==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-MAY-08 3D14 . COMPND 2 MOLECULE: SERINE/THREONINE KINASE 6; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR R.A.ELLING,S.BASKARAN,D.A.ALLEN,J.D.OSLOB,M.J.ROMANOWSKI . 262 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13007.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 166 63.4 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 . 38 14.5 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 . 10 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 30.9 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 0 1 0 2 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 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 1 133 A G > 0 0 104 0, 0.0 3,-1.4 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 154.7 1.1 31.2 61.6 2 134 A P G > + 0 0 42 0, 0.0 3,-0.7 0, 0.0 33,-0.1 0.648 360.0 65.1 -64.9 -18.7 3.2 28.2 62.5 3 135 A L G 3 S+ 0 0 5 1,-0.2 87,-0.1 30,-0.0 0, 0.0 0.283 93.0 62.1 -91.4 11.1 0.4 26.6 64.6 4 136 A G G < 0 0 70 -3,-1.4 -1,-0.2 75,-0.0 0, 0.0 0.440 360.0 360.0-107.4 -5.7 -1.8 26.0 61.6 5 137 A S < 0 0 75 -3,-0.7 0, 0.0 -4,-0.2 0, 0.0 -0.320 360.0 360.0 -69.9 360.0 0.7 23.7 59.8 6 ! 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 7 139 A R 0 0 127 0, 0.0 2,-0.8 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 145.4 1.6 18.6 60.8 8 140 A Q - 0 0 90 73,-0.0 73,-0.1 0, 0.0 2,-0.1 -0.838 360.0-142.6-104.2 105.4 1.2 15.9 63.5 9 141 A W - 0 0 27 -2,-0.8 2,-0.3 71,-0.2 73,-0.3 -0.326 19.8-175.3 -68.5 143.3 2.2 17.7 66.8 10 142 A T > - 0 0 71 71,-0.1 3,-1.5 -2,-0.1 4,-0.1 -0.888 39.6-109.8-129.3 165.6 4.1 16.0 69.6 11 143 A L G > S+ 0 0 67 -2,-0.3 3,-1.9 1,-0.3 -1,-0.0 0.836 115.0 66.5 -63.3 -32.6 5.2 17.2 73.0 12 144 A E G 3 S+ 0 0 133 1,-0.3 -1,-0.3 3,-0.0 22,-0.0 0.575 85.7 72.2 -66.7 -10.5 8.9 17.3 71.9 13 145 A D G < S+ 0 0 22 -3,-1.5 21,-2.9 20,-0.1 2,-0.4 0.543 96.9 64.2 -76.4 -7.4 7.9 20.1 69.5 14 146 A F E < -A 33 0A 2 -3,-1.9 2,-0.5 19,-0.2 19,-0.2 -0.931 66.8-144.8-127.5 140.7 7.6 22.4 72.6 15 147 A D E -A 32 0A 63 17,-2.7 17,-2.4 -2,-0.4 2,-0.4 -0.876 34.0-139.1 -88.2 134.2 9.6 23.9 75.4 16 148 A I E -A 31 0A 86 -2,-0.5 15,-0.2 15,-0.2 2,-0.1 -0.790 23.6-177.8-101.2 139.3 7.4 24.0 78.5 17 149 A G E - 0 0 37 13,-3.3 3,-0.1 -2,-0.4 -1,-0.1 -0.122 38.3 -35.6-113.4-150.2 7.4 27.0 80.8 18 150 A R E - 0 0 151 1,-0.1 12,-2.7 11,-0.1 -1,-0.3 -0.299 69.6 -89.8 -75.8 156.4 5.7 28.1 84.0 19 151 A P E -A 29 0A 72 0, 0.0 10,-0.3 0, 0.0 -1,-0.1 -0.524 33.5-172.1 -67.1 129.5 2.1 27.2 85.0 20 152 A L E - 0 0 55 8,-2.9 2,-0.3 1,-0.3 9,-0.2 0.735 65.3 -19.1 -89.8 -31.4 -0.4 29.8 83.8 21 153 A G E -A 28 0A 30 7,-1.5 7,-2.8 76,-0.1 2,-0.4 -0.981 54.6-121.3-169.5 161.9 -3.4 28.3 85.6 22 154 A K - 0 0 175 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.882 29.7-179.2-108.8 145.8 -5.0 25.3 87.4 23 155 A G - 0 0 37 3,-0.5 3,-0.4 -2,-0.4 -2,-0.0 -0.903 41.5-110.3-137.6 167.6 -8.2 23.7 86.3 24 156 A K S S+ 0 0 78 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.886 122.4 36.8 -63.3 -39.6 -10.5 20.8 87.4 25 157 A F S S- 0 0 37 1,-0.3 21,-0.5 20,-0.0 2,-0.2 0.349 131.0 -44.2 -98.0 4.0 -9.5 18.9 84.2 26 158 A G E - B 0 45A 11 -3,-0.4 -3,-0.5 19,-0.2 -1,-0.3 -0.782 58.3 -75.5 152.2 168.9 -5.9 20.0 84.1 27 159 A N E - B 0 44A 38 17,-0.6 17,-2.7 -2,-0.2 2,-0.4 -0.606 32.5-140.6 -91.6 152.8 -3.1 22.6 84.4 28 160 A V E -AB 21 43A 28 -7,-2.8 -8,-2.9 15,-0.2 -7,-1.5 -0.946 21.1-170.7-114.7 134.2 -2.2 25.1 81.7 29 161 A Y E -AB 19 42A 64 13,-2.8 13,-2.6 -2,-0.4 2,-0.1 -0.919 28.1-111.6-123.9 148.4 1.4 26.0 81.0 30 162 A L E - B 0 41A 39 -12,-2.7 -13,-3.3 -2,-0.3 2,-0.3 -0.489 45.4-176.3 -65.5 146.8 3.3 28.6 78.9 31 163 A A E -AB 16 40A 3 9,-2.6 9,-2.8 -15,-0.2 2,-0.4 -0.980 23.0-149.8-146.0 158.9 5.0 26.9 76.0 32 164 A R E -AB 15 39A 94 -17,-2.4 -17,-2.7 -2,-0.3 2,-0.3 -0.985 22.1-129.3-132.7 121.7 7.3 27.8 73.0 33 165 A E E > -A 14 0A 2 5,-2.6 4,-2.2 -2,-0.4 5,-0.4 -0.552 23.0-140.0 -69.7 128.2 7.2 26.0 69.7 34 166 A R T 4 S+ 0 0 93 -21,-2.9 -1,-0.1 -2,-0.3 -20,-0.1 0.836 90.3 44.0 -68.8 -39.8 10.8 25.0 69.0 35 167 A Q T 4 S+ 0 0 140 -22,-0.3 -1,-0.2 1,-0.2 -21,-0.0 0.932 128.8 24.7 -68.4 -49.2 11.2 25.6 65.2 36 168 A S T 4 S- 0 0 51 2,-0.1 -2,-0.2 -34,-0.0 -1,-0.2 0.597 94.1-130.5 -93.2 -16.6 9.4 29.0 65.1 37 169 A K < + 0 0 145 -4,-2.2 2,-0.3 1,-0.2 -3,-0.2 0.664 47.4 166.5 64.7 21.3 9.9 30.2 68.7 38 170 A F - 0 0 70 -5,-0.4 -5,-2.6 -6,-0.1 2,-0.4 -0.510 32.2-134.7 -69.4 125.2 6.2 30.9 68.8 39 171 A I E +B 32 0A 78 -2,-0.3 54,-0.4 -7,-0.2 -7,-0.2 -0.692 42.8 140.8 -84.7 130.1 4.9 31.6 72.3 40 172 A L E -B 31 0A 0 -9,-2.8 -9,-2.6 -2,-0.4 2,-0.3 -0.769 44.9-101.7-147.2-171.0 1.6 29.8 73.2 41 173 A A E -BC 30 91A 5 50,-2.5 50,-2.8 -11,-0.2 2,-0.4 -0.947 21.3-156.9-123.4 149.2 -0.2 27.9 76.0 42 174 A L E -BC 29 90A 1 -13,-2.6 -13,-2.8 -2,-0.3 2,-0.5 -0.994 3.5-156.2-124.8 126.0 -0.7 24.2 76.5 43 175 A K E -BC 28 89A 42 46,-1.7 46,-2.4 -2,-0.4 2,-0.7 -0.898 13.1-151.0 -99.2 130.2 -3.5 