==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 13-SEP-02 1MQ4 . COMPND 2 MOLECULE: AURORA-RELATED KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.NOWAKOWSKI,C.N.CRONIN,D.E.MCREE,M.W.KNUTH,C.NELSON, . 261 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12484.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 170 65.1 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 . 40 15.3 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 . 2 0.8 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 . 14 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 30.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 1 0 2 0 0 1 0 0 1 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 1 1 0 2 2 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 . 1 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 1 126 A R 0 0 131 0, 0.0 2,-1.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 103.6 -0.4 18.5 59.8 2 127 A Q - 0 0 106 73,-0.0 2,-0.1 2,-0.0 73,-0.1 -0.706 360.0-175.4-101.2 89.8 0.9 15.8 62.2 3 128 A W - 0 0 92 -2,-1.1 2,-0.3 71,-0.3 73,-0.3 -0.395 4.1-172.7 -79.1 157.5 2.3 17.3 65.4 4 129 A A > - 0 0 30 71,-0.1 3,-1.7 -2,-0.1 4,-0.1 -0.930 40.4-104.3-141.2 165.0 4.0 15.4 68.1 5 130 A L G > S+ 0 0 67 -2,-0.3 3,-2.1 1,-0.3 -1,-0.0 0.863 116.2 66.6 -58.8 -36.5 5.2 16.4 71.6 6 131 A E G 3 S+ 0 0 144 1,-0.3 -1,-0.3 3,-0.0 22,-0.0 0.636 88.1 67.2 -62.5 -17.9 8.8 16.3 70.3 7 132 A D G < S+ 0 0 50 -3,-1.7 21,-2.6 20,-0.1 22,-0.3 0.505 99.1 64.7 -77.9 -3.6 8.0 19.3 68.1 8 133 A F E < -A 27 0A 11 -3,-2.1 2,-0.5 19,-0.2 19,-0.2 -0.905 65.8-145.0-126.1 146.2 7.6 21.6 71.2 9 134 A E E -A 26 0A 93 17,-2.8 17,-2.4 -2,-0.3 2,-0.3 -0.949 32.5-142.3 -99.8 127.2 9.5 23.0 74.1 10 135 A I E +A 25 0A 80 -2,-0.5 15,-0.2 15,-0.2 2,-0.1 -0.714 22.5 178.2 -99.2 145.3 7.2 23.1 77.1 11 136 A G E - 0 0 40 13,-3.1 -1,-0.1 -2,-0.3 3,-0.1 -0.034 41.1 -25.1-118.7-145.8 7.2 25.9 79.6 12 137 A R E - 0 0 137 1,-0.1 12,-2.6 11,-0.1 -1,-0.3 -0.348 69.8 -95.4 -73.5 153.0 5.3 26.9 82.7 13 138 A P E -A 23 0A 69 0, 0.0 10,-0.3 0, 0.0 -1,-0.1 -0.521 29.9-166.1 -65.3 126.0 1.7 25.8 83.4 14 139 A L E - 0 0 51 8,-3.0 2,-0.3 1,-0.3 9,-0.2 0.727 65.3 -27.8 -81.7 -29.0 -0.6 28.6 82.2 15 140 A G E -A 22 0A 32 7,-1.4 7,-2.3 -3,-0.1 2,-0.6 -0.990 61.0 -94.4-175.6 172.6 -3.6 27.0 84.2 