 169.3 23.3 14.8 -13.2 276 424 A S H > S+ 0 0 88 2,-0.2 4,-1.7 1,-0.2 5,-0.2 0.926 130.0 41.9 -43.2 -56.9 22.6 17.3 -10.5 277 425 A A H > S+ 0 0 23 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.905 113.9 54.7 -63.5 -39.2 21.6 14.6 -8.0 278 426 A G H > S+ 0 0 0 -6,-0.4 4,-2.2 1,-0.2 -2,-0.2 0.920 107.9 47.5 -61.1 -45.8 24.5 12.4 -9.3 279 427 A R H X S+ 0 0 149 -4,-3.2 4,-1.4 1,-0.2 -1,-0.2 0.845 112.6 49.7 -66.6 -36.0 27.1 15.1 -8.6 280 428 A Y H X S+ 0 0 110 -4,-1.7 4,-3.5 -5,-0.3 5,-0.3 0.937 108.9 51.0 -68.0 -47.9 25.8 15.8 -5.2 281 429 A V H X S+ 0 0 6 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.902 108.7 52.7 -56.0 -42.8 25.8 12.1 -4.3 282 430 A S H < S+ 0 0 82 -4,-2.2 -1,-0.2 -9,-0.2 -2,-0.2 0.852 117.4 38.6 -60.8 -35.8 29.4 11.8 -5.4 283 431 A R H < S+ 0 0 83 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.957 120.0 43.0 -77.2 -54.2 30.3 14.8 -3.2 284 432 A A H < S+ 0 0 32 -4,-3.5 2,-0.3 -5,-0.1 -2,-0.2 0.710 111.4 54.7 -70.7 -25.6 28.1 14.0 -0.2 285 433 A C < + 0 0 8 -4,-2.1 -54,-0.1 -5,-0.3 -42,-0.0 -0.829 52.7 154.6-119.2 149.2 28.7 10.3 0.1 286 434 A K - 0 0 83 -2,-0.3 5,-0.1 -56,-0.1 -41,-0.1 -0.937 56.7 -50.9-157.7 168.8 31.7 8.0 0.4 287 435 A P > - 0 0 64 0, 0.0 3,-1.8 0, 0.0 4,-0.4 -0.179 58.9-115.1 -49.8 138.3 32.6 4.6 1.8 288 436 A L G > S+ 0 0 4 -42,-2.6 3,-2.2 1,-0.3 4,-0.2 0.856 110.3 53.2 -45.2 -54.0 31.3 4.2 5.4 289 437 A K G > S+ 0 0 59 1,-0.3 3,-1.3 -43,-0.2 -1,-0.3 0.687 94.3 70.5 -67.0 -15.0 34.6 3.8 7.2 290 438 A E G < S+ 0 0 114 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.636 87.9 68.0 -72.7 -11.9 36.0 7.1 5.6 291 439 A F G < S+ 0 0 19 -3,-2.2 -1,-0.2 -4,-0.4 -2,-0.2 0.558 74.1 118.6 -78.8 -6.5 33.5 8.9 7.9 292 440 A M < - 0 0 28 -3,-1.3 3,-0.1 -4,-0.2 8,-0.0 -0.345 51.8-160.3 -66.3 139.2 35.5 7.8 10.9 293 441 A L S S+ 0 0 120 1,-0.2 2,-0.3 -68,-0.0 -1,-0.2 0.562 77.2 20.0 -94.7 -15.3 36.9 10.7 12.9 294 442 A S - 0 0 42 2,-0.1 -1,-0.2 1,-0.0 0, 0.0 -0.979 59.3-141.7-149.3 156.3 39.5 8.5 14.6 295 443 A Q + 0 0 146 -2,-0.3 5,-0.1 -3,-0.1 -1,-0.0 0.342 61.5 130.3 -96.9 0.8 41.2 5.1 14.1 296 444 A D S >> S- 0 0 88 1,-0.1 4,-1.8 3,-0.1 3,-0.8 -0.153 72.5-111.1 -52.8 148.9 41.1 4.4 17.8 297 445 A V H 3> S+ 0 0 77 1,-0.3 4,-2.4 2,-0.2 5,-0.1 0.779 115.0 57.1 -65.4 -29.3 39.7 0.9 18.6 298 446 A E H 3> S+ 0 0 19 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.864 108.1 48.7 -71.0 -28.2 36.5 2.2 20.2 299 447 A H H <> S+ 0 0 33 -3,-0.8 4,-2.6 2,-0.2 -2,-0.2 0.875 111.7 49.4 -70.3 -40.3 35.7 4.0 16.9 300 448 A E H X S+ 0 0 49 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.858 109.6 52.4 -64.9 -37.9 36.5 0.8 15.0 301 449 A R H X S+ 0 0 82 -4,-2.4 4,-1.9 2,-0.2 27,-0.3 0.956 110.6 46.9 -61.9 -49.5 34.2 -1.0 17.4 302 450 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.934 113.4 48.5 -55.3 -47.9 31.4 1.5 16.7 303 451 A F H X S+ 0 0 4 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.785 106.8 55.8 -71.6 -28.4 31.9 1.3 12.9 304 452 A D H X S+ 0 0 63 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.913 110.7 45.4 -64.9 -44.6 31.9 -2.5 12.9 305 453 