==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 22-JUN-08 3DJ7 . COMPND 2 MOLECULE: SERINE/THREONINE KINASE 6; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR R.A.ELLING,W.YANG,D.A.ERLANSON,B.T.TANGONAN,S.K.HANSEN, . 257 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12708.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 166 64.6 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 14.4 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 . 22 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 31.1 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 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 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 . 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 1 139 A R 0 0 128 0, 0.0 2,-0.8 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 142.0 -1.6 18.9 26.0 2 140 A Q - 0 0 100 73,-0.0 73,-0.1 2,-0.0 2,-0.0 -0.859 360.0-140.2 -98.4 101.5 -1.1 16.1 23.4 3 141 A W - 0 0 95 -2,-0.8 2,-0.3 71,-0.2 73,-0.2 -0.268 21.0-174.5 -69.4 143.0 -2.2 17.8 20.2 4 142 A T > - 0 0 75 71,-0.1 3,-2.1 1,-0.0 4,-0.2 -0.934 38.9-113.3-129.4 158.0 -4.2 16.1 17.4 5 143 A L G > S+ 0 0 65 -2,-0.3 3,-1.8 1,-0.3 5,-0.1 0.793 113.8 69.2 -59.1 -29.1 -5.2 17.3 13.9 6 144 A E G 3 S+ 0 0 136 1,-0.3 -1,-0.3 3,-0.0 22,-0.0 0.586 86.8 68.5 -66.8 -10.8 -8.8 17.2 15.1 7 145 A D G < S+ 0 0 37 -3,-2.1 21,-2.6 20,-0.1 2,-0.4 0.566 96.2 68.8 -79.9 -9.5 -7.9 20.2 17.4 8 146 A F E < -A 27 0A 4 -3,-1.8 2,-0.6 19,-0.2 19,-0.2 -0.896 66.7-143.9-124.7 140.6 -7.5 22.4 14.3 9 147 A D E -A 26 0A 56 17,-2.9 17,-2.2 -2,-0.4 2,-0.3 -0.899 33.0-137.6 -91.8 118.5 -9.5 24.1 11.6 10 148 A I E -A 25 0A 91 -2,-0.6 15,-0.2 15,-0.2 2,-0.1 -0.629 25.6-178.3 -83.1 133.3 -7.4 24.1 8.5 11 149 A G E - 0 0 37 13,-3.9 -1,-0.1 -2,-0.3 3,-0.1 -0.041 38.5 -38.1-106.3-149.1 -7.3 27.2 6.3 12 150 A R E - 0 0 148 1,-0.1 12,-2.4 11,-0.1 -1,-0.2 -0.407 69.1 -89.4 -79.7 153.0 -5.7 28.3 3.0 13 151 A P E -A 23 0A 76 0, 0.0 10,-0.3 0, 0.0 -1,-0.1 -0.416 31.5-169.6 -62.6 131.0 -2.1 27.3 2.0 14 152 A L E - 0 0 54 8,-3.6 2,-0.3 1,-0.4 9,-0.2 0.608 62.5 -48.4 -94.3 -17.9 0.5 29.8 3.2 15 153 A G E -A 22 0A 33 7,-1.3 7,-3.0 76,-0.1 2,-0.5 -0.912 51.5 -91.0 164.9 170.5 3.3 28.2 1.1 16 154 A K E +A 21 0A 185 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.954 50.2 178.0-110.2 123.6 5.2 25.2 -0.0 17 155 A