16 141 A K E -A 21 0A 190 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.922 36.8-173.3-106.6 118.6 -5.3 24.0 85.7 17 142 A G - 0 0 38 3,-1.6 3,-0.2 -2,-0.6 5,-0.0 -0.492 38.2-104.8 -96.1 177.2 -7.9 22.4 83.5 18 143 A K S S+ 0 0 176 1,-0.2 3,-0.1 -2,-0.2 21,-0.1 0.913 117.9 30.0 -68.5 -41.0 -10.2 19.6 84.7 19 144 A F S S- 0 0 28 1,-0.2 21,-2.5 19,-0.1 2,-0.3 0.252 134.6 -32.1-107.4 12.0 -8.4 16.8 82.8 20 145 A G S S- 0 0 14 -3,-0.2 -3,-1.6 19,-0.2 -1,-0.2 -0.885 76.1 -70.4 152.0 174.2 -4.8 18.2 82.8 21 146 A N E -A 16 0A 49 -2,-0.3 17,-2.5 -5,-0.2 2,-0.4 -0.499 33.6-124.5 -93.5 163.0 -2.9 21.4 82.8 22 147 A V E -AB 15 37A 27 -7,-2.3 -8,-3.0 15,-0.2 -7,-1.4 -0.922 32.8-161.0-101.6 135.3 -2.5 24.0 80.0 23 148 A Y E -AB 13 36A 51 13,-3.1 13,-3.4 -2,-0.4 2,-0.2 -0.909 21.9-119.8-119.8 142.6 1.2 24.7 79.3 24 149 A L E + B 0 35A 35 -12,-2.6 -13,-3.1 -2,-0.4 2,-0.3 -0.577 45.4 178.9 -64.0 141.8 3.0 27.5 77.5 25 150 A A E -AB 10 34A 2 9,-2.8 9,-2.7 -15,-0.2 2,-0.4 -0.987 25.6-149.2-149.1 155.9 4.9 26.0 74.6 26 151 A R E -AB 9 33A 92 -17,-2.4 -17,-2.8 -2,-0.3 2,-0.4 -0.998 22.7-127.2-127.2 130.1 7.1 26.9 71.8 27 152 A E E > -A 8 0A 18 5,-2.3 4,-2.3 -2,-0.4 5,-0.3 -0.634 22.9-137.8 -72.9 127.9 7.2 25.2 68.4 28 153 A K T 4 S+ 0 0 110 -21,-2.6 -1,-0.1 -2,-0.4 -20,-0.1 0.818 92.7 41.2 -63.0 -37.6 10.9 24.3 67.8 29 154 A Q T 4 S+ 0 0 188 -22,-0.3 -1,-0.2 1,-0.1 -21,-0.1 0.888 128.9 26.2 -81.4 -38.2 11.2 25.2 64.1 30 155 A S T 4 S- 0 0 70 2,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.671 93.5-132.0 -95.9 -20.2 9.3 28.4 64.0 31 156 A K < + 0 0 146 -4,-2.3 2,-0.3 1,-0.2 -3,-0.2 0.631 47.1 167.0 63.5 24.0 9.7 29.5 67.6 32 157 A F - 0 0 102 -5,-0.3 -5,-2.3 -6,-0.1 2,-0.4 -0.460 30.0-139.1 -70.1 125.2 6.0 30.1 67.6 33 158 A I E +B 26 0A 69 -2,-0.3 54,-0.4 -7,-0.2 2,-0.3 -0.719 39.6 141.5 -90.5 137.2 4.6 30.5 71.1 34 159 A L E -B 25 0A 9 -9,-2.7 -9,-2.8 -2,-0.4 2,-0.4 -0.853 47.3 -97.1-155.4-176.0 1.3 28.9 71.9 35 160 A A E -BC 24 85A 5 50,-2.6 50,-3.3 -2,-0.3 2,-0.6 -0.962 22.5-150.2-119.8 139.4 -0.5 27.0 74.6 36 161 A L E -BC 23 84A 0 -13,-3.4 -13,-3.1 -2,-0.4 2,-0.7 -0.944 7.3-157.3-112.7 111.9 -0.7 23.2 74.9 37 162 A K E -BC 22 83A 30 46,-3.1 46,-2.9 -2,-0.6 2,-0.4 -0.833 12.7-157.2 -91.3 113.6 -3.8 22.0 76.6 38 163 A V E - C 0 82A 4 -17,-2.5 2,-0.4 -2,-0.7 