==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 17-OCT-08 2W1E . 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, . 252 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13065.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 67.9 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 . 37 14.7 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 . 14 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 78 31.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.0 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 2 0 1 1 1 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 . 1 0 1 0 2 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 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 0 223 0, 0.0 2,-0.3 0, 0.0 73,-0.1 0.000 360.0 360.0 360.0 -68.0 -0.7 17.8 24.2 2 128 A W - 0 0 98 71,-0.4 2,-0.2 2,-0.0 71,-0.0 -0.595 360.0-172.0 -83.5 137.0 -2.2 19.1 20.9 3 129 A A - 0 0 41 -2,-0.3 3,-0.5 71,-0.1 73,-0.1 -0.490 37.2-105.7-107.8-175.7 -4.0 16.9 18.4 4 130 A L S > S+ 0 0 67 1,-0.2 3,-1.3 -2,-0.2 -2,-0.0 0.686 113.1 67.0 -86.8 -22.8 -5.3 17.6 14.9 5 131 A E T 3 S+ 0 0 159 1,-0.3 -1,-0.2 3,-0.1 3,-0.0 0.238 87.5 72.0 -85.8 15.1 -8.9 17.9 15.9 6 132 A D T 3 S+ 0 0 34 -3,-0.5 21,-3.3 21,-0.1 2,-0.3 0.381 95.1 65.4 -99.1 -3.9 -8.0 21.0 17.9 7 133 A F E < -A 26 0A 7 -3,-1.3 2,-0.6 19,-0.2 19,-0.2 -0.884 65.2-144.9-129.3 148.9 -7.5 23.0 14.7 8 134 A E E -A 25 0A 90 17,-2.5 17,-2.6 -2,-0.3 2,-0.2 -0.970 28.6-143.3-109.8 114.5 -9.3 24.4 11.7 9 135 A I E +A 24 0A 82 -2,-0.6 15,-0.2 15,-0.2 2,-0.1 -0.482 28.1 169.4 -76.6 145.0 -7.1 24.2 8.7 10 136 A G E - 0 0 37 13,-2.9 -1,-0.1 1,-0.4 3,-0.1 -0.293 40.9 -6.7-133.1-144.3 -7.4 27.0 6.3 11 137 A R E S- 0 0 168 11,-0.1 12,-2.8 -2,-0.1 -1,-0.4 -0.199 73.3-111.0 -60.7 142.1 -5.7 28.5 3.3 12 138 A P E -A 22 0A 82 0, 0.0 10,-0.3 0, 0.0 -1,-0.1 -0.574 27.8-171.4 -75.1 142.7 -2.5 26.9 2.4 13 139 A L E - 0 0 67 8,-3.4 2,-0.3 1,-0.3 9,-0.2 0.718 57.7 -5.6-103.5 -32.1 0.5 29.0 2.9 14 140 A G E -A 21 0A 20 7,-2.0 7,-1.7 2,-0.0 -1,-0.3 -0.999 42.9-142.2-166.4 160.9 3.2 26.9 1.3 15 141 A K + 0 0 175 -2,-0.3 2,-0.1 5,-0.2 3,-0.1 0.098 28.3 151.8 -97.2-148.5 4.7 23.9 -0.5 16 142 A G > - 0 0 55 1,-0.1 3,-1.0 2,-0.1 -2,-0.0 -0.307 60.0 -76.0 120.7 153.2 8.1 22.3 -0.1 17 143 A K T 3 S+ 0 0 150 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 0.740 125.4 40.1 -52.0 -34.0 9.6 18.8 -0.4 18 144 A F T 3 S- 0 0 55 1,-0.2 21,-1.0 -3,-0.1 2,-0.3 0.656 122.9 -72.2 -97.0 -19.3 8.2 17.3 2.8 19 145 A G E < - B 0 38A 14 -3,-1.0 2,-0.3 19,-0.2 19,-0.2 -0.978 58.4 -53.7 163.1-146.2 4.7 18.8 2.8 20 146 A N E - B 0 37A 56 17,-1.0 17,-3.9 -2,-0.3 2,-0.4 -0.865 24.4-137.2-129.2 156.9 2.8 22.0 3.3 21 147 A V E -AB 14 36A 22 -7,-1.7 -8,-3.4 -2,-0.3 -7,-2.0 -0.951 26.9-170.6-110.2 140.8 2.1 24.8 5.7 22 148 A Y E -AB 12 35A 61 13,-3.2 13,-3.8 -2,-0.4 2,-0.2 -0.981 28.7-116.4-130.2 142.9 -1.4 26.0 6.3 23 149 A L E + B 0 34A 37 -12,-2.8 -13,-2.9 -2,-0.4 2,-0.3 -0.500 48.7 175.1 -60.8 140.5 -3.0 28.9 8.0 24 150 A A E -AB 9 33A 2 9,-2.6 9,-2.1 -15,-0.2 2,-0.5 -0.991 27.2-135.5-154.4 156.0 -5.0 27.3 10.8 25 151 A R E -AB 8 32A 99 -17,-2.6 -17,-2.5 -2,-0.3 2,-0.5 -0.965 21.0-126.0-120.9 129.4 -7.2 28.3 13.8 26 152 A E E >> -AB 7 31A 20 5,-2.8 4,-1.9 -2,-0.5 5,-0.5 -0.575 25.3-141.3 -73.4 122.3 -7.1 26.8 17.3 27 153 A K T 45S+ 0 0 85 -21,-3.3 -1,-0.1 -2,-0.5 -20,-0.1 0.864 91.2 34.5 -58.8 -48.2 -10.6 25.8 17.9 28 154 A Q T 45S+ 0 0 167 -22,-0.3 -1,-0.2 1,-0.2 -21,-0.1 0.628 127.2 38.2 -87.9 -13.9 -11.1 26.7 21.6 29 155 A S T 45S- 0 0 63 -3,-0.5 -2,-0.2 2,-0.1 -1,-0.2 0.545 91.8-134.5-109.0 -16.0 -8.9 29.8 21.6 30 156 A K T <5 + 0 0 159 -4,-1.9 2,-0.2 1,-0.2 -3,-0.2 0.655 51.8 161.4 57.1 19.8 -9.8 31.2 18.2 31 157 A F E < -B 26 0A 95 -5,-0.5 -5,-2.8 -6,-0.1 2,-0.4 -0.463 33.7-136.9 -77.3 135.2 -6.0 31.6 17.9 32 158 A I E +B 25 0A 73 -7,-0.2 54,-0.4 -2,-0.2 2,-0.3 -0.731 39.7 132.0 -95.3 139.7 -4.3 32.1 14.5 33 159 A L E -B 24 0A 6 -9,-2.1 -9,-2.6 -2,-0.4 2,-0.4 -0.952 49.7 -92.2-165.6 178.5 -1.2 30.3 13.5 34 160 A A E -BC 23 84A 8 50,-3.1 50,-4.1 -2,-0.3 2,-0.6 -0.913 24.6-152.3-112.5 135.1 0.6 28.3 10.8 35 161 A L E -BC 22 83A 1 -13,-3.8 -13,-3.2 -2,-0.4 2,-0.5 -0.944 4.2-158.4-105.4 116.9 0.6 24.6 10.6 36 162 A K E -BC 21 82A 43 46,-3.0 46,-2.9 -2,-0.6 2,-0.6 -0.803 14.6-153.9 -88.9 127.8 3.6 23.0 8.9 37 163 A V E +BC 20 81A 17 -17,-3.9 -17,-1.0 -2,-0.5 2,-0.3 -0.936 19.3 170.1-117.4 118.7 2.6 19.5 7.8 38 164 A L E -BC 19 80A 25 42,-2.8 42,-4.2 -2,-0.6 2,-0.4 -0.950 26.3-121.9-133.1 144.3 5.3 16.8 7.4 39 165 A F E > - C 0 79A 49 -21,-1.0 4,-1.9 -2,-0.3 40,-0.3 -0.675 8.9-149.2 -95.2 134.3 5.2 13.1 6.8 40 166 A K H > S+ 0 0 64 38,-1.1 4,-0.9 -2,-0.4 39,-0.2 0.749 108.0 58.1 -62.5 -24.7 6.7 10.3 8.9 41 167 A A H >> S+ 0 0 62 37,-0.9 4,-1.3 2,-0.1 3,-1.1 0.987 110.6 32.6 -59.7 -82.1 7.0 8.9 5.4 42 168 A Q H 3> S+ 0 0 81 1,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.620 114.1 63.1 -60.3 -14.6 9.0 11.5 3.6 43 169 A L H 3<>S+ 0 0 9 -4,-1.9 5,-1.5 1,-0.2 6,-0.5 0.888 110.2 36.6 -75.8 -43.0 11.1 12.3 6.8 44 170 A E H X<5S+ 0 0 116 -3,-1.1 3,-0.6 -4,-0.9 -2,-0.2 0.576 114.2 60.4 -85.7 -15.4 12.6 8.9 7.1 45 171 A K H 3<5S+ 0 0 186 -4,-1.3 2,-2.0 1,-0.2 -2,-0.2 0.973 117.1 27.8 -72.1 -76.2 12.8 8.6 3.3 46 172 A A T 3<5S- 0 0 38 -4,-1.4 -1,-0.2 1,-0.0 -2,-0.1 -0.396 114.2-130.0 -79.3 60.8 15.1 11.7 2.8 47 173 A G T < 5 + 0 0 41 -2,-2.0 -3,-0.2 -3,-0.6 -4,-0.1 0.297 63.9 125.8 -26.0 112.4 16.4 10.9 6.3 48 174 A V >>< + 0 0 28 -5,-1.5 4,-1.7 2,-0.1 3,-0.8 0.334 20.9 122.2-150.9 1.6 16.4 14.0 8.5 49 175 A E H 3> S+ 0 0 65 -6,-0.5 4,-1.6 1,-0.3 5,-0.1 0.686 78.4 58.6 -53.2 -24.8 14.3 13.2 11.7 50 176 A H H 3> S+ 0 0 127 2,-0.2 4,-0.8 1,-0.2 -1,-0.3 0.977 106.5 45.7 -61.8 -59.3 17.4 14.0 13.7 51 177 A Q H <> S+ 0 0 40 -3,-0.8 4,-2.9 1,-0.2 -2,-0.2 0.781 109.1 60.9 -55.5 -33.3 17.5 17.6 12.3 52 178 A L H X S+ 0 0 18 -4,-1.7 4,-3.2 2,-0.2 5,-0.2 0.998 106.2 39.3 -57.3 -71.4 13.8 17.9 12.9 53 179 A R H X S+ 0 0 154 -4,-1.6 4,-0.8 1,-0.3 -1,-0.2 0.498 114.1 59.2 -71.7 0.5 13.6 17.4 16.6 54 180 A R H X S+ 0 0 87 -4,-0.8 4,-3.4 2,-0.2 -1,-0.3 0.876 107.6 42.7 -79.5 -58.0 16.7 19.5 16.7 55 181 A E H X S+ 0 0 19 -4,-2.9 4,-2.9 1,-0.2 5,-0.4 0.926 114.4 53.3 -50.2 -45.5 14.8 22.4 15.0 56 182 A V H X S+ 0 0 18 -4,-3.2 4,-0.7 1,-0.2 -1,-0.2 0.942 112.8 44.3 -54.8 -49.0 12.0 21.5 17.3 57 183 A E H X S+ 0 0 104 -4,-0.8 4,-2.2 -5,-0.2 -2,-0.2 0.946 119.2 39.9 -58.4 -52.2 14.4 21.8 20.2 58 184 A I