22.6 78.6 44 176 A V E +BC 27 88A 20 -17,-2.7 -17,-0.6 -2,-0.5 2,-0.3 -0.886 18.3 178.6-108.8 109.4 -2.6 19.2 79.8 45 177 A L E -BC 26 87A 8 42,-3.3 42,-2.9 -2,-0.7 2,-0.4 -0.779 24.8-121.3-110.0 157.3 -5.6 16.8 80.4 46 178 A F E > - C 0 86A 101 -21,-0.5 4,-2.1 -2,-0.3 40,-0.2 -0.844 4.8-144.9-106.8 131.1 -5.6 13.2 81.5 47 179 A K H > S+ 0 0 48 38,-2.4 4,-3.0 -2,-0.4 5,-0.2 0.922 101.5 51.1 -54.4 -52.1 -7.1 10.3 79.5 48 180 A T H > S+ 0 0 105 37,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.859 111.3 50.0 -53.0 -39.6 -8.3 8.3 82.5 49 181 A Q H > S+ 0 0 82 2,-0.2 4,-1.2 -3,-0.2 -1,-0.2 0.883 113.2 43.5 -71.7 -41.7 -10.0 11.5 83.8 50 182 A L H X>S+ 0 0 6 -4,-2.1 5,-2.2 2,-0.2 4,-0.9 0.883 114.4 52.0 -69.2 -41.1 -11.8 12.3 80.5 51 183 A E H ><5S+ 0 0 110 -4,-3.0 3,-0.6 -5,-0.2 -2,-0.2 0.928 109.9 47.5 -58.1 -50.0 -12.8 8.6 80.1 52 184 A K H 3<5S+ 0 0 92 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.806 114.2 46.5 -67.1 -31.7 -14.3 8.3 83.6 53 185 A A H 3<5S- 0 0 53 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.618 107.2-126.9 -84.7 -15.1 -16.3 11.5 83.2 54 186 A G T <<5S+ 0 0 44 -4,-0.9 -3,-0.2 -3,-0.6 -2,-0.1 0.878 72.7 121.8 69.3 43.1 -17.5 10.5 79.7 55 187 A V >< + 0 0 16 -5,-2.2 4,-1.6 1,-0.1 -4,-0.2 0.212 29.1 104.1-122.8 12.8 -16.3 13.8 78.1 56 188 A E H > S+ 0 0 96 -6,-0.5 4,-1.8 1,-0.2 -1,-0.1 0.867 85.4 49.4 -63.3 -39.1 -13.9 12.6 75.4 57 189 A H H > S+ 0 0 121 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.802 107.3 56.4 -68.9 -30.9 -16.5 13.3 72.7 58 190 A Q H > S+ 0 0 52 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.841 106.5 49.3 -67.0 -37.5 -17.0 16.8 74.2 59 191 A L H X S+ 0 0 14 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.911 110.3 50.1 -69.2 -42.8 -13.3 17.5 73.8 60 192 A R H X S+ 0 0 180 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.908 111.5 49.9 -58.3 -44.0 -13.4 16.4 70.2 61 193 A R H X S+ 0 0 60 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.861 108.1 52.4 -63.1 -40.5 -16.4 18.6 69.6 62 194 A E H X S+ 0 0 12 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.935 110.3 47.4 -60.4 -47.5 -14.7 21.6 71.2 63 195 A V H X S+ 0 0 22 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.904 114.6 48.3 -60.4 -42.3 -11.7 21.2 69.0 64 196 A E H X S+ 0 0 106 -4,-2.1 4,-0.5 2,-0.2 -2,-0.2 0.905 111.9 47.6 -63.7 -47.1 -14.1 20.9 66.0 65 197 A I H >X S+ 0 0 6 -4,-3.0 3,-1.4 1,-0.2 4,-1.3 0.936 113.0 49.1 -59.0 -48.0 -16.1 24.0 67.0 66 198 A Q H 3< S+ 0 0 4 -4,-2.8 11,-0.3 