44,-0.2 -0.778 12.5-178.4 -95.7 130.8 -3.2 18.5 78.0 39 164 A L E - C 0 81A 8 42,-2.6 42,-2.6 -2,-0.4 2,-0.5 -0.994 24.6-132.4-128.8 125.7 -6.1 16.0 78.7 40 165 A F E > - C 0 80A 64 -21,-2.5 4,-1.9 -2,-0.4 40,-0.3 -0.674 10.1-147.7 -80.9 118.5 -5.5 12.6 80.2 41 166 A K H > S+ 0 0 70 38,-2.0 4,-2.3 -2,-0.5 5,-0.3 0.872 94.7 58.5 -50.4 -43.9 -7.4 10.0 78.2 42 167 A A H > S+ 0 0 63 37,-0.5 4,-2.1 1,-0.2 -1,-0.2 0.939 110.5 42.0 -54.2 -48.9 -8.0 7.7 81.2 43 168 A Q H > S+ 0 0 106 -3,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.842 112.0 54.8 -70.3 -35.2 -9.8 10.5 83.1 44 169 A L H X>S+ 0 0 11 -4,-1.9 5,-1.6 2,-0.2 4,-1.3 0.937 111.5 42.5 -63.6 -50.0 -11.8 11.7 80.0 45 170 A E H <5S+ 0 0 72 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.903 112.7 53.1 -68.2 -40.9 -13.3 8.3 79.2 46 171 A K H <5S+ 0 0 93 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.938 113.3 44.3 -55.3 -46.1 -14.0 7.5 82.9 47 172 A A H <5S- 0 0 46 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.720 108.6-135.7 -72.2 -21.9 -15.8 10.9 83.1 48 173 A G T <5 + 0 0 45 -4,-1.3 -3,-0.2 -5,-0.1 3,-0.1 0.875 67.8 120.0 69.2 41.7 -17.5 10.0 79.7 49 174 A V >>< + 0 0 11 -5,-1.6 4,-1.4 1,-0.1 3,-0.9 -0.095 20.8 122.5-124.0 28.0 -17.0 13.3 78.0 50 175 A E H 3> S+ 0 0 45 -6,-0.3 4,-1.8 1,-0.2 5,-0.1 0.833 75.0 61.6 -58.6 -29.8 -14.9 12.3 75.0 51 176 A H H 3> S+ 0 0 53 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.818 99.0 55.0 -65.1 -33.0 -17.7 13.8 73.0 52 177 A Q H <> S+ 0 0 21 -3,-0.9 4,-2.4 2,-0.2 -1,-0.2 0.891 106.8 49.3 -66.0 -42.7 -17.0 17.2 74.6 53 178 A L H X S+ 0 0 19 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.913 111.3 50.7 -62.1 -40.4 -13.4 17.1 73.5 54 179 A R H X S+ 0 0 162 -4,-1.8 4,-2.5 1,-0.2 5,-0.2 0.916 111.3 46.9 -63.2 -46.6 -14.5 16.2 70.0 55 180 A R H X S+ 0 0 78 -4,-2.2 4,-3.3 2,-0.2 5,-0.5 0.906 109.2 55.2 -59.7 -45.5 -16.9 19.1 69.8 56 181 A E H X S+ 0 0 9 -4,-2.4 4,-2.3 2,-0.2 5,-0.4 0.936 113.2 41.5 -52.7 -50.4 -14.3 21.5 71.2 57 182 A V H X S+ 0 0 25 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.945 119.1 43.4 -67.7 -47.7 -11.8 20.6 68.5 58 183 A E H X S+ 0 0 54 -4,-2.5 4,-0.6 -5,-0.2 -2,-0.2 0.899 122.9 36.1 -69.6 -40.7 -14.3 20.5 65.6 59 184 A I H >X S+ 0 0 9 -4,-3.3 4,-1.2 -5,-0.2 3,-0.9 0.963 119.8 44.9 -78.1 -51.3 -16.2 23.7 