G - 0 0 40 3,-2.3 4,-0.1 -2,-0.5 -1,-0.0 -0.077 40.7 -57.6-111.8-154.4 8.3 24.3 2.1 18 156 A K S S- 0 0 59 1,-0.2 3,-0.1 -2,-0.1 21,-0.0 0.917 125.6 -1.2 -59.9 -57.4 11.1 21.9 2.6 19 157 A F S S- 0 0 58 1,-0.2 21,-0.8 2,-0.0 2,-0.3 0.126 133.7 -13.9-124.0 17.4 9.3 18.5 3.1 20 158 A G S S- 0 0 13 19,-0.2 -3,-2.3 2,-0.0 -1,-0.2 -0.964 80.8 -58.9 165.7-179.0 5.7 19.7 2.8 21 159 A N E -A 16 0A 50 17,-0.4 17,-2.7 -2,-0.3 2,-0.5 -0.517 33.9-133.8 -92.5 153.4 3.2 22.6 2.7 22 160 A V E -AB 15 37A 30 -7,-3.0 -8,-3.6 15,-0.2 -7,-1.3 -0.923 25.7-169.1-106.7 126.3 2.4 25.2 5.3 23 161 A Y E -AB 13 36A 67 13,-3.2 13,-3.0 -2,-0.5 2,-0.2 -0.869 25.4-115.0-116.3 147.3 -1.3 25.9 6.0 24 162 A L E - B 0 35A 36 -12,-2.4 -13,-3.9 -2,-0.3 2,-0.3 -0.550 44.4-176.6 -71.1 143.8 -3.1 28.6 8.0 25 163 A A E -AB 10 34A 2 9,-2.8 9,-3.2 -15,-0.2 2,-0.4 -0.995 24.9-151.2-149.5 151.5 -4.9 27.1 11.0 26 164 A R E -AB 9 33A 87 -17,-2.2 -17,-2.9 -2,-0.3 2,-0.4 -0.987 23.2-129.0-127.5 123.3 -7.2 27.9 13.9 27 165 A E E > -A 8 0A 18 5,-2.4 4,-2.2 -2,-0.4 5,-0.5 -0.578 22.6-140.7 -68.2 122.0 -7.2 26.1 17.3 28 166 A R T 4 S+ 0 0 93 -21,-2.6 -1,-0.1 -2,-0.4 -20,-0.1 0.793 90.9 46.5 -62.5 -36.4 -10.9 25.2 17.8 29 167 A Q T 4 S+ 0 0 160 -22,-0.3 -1,-0.2 1,-0.1 -21,-0.0 0.946 127.6 21.5 -72.2 -51.1 -11.1 25.8 21.6 30 168 A S T 4 S- 0 0 78 2,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.553 95.0-127.8 -96.9 -11.5 -9.4 29.2 21.9 31 169 A K < + 0 0 140 -4,-2.2 2,-0.2 1,-0.2 -3,-0.2 0.707 48.7 167.4 66.2 24.1 -9.8 30.4 18.3 32 170 A F - 0 0 109 -5,-0.5 -5,-2.4 1,-0.1 2,-0.4 -0.498 32.0-131.4 -73.6 133.6 -6.1 31.1 18.2 33 171 A I E +B 26 0A 77 -2,-0.2 54,-0.5 -7,-0.2 2,-0.2 -0.749 42.5 143.0 -92.5 129.0 -4.6 31.7 14.7 34 172 A L E -B 25 0A 5 -9,-3.2 -9,-2.8 -2,-0.4 2,-0.4 -0.812 43.9-105.1-146.8-177.9 -1.5 29.8 13.8 35 173 A A E -BC 24 85A 5 50,-2.7 50,-3.1 -2,-0.2 2,-0.5 -0.971 22.0-160.6-121.0 139.1 0.4 28.0 11.0 36 174 A L E -BC 23 84A 1 -13,-3.0 -13,-3.2 -2,-0.4 2,-0.5 -0.979 3.6-157.9-119.0 122.4 0.8 24.2 10.5 37 175 A K E -BC 22 83A 24 46,-1.5 46,-2.3 -2,-0.5 2,-0.7 -0.880 12.7-150.2 -95.9 126.8 3.5 22.7 8.4 38 176 A V E + C 0 82A 21 -17,-2.7 -17,-0.4 -2,-0.5 2,-0.3 -0.867 18.0 180.0-102.9 112.0 2.6 19.2 7.2 39 177 A L E - C 0 81A 9 42,-3.4 42,-3.2 -2,-0.7 2,-0.4 -0.751 24.2-123.8-105.7 156.4 5.6 16.9 6.7 40 178 A F E > - C 0 80A 103 -21,-0.8 