1,-0.3 -1,-0.2 0.749 96.5 69.9 -67.6 -25.9 -13.0 26.1 67.5 67 199 A S H 3< S+ 0 0 52 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.737 109.5 37.2 -60.6 -23.0 -11.6 25.0 64.1 68 200 A H H << S+ 0 0 113 -3,-1.4 2,-0.3 -4,-0.5 -2,-0.2 0.746 96.7 91.2 -99.5 -30.6 -14.3 27.1 62.6 69 201 A L < + 0 0 3 -4,-1.3 2,-0.3 62,-0.0 59,-0.0 -0.542 42.2 168.6 -79.2 129.7 -14.6 30.1 65.0 70 202 A R + 0 0 112 -2,-0.3 5,-0.1 6,-0.1 -3,-0.0 -0.904 18.6 132.0-140.5 109.0 -12.4 33.2 64.2 71 203 A H > - 0 0 44 3,-0.4 3,-2.0 -2,-0.3 53,-0.0 -0.966 58.7-123.3-156.8 137.9 -13.1 36.4 66.2 72 204 A P T 3 S+ 0 0 91 0, 0.0 4,-0.1 0, 0.0 78,-0.0 0.682 113.3 52.3 -60.9 -17.9 -10.8 38.9 68.0 73 205 A N T 3 S+ 0 0 16 79,-0.1 80,-2.6 47,-0.1 2,-0.4 0.079 96.3 79.7-106.2 21.8 -12.8 38.3 71.2 74 206 A I B < S-e 153 0B 4 -3,-2.0 -3,-0.4 78,-0.3 2,-0.2 -0.999 82.9-123.7-122.9 129.5 -12.5 34.5 71.1 75 207 A L - 0 0 7 78,-2.8 2,-0.2 -2,-0.4 80,-0.1 -0.501 33.4-114.0 -69.0 132.9 -9.3 32.8 72.3 76 208 A R - 0 0 63 -2,-0.2 16,-2.5 -4,-0.1 2,-0.5 -0.487 21.9-165.1 -72.5 136.1 -7.8 30.5 69.6 77 209 A L E -D 91 0A 4 -11,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.958 7.9-172.8-115.1 105.9 -7.7 26.7 70.0 78 210 A Y E - 0 0 61 12,-2.2 2,-0.3 -2,-0.5 13,-0.1 0.736 50.6 -74.9 -76.9 -27.3 -5.2 25.7 67.2 79 211 A G E -D 90 0A 16 11,-0.9 11,-2.8 2,-0.0 2,-0.3 -0.940 45.5-103.0 158.0-171.9 -5.7 21.9 67.6 80 212 A Y E -D 89 0A 92 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.963 19.9-177.7-143.4 160.6 -4.8 19.0 69.9 81 213 A F E -D 88 0A 18 7,-1.7 7,-3.2 -2,-0.3 2,-0.3 -0.913 12.0-150.0-143.7 172.1 -2.5 15.9 70.2 82 214 A H E -D 87 0A 122 -2,-0.3 5,-0.2 -73,-0.3 2,-0.2 -0.977 7.6-163.5-142.9 157.7 -2.0 13.1 72.7 83 215 A D - 0 0 47 3,-2.3 5,-0.0 -2,-0.3 -73,-0.0 -0.335 58.6 -64.4-112.4-153.0 0.5 10.7 74.2 84 216 A A S S+ 0 0 93 -2,-0.2 3,-0.0 1,-0.2 -2,-0.0 0.904 128.9 8.3 -62.2 -44.0 0.0 7.5 76.1 85 217 A T S S+ 0 0 66 -38,-0.1 -38,-2.4 -39,-0.0 -37,-0.4 0.550 120.2 58.5-118.0 -14.9 -1.7 9.0 79.2 86 218 A R E -C 46 0A 82 -40,-0.2 -3,-2.3 -39,-0.1 2,-0.4 -0.858 55.1-148.4-128.3 153.6 -2.4 12.7 78.4 87 219 A V E -CD 45 82A 10 -42,-2.9 -42,-3.3 -2,-0.3 2,-0.5 -0.976 19.7-154.3-117.8 137.9 -4.2 15.0 75.9 88 220 A Y E -CD 44 81A 7 -7,-3.2 -7,-1.7 -2,-0.4 2,-0.5 -0.950 4.4-153.3-121.5 123.1 -2.8 18.4 75.0 89 221 A L E -CD 43 80A 8 -46,-2.4 -46,-1.7 -2,-0.5 2,-0.8 -0.829 13.6-142.4 -94.2 126.2 -4.7 21.5 73.8 90 222 A I E +CD 42 79A 0 -11,-2.8 -12,-2.2 -2,-0.5 -11,-0.9 -0.796 