66.6 60 185 A Q H 3< S+ 0 0 1 -4,-2.3 11,-0.6 -5,-0.5 -3,-0.2 0.831 107.4 58.8 -66.9 -32.0 -13.3 25.8 67.9 61 186 A S H 3< S+ 0 0 29 -4,-1.8 -1,-0.2 -5,-0.4 -2,-0.2 0.764 108.4 45.4 -68.8 -23.5 -11.0 25.0 65.0 62 187 A H H << S+ 0 0 140 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.712 91.4 94.7 -93.3 -21.5 -13.4 26.4 62.4 63 188 A L < - 0 0 7 -4,-1.2 2,-0.4 -3,-0.1 8,-0.3 -0.497 51.6-173.7 -71.7 139.7 -14.3 29.6 64.2 64 189 A R + 0 0 124 -2,-0.2 5,-0.1 6,-0.1 -3,-0.0 -0.871 27.5 128.2-138.9 98.5 -12.3 32.7 63.2 65 190 A H > - 0 0 45 3,-0.4 3,-2.0 -2,-0.4 53,-0.0 -0.987 61.9-122.4-153.9 140.0 -12.9 35.8 65.2 66 191 A P T 3 S+ 0 0 86 0, 0.0 4,-0.1 0, 0.0 -1,-0.0 0.730 114.5 47.6 -60.2 -21.2 -10.6 38.2 67.0 67 192 A N T 3 S+ 0 0 16 47,-0.1 80,-2.7 79,-0.1 2,-0.4 0.080 97.7 80.7-108.8 21.3 -12.5 37.6 70.3 68 193 A I B < S-e 147 0B 5 -3,-2.0 -3,-0.4 78,-0.3 2,-0.2 -0.999 86.5-115.9-123.3 128.7 -12.5 33.8 70.0 69 194 A L - 0 0 3 78,-3.1 2,-0.2 -2,-0.4 -6,-0.1 -0.418 32.9-125.1 -64.6 129.3 -9.4 31.8 71.0 70 195 A R - 0 0 86 -2,-0.2 16,-2.5 -4,-0.1 2,-0.5 -0.483 15.2-156.9 -74.6 138.3 -8.0 30.0 68.1 71 196 A L E -D 85 0A 3 -11,-0.6 14,-0.2 -8,-0.3 3,-0.1 -0.998 7.4-172.8-112.5 124.1 -7.4 26.2 68.2 72 197 A Y E - 0 0 87 12,-2.7 2,-0.3 -2,-0.5 13,-0.2 0.651 52.6 -69.6 -93.4 -22.2 -4.8 25.3 65.7 73 198 A G E -D 84 0A 16 11,-1.1 11,-2.7 2,-0.0 -1,-0.3 -0.983 45.1-114.9 159.5-162.5 -5.0 21.5 66.0 74 199 A Y E -D 83 0A 128 -2,-0.3 -71,-0.3 9,-0.2 2,-0.3 -0.978 14.8-173.5-159.5 160.7 -4.4 18.6 68.2 75 200 A F E -D 82 0A 14 7,-2.0 7,-3.2 -2,-0.3 2,-0.3 -0.944 9.4-154.6-151.4 174.9 -2.4 15.4 68.7 76 201 A H E -D 81 0A 110 -2,-0.3 5,-0.2 -73,-0.3 2,-0.2 -0.992 9.3-174.4-150.4 156.6 -2.3 12.4 71.0 77 202 A D - 0 0 64 3,-2.2 5,-0.0 -2,-0.3 -73,-0.0 -0.411 58.5 -60.3-125.6-148.7 -0.0 9.8 72.4 78 203 A A S S+ 0 0 96 -2,-0.2 3,-0.0 1,-0.2 -2,-0.0 0.923 128.3 14.2 -71.3 -46.1 -0.8 6.8 74.7 79 204 A T S S+ 0 0 67 -38,-0.1 -38,-2.0 -39,-0.1 -37,-0.5 0.552 120.7 53.2-107.3 -11.5 -2.1 8.5 77.8 80 205 A R E -C 40 0A 78 -40,-0.3 -3,-2.2 -39,-0.1 2,-0.4 -0.914 53.1-150.9-137.4 150.8 -2.8 12.1 76.7 81 206 A V E -CD 39 76A 17 -42,-2.6 -42,-2.6 -2,-0.3 2,-0.5 -0.939 22.0-154.8-112.7 141.3 -4.5 14.3 74.2 82 207 A Y E -CD 38 75A 1 -7,-3.2 -7,-2.0 -2,-0.4 2,-0.5 -0.969 4.2-160.0-126.1 