H X S+ 0 0 18 -4,-3.4 4,-0.5 1,-0.2 -2,-0.2 0.911 115.5 46.3 -73.2 -46.0 16.1 25.0 19.0 59 185 A Q H < S+ 0 0 2 -4,-2.9 11,-0.8 -5,-0.3 -1,-0.2 0.605 115.4 53.6 -77.4 -9.5 13.2 27.1 17.7 60 186 A S H < S+ 0 0 45 -4,-0.7 -2,-0.2 -5,-0.4 10,-0.2 0.945 106.0 44.4 -82.2 -68.0 11.3 26.1 20.9 61 187 A H H < S+ 0 0 125 -4,-2.2 2,-0.3 -5,-0.2 -2,-0.2 0.508 102.7 96.4 -60.5 -3.4 13.8 27.2 23.7 62 188 A L < + 0 0 8 -4,-0.5 2,-0.3 -5,-0.2 8,-0.3 -0.644 49.6 179.9 -92.4 146.5 14.2 30.4 21.7 63 189 A R + 0 0 128 -2,-0.3 5,-0.1 6,-0.1 -3,-0.1 -0.898 21.7 128.5-147.7 117.4 12.4 33.7 22.2 64 190 A H > - 0 0 37 3,-0.4 3,-2.0 -2,-0.3 -2,-0.0 -0.931 59.1-119.5-167.1 143.8 12.9 36.8 20.2 65 191 A P T 3 S+ 0 0 85 0, 0.0 4,-0.1 0, 0.0 78,-0.1 0.649 116.2 45.8 -60.2 -16.7 10.7 39.3 18.3 66 192 A N T 3 S+ 0 0 15 79,-0.1 80,-1.1 47,-0.1 2,-0.4 -0.132 97.4 81.6-121.3 30.7 12.6 38.4 15.1 67 193 A I B < S-e 146 0B 4 -3,-2.0 -3,-0.4 78,-0.2 80,-0.2 -0.985 88.6-110.3-132.1 132.2 12.5 34.7 15.4 68 194 A L - 0 0 3 78,-1.4 -2,-0.1 -2,-0.4 2,-0.0 -0.364 37.0-123.1 -63.5 121.5 9.4 32.8 14.4 69 195 A R - 0 0 68 -2,-0.2 16,-2.5 -4,-0.1 2,-0.5 -0.408 18.5-154.9 -60.7 138.3 7.8 31.4 17.5 70 196 A L E -D 84 0A 3 -11,-0.8 14,-0.2 -8,-0.3 3,-0.1 -0.997 11.1-175.7-111.3 124.2 7.4 27.7 17.5 71 197 A Y E - 0 0 90 12,-2.8 2,-0.3 -2,-0.5 13,-0.2 0.897 51.0 -62.0 -87.9 -42.5 4.6 26.9 19.8 72 198 A G E -D 83 0A 19 11,-1.0 11,-1.4 2,-0.0 2,-0.3 -0.887 44.2-125.1-175.5-160.0 4.6 23.1 19.7 73 199 A Y E -D 82 0A 110 -2,-0.3 -71,-0.4 9,-0.2 2,-0.3 -0.979 13.2-176.1-165.0 170.2 4.3 20.0 17.6 74 200 A F E -D 81 0A 17 7,-2.1 7,-4.8 -2,-0.3 2,-0.3 -0.911 8.6-153.7-175.1 150.0 2.6 16.6 17.2 75 201 A H E -D 80 0A 107 5,-0.3 5,-0.3 -2,-0.3 3,-0.1 -0.869 7.4-178.3-124.7 159.2 2.5 13.5 15.1 76 202 A D - 0 0 67 3,-3.1 -1,-0.1 -2,-0.3 -73,-0.0 0.026 57.2 -66.7-118.2-130.2 -0.2 10.9 14.3 77 203 A A S S+ 0 0 80 -2,-0.1 -37,-0.2 3,-0.0 -1,-0.1 0.847 130.3 31.4 -81.8 -73.8 0.3 7.8 12.1 78 204 A T S S+ 0 0 75 -39,-0.1 -38,-1.1 -38,-0.1 -37,-0.9 0.631 123.2 5.0 -60.6 -25.3 0.9 9.3 8.8 79 205 A R E -C 39 0A 85 -40,-0.3 -3,-3.1 -39,-0.2 2,-0.4 -0.948 53.4-115.5-161.8 166.3 2.6 