35.3 178.9 -90.4 111.5 -2.7 24.0 71.7 91 223 A L E -CD 41 77A 27 -50,-2.8 -50,-2.5 -2,-0.8 -14,-0.2 -0.820 35.5-104.7-122.1 150.1 -4.0 27.4 72.8 92 224 A E - 0 0 41 -16,-2.5 2,-0.4 -2,-0.3 -52,-0.1 -0.502 44.5-118.7 -63.3 135.3 -3.4 31.1 72.1 93 225 A Y - 0 0 68 -54,-0.4 -1,-0.1 -2,-0.2 -17,-0.1 -0.693 17.5-155.2 -82.0 129.6 -1.5 32.7 75.1 94 226 A A > - 0 0 13 -2,-0.4 3,-1.9 1,-0.1 51,-0.2 -0.869 7.0-166.6-104.5 96.1 -3.4 35.4 76.9 95 227 A P T 3 S+ 0 0 54 0, 0.0 51,-0.2 0, 0.0 -1,-0.1 0.705 82.7 52.8 -62.3 -24.5 -0.6 37.6 78.5 96 228 A L T 3 S- 0 0 94 49,-1.9 50,-0.2 1,-0.3 6,-0.1 0.360 102.3-140.0 -96.6 6.4 -2.8 39.5 80.8 97 229 A G < - 0 0 29 -3,-1.9 48,-2.1 48,-0.5 -1,-0.3 -0.211 39.6 -20.9 78.9-161.8 -4.4 36.4 82.4 98 230 A T B > -F 144 0B 40 46,-0.2 4,-1.8 1,-0.1 46,-0.3 -0.510 42.0-132.4 -88.0 153.5 -8.0 35.7 83.5 99 231 A V H > S+ 0 0 0 44,-3.0 4,-2.7 41,-0.7 5,-0.2 0.833 109.9 65.3 -66.2 -33.1 -10.8 38.2 84.3 100 232 A Y H > S+ 0 0 97 40,-1.5 4,-1.6 43,-0.5 -1,-0.2 0.925 106.0 40.8 -50.9 -50.2 -11.3 36.0 87.4 101 233 A R H > S+ 0 0 151 2,-0.2 4,-2.1 39,-0.2 -1,-0.2 0.882 111.9 56.1 -69.2 -37.8 -7.8 37.0 88.6 102 234 A E H X S+ 0 0 31 -4,-1.8 4,-2.5 1,-0.2 5,-0.2 0.905 108.2 48.2 -61.5 -40.8 -8.4 40.7 87.5 103 235 A L H X S+ 0 0 11 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.856 108.7 53.6 -67.2 -37.7 -11.6 40.8 89.6 104 236 A Q H < S+ 0 0 91 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.918 113.6 43.8 -59.5 -42.7 -9.8 39.3 92.7 105 237 A K H < S+ 0 0 162 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.906 124.1 32.4 -71.0 -45.6 -7.1 42.0 92.4 106 238 A L H < S- 0 0 74 -4,-2.5 2,-2.3 -5,-0.2 -1,-0.2 0.569 89.2-147.1 -89.5 -11.5 -9.4 45.0 91.8 107 239 A S S < S+ 0 0 81 -4,-1.8 2,-0.3 -5,-0.2 -1,-0.1 -0.288 76.2 11.9 72.8 -54.2 -12.4 43.7 93.9 108 240 A R S S- 0 0 128 -2,-2.3 2,-0.3 -6,-0.1 91,-0.2 -0.981 76.1-123.0-146.2 158.5 -14.9 45.4 91.5 109 241 A F - 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0 0 42 -3,-1.9 15,-0.0 17,-0.1 -35,-0.0 -0.667 64.7-129.9 -92.9 135.7 -26.6 28.9 85.1 173 310 A P >> - 0 0 0 0, 0.0 4,-2.0 0, 0.0 3,-1.1 -0.330 30.9-100.9 -74.9 162.5 -30.1 30.0 84.2 174 311 A P H 3> S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 6,-0.2 0.861 120.5 58.1 -49.0 -44.4 -33.3 28.4 85.7 175 312 A E H 34>S+ 0 0 3 67,-0.2 5,-2.7 1,-0.2 11,-0.0 0.816 110.6 43.3 -63.3 -29.5 -33.9 26.3 82.5 176 313 A M H X45S+ 0 0 39 -3,-1.1 3,-1.2 3,-0.2 -1,-0.2 0.880 112.8 48.9 -80.0 -41.0 -30.5 24.6 