4,-1.8 -2,-0.3 40,-0.3 -0.874 7.2-142.5-104.6 134.7 5.5 13.2 5.5 41 179 A K H > S+ 0 0 59 38,-3.2 4,-2.4 -2,-0.4 5,-0.2 0.869 100.6 54.0 -59.3 -43.1 7.1 10.4 7.6 42 180 A T H > S+ 0 0 116 37,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.902 109.2 48.3 -59.5 -44.8 8.4 8.5 4.5 43 181 A Q H > S+ 0 0 37 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.862 113.1 47.6 -65.1 -38.6 10.2 11.6 3.1 44 182 A L H X>S+ 0 0 7 -4,-1.8 5,-2.2 2,-0.2 4,-0.9 0.860 114.1 46.9 -70.3 -38.2 11.8 12.3 6.5 45 183 A E H <5S+ 0 0 55 -4,-2.4 -2,-0.2 3,-0.2 -1,-0.2 0.895 110.5 52.0 -69.4 -42.4 12.9 8.7 7.0 46 184 A K H <5S+ 0 0 92 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.796 113.8 43.5 -66.0 -32.3 14.3 8.4 3.4 47 185 A A H <5S- 0 0 55 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.674 107.5-130.1 -83.3 -20.2 16.4 11.6 3.9 48 186 A G T <5 + 0 0 43 -4,-0.9 -3,-0.2 -5,-0.1 -2,-0.1 0.951 69.4 124.1 67.7 53.1 17.4 10.4 7.3 49 187 A V >>< + 0 0 15 -5,-2.2 4,-1.8 2,-0.1 3,-0.7 0.275 26.2 108.2-126.5 6.9 16.5 13.7 9.0 50 188 A E H 3> S+ 0 0 106 -6,-0.5 4,-1.4 1,-0.3 -5,-0.1 0.788 82.9 52.1 -59.0 -30.9 14.1 12.7 11.8 51 189 A H H 3> S+ 0 0 116 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.789 105.8 54.9 -74.5 -30.3 16.8 13.4 14.4 52 190 A Q H <> S+ 0 0 49 -3,-0.7 4,-1.8 2,-0.2 -2,-0.2 0.865 107.4 49.1 -70.0 -38.9 17.3 16.9 12.9 53 191 A L H X S+ 0 0 16 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.883 109.2 52.4 -65.8 -40.5 13.6 17.7 13.3 54 192 A R H X S+ 0 0 46 -4,-1.4 4,-1.4 1,-0.2 -1,-0.2 0.797 109.8 50.5 -64.4 -30.4 13.7 16.4 16.9 55 193 A R H X S+ 0 0 60 -4,-1.2 4,-3.1 2,-0.2 -2,-0.2 0.850 107.3 52.9 -73.7 -38.1 16.6 18.8 17.5 56 194 A E H X S+ 0 0 12 -4,-1.8 4,-3.4 2,-0.2 5,-0.2 0.948 109.2 47.8 -63.1 -50.9 14.8 21.8 16.0 57 195 A V H X S+ 0 0 24 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.909 115.1 48.1 -53.8 -45.2 11.8 21.3 18.3 58 196 A E H X S+ 0 0 106 -4,-1.4 4,-0.5 2,-0.2 3,-0.4 0.933 114.3 44.3 -59.9 -51.9 14.3 21.0 21.2 59 197 A I H >X S+ 0 0 9 -4,-3.1 4,-1.3 1,-0.2 3,-1.1 0.909 114.2 49.9 -61.5 -44.6 16.2 24.1 20.2 60 198 A Q H 3< S+ 0 0 2 -4,-3.4 11,-0.4 1,-0.2 -1,-0.2 0.655 98.9 67.2 -71.3 -17.7 13.0 26.1 19.5 61 199 A S H 3< S+ 0 0 55 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.706 109.0 37.8 -73.2 -20.1 11.6 25.1 22.9 62 200 A H H << S+ 0 0 124 -3,-1.1 2,-0.3 -4,-0.5 -2,-0.2 0.729 97.3 92.0 -99.9 -29.7 14.4 27.2 24.6 63 201 A L < + 0 0 4 -4,-1.3 2,-0.4 2,-0.0 59,-0.0 -0.533 43.8 171.6 -77.7 128.7 14.6 30.2 22.2 64 202 A R + 0 0 113 -2,-0.3 5,-0.1 6,-0.1 -3,-0.0 -0.909 19.0 132.3-137.9 109.6 12.5 33.3 22.9 65 203 A H > - 0 0 44 -2,-0.4 3,-1.9 3,-0.3 53,-0.0 -0.965 55.7-129.2-156.4 138.0 13.0 36.4 20.9 66 204 A P T 3 S+ 0 0 92 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.733 112.1 53.5 -61.9 -23.3 10.6 38.8 19.0 67 205 A N T 3 S+ 0 0 20 79,-0.1 80,-2.2 47,-0.1 2,-0.4 0.126 98.5 78.2 -97.3 17.7 12.7 38.5 15.9 68 206 A I B < S-e 147 0B 3 -3,-1.9 -3,-0.3 78,-0.3 2,-0.2 -0.997 83.9-121.0-126.4 130.9 12.5 34.7 15.9 69 207 A L - 0 0 8 78,-2.9 2,-0.2 -2,-0.4 80,-0.1 -0.515 33.8-119.3 -70.1 132.1 9.4 32.7 14.8 70 208 A R - 0 0 59 -2,-0.2 16,-2.4 -4,-0.1 2,-0.6 -0.523 18.7-162.6 -77.0 133.9 8.0 30.5 17.5 71 209 A L E -D 85 0A 5 -11,-0.4 14,-0.2 -2,-0.2 3,-0.1 -0.983 7.7-174.8-108.9 113.9 7.8 26.8 17.2 72 210 A Y E - 0 0 97 12,-2.2 2,-0.3 -2,-0.6 13,-0.1 0.787 52.2 -74.0 -81.0 -29.8 5.2 25.7 19.9 73 211 A G E -D 84 0A 16 11,-1.0 11,-3.0 2,-0.0 -1,-0.3 -0.935 45.0-109.6 157.1-176.2 5.6 22.0 19.4 74 212 A Y E -D 83 0A 103 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.937 17.2-173.7-144.4 166.0 4.7 19.1 17.1 75 213 A F E -D 82 0A 18 7,-2.1 7,-3.7 -2,-0.3 2,-0.3 -0.971 9.7-151.7-154.3 162.8 2.6 16.0 16.7 76 214 A H E -D 81 0A 122 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.899 6.8-166.9-135.1 161.5 2.2 13.1 14.3 77 215 A D - 0 0 64 3,-2.3 5,-0.0 -2,-0.3 -73,-0.0 -0.314 59.8 -59.2-118.8-146.5 -0.4 10.6 12.9 78 216 A A S S+ 0 0 91 -2,-0.1 3,-0.0 1,-0.1 -2,-0.0 0.916 128.8 3.6 -65.0 -44.7 0.1 7.5 10.8 79 217 A T S S+ 0 0 83 -38,-0.1 -38,-3.2 1,-0.1 -37,-0.4 0.649 119.1 62.0-117.9 -25.1 1.8 9.1 7.8 80 218 A R E -C 40 0A 25 -40,-0.3 -3,-2.3 -39,-0.1 2,-0.4 -0.809 55.9-148.4-119.2 149.4 2.3 12.9 8.5 81 219 A V E -CD 39 76A 8 -42,-3.2 -42,-3.4 -2,-0.3 2,-0.5 -0.961 18.2-155.2-112.9 132.8 4.2 15.1 11.0 82 220 A Y E -CD 38 75A 10 -7,-3.7 -7,-2.1 -2,-0.4 2,-0.5 -0.935 2.8-156.3-117.0 120.9 2.7 18.4 12.0 83 221 A L E -CD 37 74A 6 -46,-2.3 -46,-1.5 -2,-0.5 2,-0.8 -0.832 13.3-141.6 -94.2 125.1 4.6 21.4 13.2 84 222 A I E +CD 36 73A 11 -11,-3.0 -12,-2.2 -2,-0.5 -11,-1.0 -0.785 35.7 178.3 -87.3 110.8 2.7 23.9 15.3 85 223 A L E -CD 35 71A 20 -50,-3.1 -50,-2.7 -2,-0.8 2,-0.2 -0.816 35.4-102.8-122.9 152.0 4.1 27.3 14.2 86 224 A E - 0 0 37 -16,-2.4 2,-0.4 -2,-0.3 -52,-0.1 -0.520 43.9-119.6 -65.2 133.2 3.6 31.0 14.9 87 225 A Y - 0 0 62 -54,-0.5 -1,-0.1 -2,-0.2 -17,-0.1 -0.645 19.1-157.7 -79.6 129.0 1.7 32.7 12.0 88 226 A A > - 0 0 12 -2,-0.4 3,-1.5 1,-0.1 51,-0.2 -0.911 4.4-165.8-109.2 104.2 3.5 35.4 10.2 89 227 A P T 3 S+ 0 0 52 0, 0.0 51,-0.2 0, 0.0 -1,-0.1 0.698 82.2 53.7 -68.1 -25.8 0.8 37.6 8.5 90 228 A L T 3 S- 0 0 89 49,-2.0 50,-0.1 1,-0.3 6,-0.1 0.170 101.7-139.0 -98.5 17.0 3.0 39.5 6.1 91 229 A G < - 0 0 29 -3,-1.5 48,-2.0 48,-0.3 -1,-0.3 -0.018 41.7 -19.6 68.0-164.1 4.6 36.4 4.5 92 230 A T B > -F 138 0B 42 46,-0.2 4,-1.7 1,-0.1 46,-0.3 -0.470 45.3-132.1 -80.4 150.1 8.1 35.6 3.5 93 231 A V H > S+ 0 0 0 44,-2.9 4,-2.2 41,-0.7 42,-0.2 0.766 111.0 64.7 -66.1 -27.7 10.9 38.2 2.9 94 232 A Y H > S+ 0 0 93 40,-1.1 4,-1.4 43,-0.5 -1,-0.2 0.904 103.7 43.9 -59.7 -44.9 11.4 36.1 -0.3 95 233 A R H > S+ 0 0 153 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.891 112.2 52.9 -68.1 -40.8 7.9 37.0 -1.5 96 234 A E H X S+ 0 0 49 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.863 108.5 50.9 -61.0 -38.3 8.5 40.7 -0.5 97 235 A L H X S+ 0 0 11 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.821 109.1 49.8 -71.4 -34.0 11.7 40.8 -2.5 98 236 A Q H < S+ 0 0 96 -4,-1.4 -1,-0.2 2,-0.2 -2,-0.2 0.852 112.7 48.9 -68.9 -36.9 10.1 39.4 -5.6 99 237 A K H < S+ 0 0 88 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.892 123.0 30.3 -68.1 -42.7 7.3 42.0 -5.3 100 238 A L H < S- 0 0 77 -4,-2.1 2,-2.9 -5,-0.1 -2,-0.2 0.475 88.9-144.6 -99.6 -4.7 9.7 45.0 -4.8 101 239 A S S < S+ 0 0 82 -4,-1.2 2,-0.3 -5,-0.1 -1,-0.1 -0.264 79.7 7.9 67.0 -53.2 12.7 43.7 -6.9 102 240 A R S S- 0 0 129 -2,-2.9 2,-0.3 -6,-0.1 91,-0.2 -0.982 76.4-122.0-150.1 156.0 15.1 45.3 -4.4 103 241 A F - 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0 0 11 0, 0.0 3,-1.6 0, 0.0 -9,-0.1 -0.377 36.5-117.3 -68.9 149.9 22.7 37.1 -4.4 198 341 A P T 3 S+ 0 0 5 0, 0.0 19,-0.3 0, 0.0 -11,-0.0 0.700 111.1 41.3 -62.6 -25.6 26.4 38.0 -5.2 199 342 A F T 3 S+ 0 0 0 -35,-0.2 11,-0.2 17,-0.1 12,-0.2 0.146 81.8 148.9-110.5 18.1 27.5 34.5 -6.3 200 343 A E < + 0 0 88 -3,-1.6 2,-0.3 10,-0.1 3,-0.0 -0.236 15.3 157.0 -57.4 134.0 24.4 33.7 -8.4 201 344 A A - 0 0 27 1,-0.1 -37,-0.1 9,-0.0 -2,-0.1 -0.965 52.6-117.6-151.8 164.4 24.9 31.5 -11.4 