12.5 9.9 80 206 A V E -CD 38 75A 7 -42,-4.2 -42,-2.8 -2,-0.3 2,-0.4 -0.960 30.3-152.7-117.4 134.1 4.2 15.2 12.1 81 207 A Y E -CD 37 74A 7 -7,-4.8 -7,-2.1 -2,-0.4 2,-0.5 -0.907 4.1-155.5-118.0 134.3 2.8 18.7 12.6 82 208 A L E -CD 36 73A 4 -46,-2.9 -46,-3.0 -2,-0.4 2,-1.0 -0.931 8.0-150.5-114.3 122.9 4.4 22.0 13.5 83 209 A I E -CD 35 72A 5 -11,-1.4 -12,-2.8 -2,-0.5 -11,-1.0 -0.752 29.0-178.3 -94.7 100.3 2.5 24.7 15.2 84 210 A L E -CD 34 70A 10 -50,-4.1 -50,-3.1 -2,-1.0 -14,-0.2 -0.720 36.0-104.7-107.4 147.9 4.1 27.9 14.1 85 211 A E - 0 0 28 -16,-2.5 2,-0.4 -2,-0.3 -52,-0.2 -0.433 46.1-125.9 -51.5 139.4 3.6 31.6 14.7 86 212 A Y - 0 0 70 -54,-0.4 -17,-0.1 -2,-0.1 -54,-0.1 -0.830 15.3-150.9-102.0 137.0 1.9 32.9 11.6 87 213 A A > - 0 0 9 -2,-0.4 3,-1.6 1,-0.2 51,-0.3 -0.876 3.2-155.9-117.0 98.2 3.5 35.8 9.8 88 214 A P T 3 S+ 0 0 53 0, 0.0 51,-0.2 0, 0.0 -1,-0.2 0.749 84.4 49.3 -38.9 -55.0 1.0 38.0 8.0 89 215 A L T 3 S- 0 0 94 49,-1.0 50,-0.1 1,-0.2 6,-0.1 0.130 95.5-141.4 -90.3 19.8 3.1 39.6 5.3 90 216 A G < - 0 0 30 -3,-1.6 48,-1.8 48,-0.4 -1,-0.2 -0.106 46.1 -9.0 62.9-152.5 4.9 36.5 3.9 91 217 A T B > -F 137 0B 35 46,-0.2 4,-1.5 1,-0.1 46,-0.2 -0.429 41.3-137.3 -91.3 152.6 8.5 36.3 2.8 92 218 A V H > S+ 0 0 0 44,-3.1 4,-1.1 41,-0.7 42,-0.2 0.764 108.3 65.6 -68.1 -28.8 11.2 38.8 2.3 93 219 A Y H >> S+ 0 0 85 40,-0.8 4,-2.0 43,-0.4 3,-1.1 0.979 102.0 42.9 -56.1 -57.7 11.8 36.8 -0.8 94 220 A R H 3> S+ 0 0 141 1,-0.3 4,-2.7 2,-0.2 6,-0.2 0.856 109.3 56.6 -63.5 -36.9 8.5 37.6 -2.4 95 221 A E H 3X S+ 0 0 45 -4,-1.5 4,-3.0 1,-0.2 -1,-0.3 0.801 108.8 50.8 -61.3 -26.1 8.8 41.3 -1.5 96 222 A L H - 0 0 80 -2,-0.2 4,-2.8 1,-0.1 5,-0.2 -0.292 35.6-100.2 -83.3 176.4 16.4 50.7 -0.7 104 230 A E H > S+ 0 0 55 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.872 119.2 52.2 -70.5 -37.1 19.1 51.4 1.8 105 231 A Q H > S+ 0 0 80 2,-0.2 4,-1.5 1,-0.2 147,-0.8 0.851 113.9 43.6 -73.0 -35.5 16.9 52.2 4.7 106 232 A R H > S+ 0 0 60 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.939 115.0 48.8 -68.8 -53.8 14.9 49.1 4.3 107 233 A T H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.929 113.1 47.8 -51.1 -48.3 17.9 46.9 3.7 