115.3 -2.9 17.7 73.4 83 208 A L E -CD 37 74A 0 -46,-2.9 -46,-3.1 -2,-0.5 2,-0.7 -0.848 13.7-143.4 -94.0 128.0 -4.8 20.7 72.1 84 209 A I E +CD 36 73A 4 -11,-2.7 -12,-2.7 -2,-0.5 -11,-1.1 -0.831 31.7 178.7 -93.1 111.5 -2.7 23.3 70.4 85 210 A L E -CD 35 71A 13 -50,-3.3 -50,-2.6 -2,-0.7 -14,-0.2 -0.809 37.2 -97.7-116.3 151.8 -4.2 26.7 71.3 86 211 A E - 0 0 37 -16,-2.5 2,-0.4 -2,-0.3 -52,-0.2 -0.471 48.3-117.9 -54.6 130.7 -3.5 30.4 70.7 87 212 A Y - 0 0 64 -54,-0.4 -1,-0.1 -2,-0.1 -17,-0.1 -0.705 19.8-154.7 -76.4 128.1 -1.6 31.7 73.7 88 213 A A > - 0 0 13 -2,-0.4 3,-1.3 1,-0.1 51,-0.2 -0.905 9.2-167.6-105.6 100.1 -3.5 34.4 75.6 89 214 A P T 3 S+ 0 0 51 0, 0.0 51,-0.2 0, 0.0 -1,-0.1 0.755 77.4 55.9 -68.4 -28.0 -0.7 36.4 77.3 90 215 A L T 3 S- 0 0 75 49,-1.8 50,-0.2 1,-0.3 6,-0.1 0.328 100.3-137.6 -91.0 8.0 -2.7 38.5 79.8 91 216 A G < - 0 0 13 -3,-1.3 48,-2.5 48,-0.5 -1,-0.3 -0.317 39.8 -24.0 80.3-155.4 -4.4 35.5 81.4 92 217 A T B > -F 138 0B 35 46,-0.2 4,-1.9 1,-0.1 46,-0.2 -0.599 41.2-127.7 -97.1 159.3 -8.0 35.1 82.4 93 218 A V H > S+ 0 0 0 44,-2.6 4,-2.6 41,-0.8 5,-0.2 0.850 112.5 64.6 -67.9 -32.2 -10.7 37.5 83.3 94 219 A Y H > S+ 0 0 111 40,-1.4 4,-1.8 43,-0.4 -1,-0.2 0.922 106.0 41.0 -54.7 -47.8 -11.0 35.3 86.4 95 220 A R H > S+ 0 0 135 2,-0.2 4,-2.3 39,-0.2 -1,-0.2 0.895 112.0 56.1 -68.7 -39.5 -7.5 36.4 87.6 96 221 A E H X S+ 0 0 21 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.900 109.4 47.3 -58.2 -41.8 -8.1 40.0 86.5 97 222 A L H X S+ 0 0 11 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.852 110.4 49.8 -69.8 -40.1 -11.2 40.0 88.8 98 223 A Q H < S+ 0 0 130 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.868 113.5 48.5 -71.6 -26.1 -9.4 38.5 91.7 99 224 A K H < S+ 0 0 146 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.956 126.3 25.7 -71.2 -50.6 -6.6 41.1 91.2 100 225 A L H < S- 0 0 68 -4,-2.5 2,-1.8 -5,-0.2 -2,-0.2 0.533 90.5-142.1 -91.3 -12.0 -9.0 44.2 91.0 101 226 A S S < S+ 0 0 81 -4,-2.1 2,-0.3 -5,-0.2 -4,-0.1 -0.236 78.1 5.0 70.7 -48.9 -12.0 42.8 93.0 102 227 A K S S- 0 0 96 -2,-1.8 2,-0.3 -6,-0.1 95,-0.2 -0.978 77.4-116.7-157.0 163.1 -14.4 44.5 90.5 103 228 A F - 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0 0 40 -2,-0.9 2,-0.3 -3,-0.1 -17,-0.1 -0.983 32.6-161.8-148.3 153.9 -30.8 38.6 92.9 221 347 A T - 0 0 112 -2,-0.3 -2,-0.0 -19,-0.3 0, 0.0 -0.945 19.1-123.5-133.0 161.3 -30.3 42.2 94.1 222 348 A F - 0 0 33 -2,-0.3 2,-0.0 4,-0.1 -28,-0.0 -0.779 21.5-117.4-104.0 141.9 -27.8 44.9 93.3 223 349 A P > - 0 0 37 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.369 38.9-106.0 -65.0 159.6 -25.5 46.7 95.6 224 350 A D T 3 S+ 0 0 156 1,-0.2 -2,-0.0 -2,-0.0 0, 0.0 0.810 114.1 67.1 -61.2 -32.1 -26.2 50.5 95.7 225 351 A F T 3 S+ 0 0 112 2,-0.0 2,-0.3 -27,-0.0 -1,-0.2 0.742 75.6 102.3 -66.2 -19.7 -23.2 51.4 93.7 226 352 A V S < S- 0 0 5 -3,-1.3 -4,-0.1 1,-0.1 -32,-0.0 -0.476 74.4-126.4 -69.1 127.5 -24.6 49.7 90.5 227 353 A T > - 0 0 50 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.194 15.3-112.2 -76.7 163.3 -26.0 52.3 88.1 228 354 A E H > S+ 0 0 135 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.810 116.8 53.9 -67.4 -28.7 -29.4 52.4 86.6 229 355 A G H > S+ 0 0 24 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.916 111.1 44.8 -68.7 -44.7 -28.1 51.7 83.1 230 356 A A H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.929 113.4 51.2 -64.7 -44.2 -26.2 48.6 84.3 231 357 A R H X S+ 0 0 56 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.877 109.0 51.8 -59.3 -39.8 -29.2 47.5 86.3 232 358 A D H X S+ 0 0 63 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.2 0.915 111.9 44.9 -64.9 -44.2 -31.4 47.9 83.2 233 359 A L H X S+ 0 0 2 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.932 116.4 45.4 -63.4 -49.4 -29.1 45.8 81.0 234 360 A I H X S+ 0 0 1 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.902 111.3 52.0 -65.2 -42.1 -28.6 43.1 83.6 235 361 A S H < S+ 0 0 50 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.838 109.8 50.6 -64.4 -32.6 -32.3 42.9 84.4 236 362 A R H < S+ 0 0 128 -4,-1.6 3,-0.2 -5,-0.2 -1,-0.2 0.840 113.6 44.6 -72.9 -32.4 -33.1 42.5 80.7 237 363 A L H < S+ 0 0 0 -4,-1.6 2,-1.5 1,-0.2 -2,-0.2 0.826 102.9 65.7 -80.4 -34.1 -30.6 39.7 80.3 238 364 A L < + 0 0 5 -4,-2.4 2,-0.4 -5,-0.1 -1,-0.2 -0.468 69.0 140.5 -93.8 64.3 -31.6 37.8 83.4 239 365 A K - 0 0 72 -2,-1.5 6,-0.1 -3,-0.2 -21,-0.1 -0.913 52.1-141.0-106.0 134.1 -35.1 36.8 82.4 240 366 A H S S+ 0 0 72 -2,-0.4 -67,-0.3 -23,-0.1 -1,-0.1 0.905 92.7 67.6 -57.4 -44.7 -36.3 33.3 83.3 241 367 A N S > S- 0 0 72 1,-0.2 3,-1.7 -3,-0.1 4,-0.3 -0.724 76.8-152.9 -82.3 115.5 -38.1 33.1 79.9 