202 345 A H S S+ 0 0 199 -2,-0.3 2,-0.3 2,-0.0 -1,-0.1 0.768 99.8 55.2 -75.8 -26.1 23.0 29.1 -13.7 203 346 A T S > S- 0 0 66 1,-0.1 4,-1.8 -3,-0.0 5,-0.1 -0.857 73.9-139.0-112.8 145.4 25.2 26.2 -12.6 204 347 A Y H > S+ 0 0 124 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.860 106.1 56.4 -58.4 -40.5 26.1 24.8 -9.1 205 348 A Q H > S+ 0 0 125 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.847 106.0 47.5 -67.1 -38.9 29.7 24.4 -10.2 206 349 A E H > S+ 0 0 19 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.905 111.5 51.0 -68.2 -42.9 30.2 28.1 -11.2 207 350 A T H X S+ 0 0 5 -4,-1.8 4,-2.2 1,-0.2 5,-0.2 0.893 109.3 52.1 -59.2 -40.6 28.6 29.2 -7.9 208 351 A Y H X S+ 0 0 83 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.890 110.6 48.2 -61.0 -42.2 31.0 26.8 -6.1 209 352 A R H X S+ 0 0 122 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.948 112.2 47.9 -61.9 -50.3 33.9 28.5 -8.0 210 353 A R H X>S+ 0 0 68 -4,-2.9 5,-3.2 1,-0.2 4,-0.8 0.836 112.2 47.4 -66.8 -36.8 32.8 32.0 -7.2 211 354 A I H ><5S+ 0 0 0 -4,-2.2 3,-0.6 3,-0.2 -1,-0.2 0.928 109.6 54.5 -67.2 -46.2 32.2 31.4 -3.5 212 355 A S H 3<5S+ 0 0 42 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.880 118.0 34.9 -53.5 -43.8 35.6 29.7 -3.2 213 356 A R H 3<5S- 0 0 159 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.573 106.2-124.6 -86.0 -11.6 37.4 32.7 -4.7 214 357 A V T <<5 + 0 0 34 -4,-0.8 2,-0.9 -3,-0.6 -3,-0.2 0.941 48.7 174.1 56.6 51.6 35.1 35.2 -3.1 215 358 A E < + 0 0 83 -5,-3.2 2,-0.3 -6,-0.1 -1,-0.2 -0.780 16.3 121.5 -98.7 96.9 34.5 36.4 -6.7 216 359 A F - 0 0 40 -2,-0.9 2,-0.3 -3,-0.1 -17,-0.1 -0.991 38.7-153.2-153.3 154.9 31.8 39.1 -6.8 217 360 A T - 0 0 116 -2,-0.3 -2,-0.0 -19,-0.3 0, 0.0 -0.938 17.3-124.8-130.3 153.7 31.2 42.8 -7.9 218 361 A F - 0 0 37 -2,-0.3 2,-0.1 4,-0.1 -28,-0.0 -0.782 25.9-121.9 -93.4 138.5 28.9 45.6 -6.8 219 362 A P > - 0 0 36 0, 0.0 3,-1.5 0, 0.0 -1,-0.0 -0.369 36.3 -99.9 -68.7 162.8 26.7 47.4 -9.4 220 363 A D T 3 S+ 0 0 149 1,-0.3 -2,-0.0 -2,-0.1 0, 0.0 0.742 115.7 61.0 -60.2 -30.1 27.1 51.2 -9.6 221 364 A F T 3 S+ 0 0 93 2,-0.0 2,-0.4 -27,-0.0 -1,-0.3 0.563 76.6 105.1 -79.4 -9.7 24.2 52.2 -7.5 222 365 A V S < S- 0 0 9 -3,-1.5 -4,-0.1 1,-0.1 -28,-0.0 -0.614 72.5-128.0 -74.1 124.8 25.5 50.5 -4.3 223 366 A T > - 0 0 53 -2,-0.4 4,-2.3 1,-0.1 5,-0.1 -0.219 15.6-113.6 -71.1 162.5 26.8 53.1 -1.9 