108 234 A A H X S+ 0 0 0 -4,-3.0 4,-2.5 2,-0.2 -1,-0.2 0.868 109.6 52.6 -66.1 -36.8 19.6 48.4 6.8 109 235 A T H X S+ 0 0 19 -4,-1.5 4,-3.0 141,-0.3 5,-0.3 0.953 110.5 46.8 -64.8 -52.1 16.6 48.0 9.0 110 236 A Y H X S+ 0 0 10 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.918 109.3 56.7 -52.0 -46.4 16.3 44.3 8.1 111 237 A I H X S+ 0 0 1 -4,-2.4 4,-3.9 -5,-0.3 -2,-0.2 0.918 111.0 42.1 -56.5 -47.9 20.0 44.0 8.7 112 238 A T H X S+ 0 0 19 -4,-2.5 4,-3.1 2,-0.3 5,-0.5 0.984 113.9 50.4 -58.5 -61.2 19.7 45.3 12.2 113 239 A E H X S+ 0 0 20 -4,-3.0 4,-1.5 1,-0.3 -2,-0.2 0.859 117.7 43.9 -41.8 -37.6 16.5 43.3 12.9 114 240 A L H X S+ 0 0 1 -4,-2.6 4,-3.3 -5,-0.3 -2,-0.3 0.916 110.2 52.6 -81.3 -45.4 18.6 40.4 11.6 115 241 A A H X S+ 0 0 0 -4,-3.9 4,-2.3 2,-0.2 -2,-0.2 0.957 113.1 44.0 -54.0 -56.1 21.8 41.3 13.5 116 242 A N H X S+ 0 0 62 -4,-3.1 4,-2.9 1,-0.3 5,-0.2 0.906 113.0 52.0 -57.4 -46.6 20.0 41.4 16.8 117 243 A A H X S+ 0 0 0 -4,-1.5 4,-1.2 -5,-0.5 -1,-0.3 0.939 112.9 44.7 -52.5 -49.8 18.1 38.3 16.0 118 244 A L H X S+ 0 0 3 -4,-3.3 4,-2.2 1,-0.2 -1,-0.2 0.829 110.0 58.3 -66.0 -30.1 21.4 36.6 15.2 119 245 A S H X S+ 0 0 51 -4,-2.3 4,-2.6 -5,-0.3 -2,-0.2 0.937 102.4 50.3 -67.5 -48.9 22.8 38.1 18.3 120 246 A Y H X S+ 0 0 56 -4,-2.9 4,-1.0 1,-0.2 -1,-0.2 0.838 113.0 49.1 -54.9 -34.4 20.2 36.5 20.6 121 247 A C H <>S+ 0 0 11 -4,-1.2 5,-3.2 -5,-0.2 -1,-0.2 0.864 110.0 47.7 -80.1 -39.6 21.0 33.2 18.9 122 248 A H H ><5S+ 0 0 24 -4,-2.2 3,-2.4 3,-0.2 -2,-0.2 0.884 106.0 60.5 -66.2 -39.7 24.7 33.4 19.2 123 249 A S H 3<5S+ 0 0 89 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.867 109.3 42.8 -53.2 -38.2 24.2 34.4 22.8 124 250 A K T 3<5S- 0 0 121 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.075 123.4-108.2 -99.2 23.8 22.5 31.0 23.3 125 251 A R T < 5S+ 0 0 165 -3,-2.4 2,-0.4 1,-0.2 -3,-0.2 0.800 72.3 140.1 48.2 44.1 25.3 29.3 21.2 126 252 A V < - 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0 0 102 -3,-0.6 6,-0.1 2,-0.1 -21,-0.1 -0.552 55.0-132.9 -74.2 140.2 36.0 38.6 4.2 230 366 A H S S+ 0 0 66 -2,-0.2 -67,-0.2 -68,-0.1 -1,-0.1 0.856 91.9 69.3 -61.5 -38.2 37.4 35.1 3.3 231 367 A N S > S- 0 0 69 