82.9 177 314 A I H 3<5S+ 0 0 19 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.1 0.784 112.7 50.1 -69.9 -25.1 -30.5 24.0 86.7 178 315 A E T 3<5S- 0 0 60 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.303 114.8-118.5 -93.0 7.6 -34.0 22.4 86.3 179 316 A G T < 5 + 0 0 71 -3,-1.2 -3,-0.2 1,-0.2 2,-0.1 0.774 64.9 145.0 60.4 31.4 -32.7 20.2 83.4 180 317 A R < - 0 0 112 -5,-2.7 -1,-0.2 -6,-0.2 2,-0.1 -0.393 59.0 -74.0 -92.7 170.5 -35.2 21.7 80.9 181 318 A M + 0 0 154 -2,-0.1 2,-0.3 -18,-0.0 -1,-0.2 -0.391 58.7 179.4 -60.7 141.4 -34.9 22.5 77.2 182 319 A H + 0 0 22 -18,-2.2 -18,-2.4 -2,-0.1 2,-0.1 -0.986 14.6 179.6-150.2 155.3 -32.6 25.5 76.5 183 320 A D > - 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0 0 11 0, 0.0 3,-1.5 0, 0.0 -9,-0.1 -0.352 36.3-114.5 -75.5 155.7 -22.5 37.2 91.5 204 341 A P T 3 S+ 0 0 8 0, 0.0 19,-0.3 0, 0.0 -11,-0.0 0.676 111.1 43.1 -68.4 -20.8 -26.1 37.9 92.4 205 342 A F T 3 S+ 0 0 0 -35,-0.3 11,-0.2 17,-0.1 12,-0.2 0.231 80.3 142.8-107.7 12.8 -27.1 34.3 93.5 206 343 A E < + 0 0 74 -3,-1.5 2,-0.3 -36,-0.1 4,-0.0 -0.185 21.4 157.7 -52.2 138.8 -23.9 33.6 95.5 207 344 A A - 0 0 20 1,-0.0 -37,-0.1 0, 0.0 -2,-0.1 -0.982 55.2-110.0-157.9 164.7 -24.5 31.5 98.6 208 345 A H S S+ 0 0 193 -2,-0.3 2,-0.4 1,-0.0 3,-0.1 0.615 102.3 47.3 -71.5 -14.4 -22.8 29.2 101.1 209 346 A T S > S- 0 0 70 1,-0.1 4,-2.0 -3,-0.0 5,-0.2 -0.971 72.1-135.8-132.8 148.4 -24.8 26.3 99.8 210 347 A Y H > S+ 0 0 129 -2,-0.4 4,-2.8 1,-0.2 5,-0.2 0.896 109.8 57.6 -56.4 -44.2 -25.7 24.8 96.4 211 348 A Q H > S+ 0 0 125 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.873 107.3 45.2 -61.9 -39.6 -29.3 24.5 97.7 212 349 A E H > S+ 0 0 55 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.897 113.0 49.9 -70.6 -42.5 -29.6 28.2 98.5 213 350 A T H X S+ 0 0 5 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.923 111.1 50.8 -59.1 -44.8 -28.1 29.3 95.2 214 351 A Y H X S+ 0 0 80 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.917 110.9 48.6 -55.4 -50.2 -30.6 26.9 93.5 215 352 A R H X S+ 0 0 108 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.921 113.3 46.3 -56.8 -48.1 -33.5 28.4 95.4 216 353 A R H X>S+ 0 0 49 -4,-2.6 5,-2.9 2,-0.2 4,-0.6 0.880 113.0 48.5 -70.9 -36.0 -32.5 32.0 94.6 217 354 A I H ><5S+ 0 0 0 -4,-2.7 3,-1.0 3,-0.2 -1,-0.2 0.944 109.7 52.8 -63.6 -48.7 -31.9 31.3 90.8 218 355 A S H 3<5S+ 0 0 43 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.855 118.9 35.6 -54.9 -39.5 -35.3 29.5 90.5 219 356 A R H 3<5S- 0 0 163 