242 368 A P G > S+ 0 0 17 0, 0.0 3,-1.7 0, 0.0 -1,-0.2 0.828 92.4 62.9 -57.8 -37.8 -35.3 32.9 77.2 243 369 A S G 3 S+ 0 0 100 1,-0.3 -2,-0.0 -3,-0.1 -3,-0.0 0.677 99.2 56.4 -61.1 -21.2 -37.6 34.4 74.6 244 370 A Q G < S+ 0 0 118 -3,-1.7 -1,-0.3 -5,-0.1 -4,-0.1 0.518 85.5 100.7 -86.1 -8.4 -37.8 37.6 76.7 245 371 A R S < S- 0 0 6 -3,-1.7 -8,-0.2 -4,-0.3 -58,-0.1 -0.566 81.1-109.5 -73.6 141.9 -34.0 38.0 76.7 246 372 A P - 0 0 18 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.176 27.8-106.2 -68.9 161.7 -32.7 40.5 74.2 247 373 A M > - 0 0 112 1,-0.1 4,-1.0 -61,-0.0 3,-0.4 -0.482 35.0-108.1 -76.3 162.6 -30.9 39.8 71.0 248 374 A L H > S+ 0 0 14 1,-0.2 4,-2.5 2,-0.2 3,-0.5 0.852 119.6 61.8 -65.2 -33.2 -27.2 40.5 71.0 249 375 A R H > S+ 0 0 48 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.901 101.9 52.2 -55.8 -43.0 -27.8 43.5 68.7 250 376 A E H 4 S+ 0 0 104 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.778 109.5 48.9 -66.4 -29.2 -30.0 45.0 71.4 251 377 A V H >< S+ 0 0 0 -4,-1.0 3,-1.4 -3,-0.5 6,-0.2 0.895 108.2 53.0 -73.8 -44.1 -27.1 44.6 73.9 252 378 A L H 3< S+ 0 0 42 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.755 115.7 40.9 -64.0 -23.3 -24.5 46.2 71.6 253 379 A E T 3< S+ 0 0 151 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.181 82.2 128.6-111.6 12.0 -26.8 49.2 71.2 254 380 A H <> - 0 0 19 -3,-1.4 4,-2.5 1,-0.1 3,-0.3 -0.512 66.8-125.2 -65.8 137.4 -27.9 49.5 74.8 255 381 A P H > S+ 0 0 95 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.811 109.2 52.8 -57.6 -38.5 -27.3 53.1 76.0 256 382 A W H > S+ 0 0 13 -27,-0.2 4,-1.2 2,-0.2 5,-0.2 0.880 112.6 44.8 -61.7 -42.7 -25.2 52.0 79.0 257 383 A I H > S+ 0 0 2 -3,-0.3 4,-2.8 -6,-0.2 -1,-0.2 0.913 113.8 50.9 -65.2 -44.4 -22.9 49.9 76.7 258 384 A T H < S+ 0 0 95 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.907 113.1 43.9 -60.5 -44.1 -22.7 52.8 74.2 259 385 A A H < S+ 0 0 83 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.722 125.2 32.4 -76.0 -23.1 -21.8 55.4 76.7 260 386 A N H < S+ 0 0 22 -4,-1.2 -150,-0.2 -5,-0.1 2,-0.2 0.699 91.6 98.1-109.9 -22.6 -19.2 53.2 78.5 261 387 A S < 0 0 30 -4,-2.8 -154,-0.1 -152,-0.2 -155,-0.1 -0.496 360.0 360.0 -75.8 139.6 -17.6 50.9 76.0 262 388 A S 0 0 130 -156,-0.4 -1,-0.1 -2,-0.2 -2,-0.1 -0.232 360.0 360.0 -76.8 360.0 -14.2 51.6 74.4