1,-0.2 3,-1.4 -69,-0.1 4,-0.3 -0.730 76.8-145.5 -89.4 120.9 38.9 34.7 6.8 232 368 A P G > S+ 0 0 25 0, 0.0 3,-2.8 0, 0.0 -1,-0.2 0.936 96.8 62.2 -46.6 -52.2 36.3 34.3 9.6 233 369 A S G 3 S+ 0 0 95 1,-0.3 -3,-0.0 -3,-0.1 -2,-0.0 0.728 96.3 56.5 -46.1 -35.1 38.5 36.2 12.0 234 370 A Q G < S+ 0 0 106 -3,-1.4 -1,-0.3 -7,-0.0 -4,-0.1 0.469 83.9 111.5 -84.1 0.9 38.4 39.5 10.0 235 371 A R S < S- 0 0 5 -3,-2.8 -8,-0.2 -4,-0.3 -9,-0.1 -0.578 71.8-113.3 -79.8 133.3 34.6 39.5 10.1 236 372 A P - 0 0 13 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.107 28.5-104.9 -50.6 170.3 33.0 42.3 12.2 237 373 A M > - 0 0 80 1,-0.1 4,-3.1 -61,-0.0 3,-0.4 -0.804 26.7-116.1 -97.1 147.7 31.1 41.7 15.3 238 374 A L H > S+ 0 0 1 -2,-0.4 4,-3.5 1,-0.3 5,-0.2 0.870 120.9 60.3 -49.4 -34.7 27.4 42.0 15.2 239 375 A R H > S+ 0 0 178 2,-0.2 4,-3.1 1,-0.2 -1,-0.3 0.957 106.7 41.8 -52.4 -58.0 28.1 44.9 17.5 240 376 A E H > S+ 0 0 108 -3,-0.4 4,-0.5 1,-0.2 -2,-0.2 0.876 113.1 55.4 -61.6 -36.8 30.2 46.7 14.9 241 377 A V H >< S+ 0 0 2 -4,-3.1 3,-0.9 2,-0.2 -2,-0.2 0.933 111.4 42.7 -62.4 -47.6 27.6 45.7 12.4 242 378 A L H 3< S+ 0 0 38 -4,-3.5 -2,-0.2 1,-0.2 -1,-0.2 0.905 118.0 48.3 -59.4 -43.4 24.9 47.4 14.5 243 379 A E H 3< S+ 0 0 121 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.412 81.0 125.7 -81.7 -0.2 27.3 50.3 15.1 244 380 A H S+ 0 0 15 -27,-0.2 4,-0.5 2,-0.1 -138,-0.1 0.692 112.0 50.4 -95.3 -26.9 25.7 53.3 7.2 247 383 A I H >> S+ 0 0 1 -3,-0.4 4,-2.7 2,-0.2 3,-1.6 0.987 116.5 38.7 -66.0 -61.5 23.6 51.0 9.3 248 384 A T H 3< S+ 0 0 91 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.1 0.667 114.4 55.8 -68.8 -17.7 22.8 53.7 11.9 249 385 A A H 34 S+ 0 0 73 -5,-0.3 -1,-0.3 -4,-0.2 -2,-0.2 0.670 123.6 24.2 -82.0 -18.5 22.5 56.4 9.2 250 386 A N H << S+ 0 0 32 -3,-1.6 2,-0.8 -4,-0.5 -141,-0.3 0.533 88.3 109.5-125.8 -15.1 19.8 54.3 7.4 251 387 A S < - 0 0 22 -4,-2.7 -145,-0.1 -143,-0.2 -146,-0.1 -0.617 43.5-168.5 -77.9 109.8 18.1 52.0 9.8 252 388 A S 0 0 108 -2,-0.8 -1,-0.2 -147,-0.8 -146,-0.1 0.794 360.0 360.0 -67.3 -31.1 14.5 53.2 10.4 253 389 A K 0 0 180 -3,-0.1 -143,-0.0 0, 0.0 -2,-0.0 0.051 360.0 360.0 -89.4 360.0 14.3 50.8 13.4