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.495 104.2-127.7 -88.3 -9.4 -37.1 32.5 92.1 220 357 A V T <<5 + 0 0 32 -3,-1.0 2,-0.9 -4,-0.6 -3,-0.2 0.936 49.6 170.5 49.7 51.2 -34.8 35.0 90.4 221 358 A E < + 0 0 84 -5,-2.9 2,-0.3 -6,-0.1 -1,-0.2 -0.811 13.4 119.5-100.7 103.1 -34.4 36.3 93.9 222 359 A F - 0 0 42 -2,-0.9 2,-0.3 -3,-0.1 -17,-0.1 -0.984 40.0-149.5-155.8 161.3 -31.7 39.0 94.2 223 360 A T - 0 0 120 -2,-0.3 -2,-0.0 -19,-0.3 0, 0.0 -0.880 17.8-122.3-129.3 163.4 -31.1 42.6 95.2 224 361 A F - 0 0 39 -2,-0.3 -28,-0.0 4,-0.1 -2,-0.0 -0.857 26.1-117.7-103.0 138.8 -28.6 45.4 94.2 225 362 A P > - 0 0 35 0, 0.0 3,-1.3 0, 0.0 -1,-0.0 -0.299 38.5-100.2 -65.7 165.4 -26.3 47.2 96.5 226 363 A D T 3 S+ 0 0 147 1,-0.3 -2,-0.0 0, 0.0 0, 0.0 0.790 116.2 60.2 -60.8 -32.1 -26.9 51.0 96.8 227 364 A F T 3 S+ 0 0 83 2,-0.1 2,-0.3 -27,-0.0 -1,-0.3 0.649 74.5 105.8 -74.8 -17.8 -24.0 52.0 94.5 228 365 A V S < S- 0 0 6 -3,-1.3 -4,-0.1 1,-0.1 -32,-0.0 -0.506 72.8-127.6 -67.8 126.2 -25.3 50.2 91.4 229 366 A T > - 0 0 51 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.250 15.7-109.7 -77.9 163.4 -26.7 52.9 89.1 230 367 A E H > S+ 0 0 141 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.850 117.1 52.8 -62.5 -37.1 -30.2 52.9 87.5 231 368 A G H > S+ 0 0 25 2,-0.2 4,-2.0 1,-0.2 27,-0.2 0.885 111.4 45.6 -64.7 -41.4 -28.9 52.2 84.0 232 369 A A H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.920 111.3 53.1 -67.1 -46.1 -26.9 49.1 85.2 233 370 A R H X S+ 0 0 57 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.875 108.9 51.5 -52.6 -41.5 -29.9 47.9 87.2 234 371 A D H X S+ 0 0 57 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.932 111.0 45.0 -65.1 -49.3 -32.0 48.2 84.0 235 372 A L H X S+ 0 0 0 -4,-2.0 4,-0.7 2,-0.2 -2,-0.2 0.927 116.7 45.9 -59.5 -48.0 -29.7 46.2 81.8 236 373 A I H >X S+ 0 0 1 -4,-2.5 4,-2.4 1,-0.2 3,-0.9 0.925 112.0 50.4 -64.5 -46.9 -29.2 43.5 84.5 237 374 A S H 3< S+ 0 0 55 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.808 109.6 51.6 -61.7 -29.6 -32.9 43.2 85.3 238 375 A R H 3< S+ 0 0 118 -4,-1.7 10,-1.5 -5,-0.2 -1,-0.2 0.604 114.7 43.1 -86.0 -10.5 -33.8 42.8 81.6 239 376 A L H << S+ 0 0 0 -3,-0.9 2,-1.5 -4,-0.7 -2,-0.2 0.743 103.1 65.0 -95.9 -36.5 -31.2 40.0 81.2 240 377 A L S < S+ 0 0 5 -4,-2.4 2,-0.4 -5,-0.1 -1,-0.2 -0.498 71.9 142.4 -91.7 65.8 -32.0 38.1 84.4 241 378 A K - 0 0 67 -2,-1.5 6,-0.1 -3,-0.2 -21,-0.1 -0.885 52.5-141.2-107.6 136.0 -35.6 37.1 83.4 242 379 A H S S+ 0 0 76 -2,-0.4 2,-0.7 -23,-0.1 -67,-0.2 0.929 93.2 70.3 -60.3 -45.1 -37.0 33.7 84.4 243 380 A N S >> S- 0 0 76 1,-0.2 3,-1.4 -3,-0.1 4,-0.6 -0.664 76.2-155.9 -77.1 111.2 -38.7 33.5 80.9 244 381 A A G >4 S+ 0 0 23 -2,-0.7 3,-1.2 1,-0.3 -1,-0.2 0.849 89.9 58.9 -60.2 -37.9 -35.8 33.0 78.5 245 382 A S G 34 S+ 0 0 93 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.710 101.2 57.1 -64.9 -21.7 -37.8 34.4 75.5 246 383 A Q G <4 S+ 0 0 118 -3,-1.4 -1,-0.2 -5,-0.0 -2,-0.2 0.618 84.0 106.8 -84.6 -16.2 -38.3 37.7 77.5 247 384 A R S << S- 0 0 4 -3,-1.2 -8,-0.2 -4,-0.6 -9,-0.1 -0.313 81.8 -94.1 -62.8 146.1 -34.5 38.3 77.9 248 385 A L - 0 0 22 -10,-1.5 2,-0.2 -13,-0.2 -1,-0.1 -0.164 36.6-122.2 -51.1 150.6 -32.8 41.0 75.9 249 386 A T > - 0 0 57 -3,-0.1 4,-1.5 1,-0.1 5,-0.1 -0.495 27.2-108.2 -86.1 166.7 -31.1 40.0 72.6 250 387 A L H > S+ 0 0 13 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.876 121.9 55.8 -65.6 -36.4 -27.4 40.7 72.1 251 388 A A H > S+ 0 0 71 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.927 107.6 49.7 -57.4 -44.3 -28.3 43.5 69.6 252 389 A E H 4 S+ 0 0 101 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.786 109.7 51.2 -66.3 -32.1 -30.4 45.1 72.4 253 390 A V H >< S+ 0 0 0 -4,-1.5 3,-1.5 2,-0.2 6,-0.2 0.947 109.3 49.4 -65.6 -51.2 -27.5 44.8 74.9 254 391 A L H 3< S+ 0 0 42 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.774 116.2 43.7 -61.5 -27.0 -25.1 46.5 72.5 255 392 A E T 3< S+ 0 0 125 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.353 83.4 127.8 -99.7 3.3 -27.6 49.3 71.9 256 393 A H <> - 0 0 16 -3,-1.5 4,-2.9 -4,-0.2 3,-0.3 -0.399 66.4-126.4 -62.9 134.9 -28.6 49.7 75.6 257 394 A P H > S+ 0 0 97 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.832 109.8 49.9 -51.6 -40.8 -28.2 53.3 76.8 258 395 A W H > S+ 0 0 14 -27,-0.2 4,-1.3 2,-0.2 5,-0.2 0.882 112.4 47.6 -67.4 -39.9 -26.0 52.4 79.7 259 396 A I H > S+ 0 0 2 -3,-0.3 4,-2.5 -6,-0.2 3,-0.3 0.942 112.9 48.8 -63.9 -48.5 -23.7 50.4 77.5 260 397 A K H < S+ 0 0 135 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.897 112.6 48.4 -59.0 -42.2 -23.6 53.2 74.9 261 398 A A H < S+ 0 0 82 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.791 123.2 28.5 -68.0 -30.4 -22.7 55.8 77.6 262 399 A N H < S+ 0 0 23 -4,-1.3 -146,-0.2 -3,-0.3 -2,-0.2 0.669 92.9 95.9-113.2 -23.3 -19.9 53.9 79.3 263 400 A S < 0 0 32 -4,-2.5 -150,-0.1 -148,-0.2 -151,-0.1 -0.484 360.0 360.0 -75.9 144.2 -18.2 51.5 76.8 264 401 A S 0 0 136 -152,-0.4 -1,-0.1 -2,-0.2 -151,-0.0 0.808 360.0 360.0 -93.5 360.0 -15.0 52.6 75.1