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.923 112.0 51.7 -62.4 -47.9 28.5 -2.5 14.6 306 454 A I H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.932 109.1 50.5 -55.1 -46.7 27.2 0.2 12.2 307 455 A Q H < S+ 0 0 101 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.894 110.1 50.0 -62.3 -38.2 28.3 -1.8 9.2 308 456 A K H >< S+ 0 0 88 -4,-1.7 10,-1.1 1,-0.2 3,-1.0 0.858 110.6 49.2 -65.4 -39.5 26.6 -5.0 10.5 309 457 A M H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.747 109.6 53.9 -69.8 -27.2 23.4 -3.0 11.1 310 458 A L T 3< S+ 0 0 3 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.058 74.5 137.9 -98.1 20.9 23.7 -1.6 7.5 311 459 A E < - 0 0 65 -3,-1.0 6,-0.1 1,-0.1 -3,-0.1 -0.490 54.5-137.0 -57.1 129.1 23.9 -5.1 5.9 312 460 A Y S S+ 0 0 14 -2,-0.2 -111,-0.3 -65,-0.1 -1,-0.1 0.919 85.2 72.5 -63.5 -46.2 21.7 -5.0 2.8 313 461 A D S > S- 0 0 23 1,-0.2 4,-2.0 -113,-0.1 3,-0.1 -0.628 72.2-152.0 -76.5 117.4 20.0 -8.4 3.2 314 462 A P T 4 S+ 0 0 34 0, 0.0 -1,-0.2 0, 0.0 -100,-0.1 0.730 94.0 55.2 -65.7 -22.0 17.6 -8.1 6.1 315 463 A A T 4 S+ 0 0 90 1,-0.2 -2,-0.0 -104,-0.0 4,-0.0 0.916 113.2 41.0 -67.8 -48.7 18.0 -11.9 6.9 316 464 A K T 4 S+ 0 0 146 -3,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.759 92.9 109.4 -71.9 -26.9 21.7 -11.6 7.2 317 465 A R S < S- 0 0 5 -4,-2.0 -8,-0.2 -6,-0.1 -9,-0.1 -0.190 82.2 -96.0 -54.4 142.8 21.5 -8.3 9.1 318 466 A I - 0 0 17 -10,-1.1 2,-0.2 -13,-0.1 -1,-0.1 -0.232 36.2-132.0 -56.1 140.8 22.4 -8.4 12.8 319 467 A T > - 0 0 61 -3,-0.1 4,-2.5 1,-0.1 5,-0.1 -0.542 21.3-113.2 -87.9 162.9 19.5 -8.8 15.1 320 468 A L H > S+ 0 0 2 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.865 118.7 58.9 -65.6 -34.0 19.3 -6.5 18.2 321 469 A R H 4 S+ 0 0 126 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.931 111.6 40.9 -58.5 -45.5 19.8 -9.5 20.4 322 470 A E H >4 S+ 0 0 107 2,-0.2 3,-1.5 1,-0.2 -2,-0.2 0.880 110.9 56.8 -64.8 -42.8 23.2 -10.0 18.6 323 471 A A H >< S+ 0 0 0 -4,-2.5 3,-1.9 1,-0.3 6,-0.2 0.874 99.5 60.6 -61.1 -35.7 24.0 -6.2 18.6 324 472 A L T 3< S+ 0 0 28 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.724 103.9 50.4 -64.8 -21.1 23.6 -6.1 22.3 325 473 A K T < S+ 0 0 124 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.314 85.6 124.6 -96.2 5.7 26.5 -8.7 22.6 326 474 A H S X S- 0 0 12 -3,-1.9 3,-2.3 -4,-0.2 4,-0.3 -0.346 73.2-117.1 -71.1 146.4 28.8 -6.6 20.3 327 475 A P G > S+ 0 0 59 0, 0.0 3,-1.8 0, 0.0 4,-0.4 0.772 109.6 73.0 -49.3 -32.8 32.3 -5.6 21.5 328 476 A F G 3 S+ 0 0 0 -27,-0.3 3,-0.4 1,-0.3 -26,-0.1 0.802 100.0 47.3 -50.8 -34.2 31.3 -1.9 21.2 329 477 A F G X> S+ 0 0 7 -3,-2.3 3,-1.6 -6,-0.2 4,-0.5 0.472 81.5 96.9 -90.1 -2.8 29.2 -2.5 24.4 330 478 A D G X4 S+ 0 0 96 -3,-1.8 3,-1.4 -4,-0.3 -1,-0.2 0.850 77.0 61.9 -57.5 -34.6 31.9 -4.4 26.4 331 479 A L G 34 S+ 0 0 112 -4,-0.4 -1,-0.3 -3,-0.4 -2,-0.1 0.740 100.8 53.9 -63.0 -24.7 32.8 -1.1 28.3 332 480 A L G <4 0 0 63 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.596 360.0 360.0 -81.6 -13.2 29.3 -1.0 29.7 333 481 A K << 0 0 119 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.1 0.376 360.0 360.0 -73.7 360.0 29.6 -4.6 31.0