224 367 A E H > S+ 0 0 143 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.833 115.6 58.2 -65.7 -34.4 30.3 53.0 -0.3 225 368 A G H > S+ 0 0 26 2,-0.2 4,-1.7 1,-0.2 27,-0.2 0.904 111.0 41.1 -61.0 -44.8 28.7 52.5 3.2 226 369 A A H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.881 112.8 55.3 -69.7 -41.3 26.9 49.3 2.0 227 370 A R H X S+ 0 0 58 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.897 107.1 51.4 -55.5 -43.6 30.0 48.2 0.0 228 371 A D H X S+ 0 0 62 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.939 111.3 45.2 -61.8 -51.5 32.1 48.5 3.2 229 372 A L H X S+ 0 0 0 -4,-1.7 4,-0.9 1,-0.2 -2,-0.2 0.915 115.8 46.2 -58.3 -48.6 29.8 46.3 5.4 230 373 A I H X S+ 0 0 2 -4,-2.4 4,-3.0 1,-0.2 3,-0.5 0.903 112.2 49.8 -65.3 -44.1 29.3 43.6 2.7 231 374 A S H < S+ 0 0 48 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.844 111.8 49.1 -63.6 -35.2 33.1 43.4 1.9 232 375 A R H < S+ 0 0 111 -4,-1.9 10,-1.4 -5,-0.2 -1,-0.2 0.610 115.2 44.9 -80.8 -15.4 33.9 43.1 5.6 233 376 A L H < S+ 0 0 0 -4,-0.9 2,-1.6 -3,-0.5 -2,-0.2 0.815 104.8 63.3 -89.6 -40.7 31.3 40.4 6.0 234 377 A L S < S+ 0 0 4 -4,-3.0 2,-0.4 -5,-0.1 -1,-0.2 -0.552 71.6 137.7 -89.8 73.2 32.2 38.4 2.8 235 378 A K - 0 0 78 -2,-1.6 6,-0.2 -3,-0.2 5,-0.1 -0.976 54.1-138.6-121.7 134.3 35.7 37.3 3.7 236 379 A H S S+ 0 0 75 -2,-0.4 2,-0.8 -23,-0.1 -67,-0.2 0.872 92.9 71.8 -55.8 -44.3 37.2 33.9 3.1 237 380 A N S > S- 0 0 78 1,-0.2 3,-1.4 -3,-0.1 4,-0.4 -0.691 75.0-156.4 -77.2 111.0 38.9 33.8 6.5 238 381 A A G > S+ 0 0 23 -2,-0.8 3,-0.8 1,-0.3 -1,-0.2 0.777 89.5 58.2 -62.3 -31.5 36.0 33.4 9.0 239 382 A S G 3 S+ 0 0 101 1,-0.2 -1,-0.3 -3,-0.0 -3,-0.1 0.665 100.9 58.5 -73.4 -17.2 38.0 34.9 11.9 240 383 A Q G < S+ 0 0 121 -3,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.587 84.2 106.0 -86.5 -13.7 38.4 38.1 9.9 241 384 A R S < S- 0 0 10 -3,-0.8 -8,-0.2 -4,-0.4 -9,-0.1 -0.366 81.1 -97.1 -68.7 145.5 34.6 38.6 9.5 242 385 A L - 0 0 20 -10,-1.4 2,-0.1 -13,-0.2 -1,-0.1 -0.205 36.9-121.5 -55.2 148.2 32.9 41.4 11.5 243 386 A T > - 0 0 73 1,-0.1 4,-1.5 -61,-0.0 5,-0.1 -0.460 27.4-105.1 -85.2 168.0 31.1 40.4 14.7 244 387 A L H > S+ 0 0 14 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.820 122.9 52.2 -65.3 -32.4 27.4 41.0 15.2 245 388 A A H > S+ 0 0 65 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.855 107.4 52.3 -69.7 -37.0 28.1 43.9 17.5 246 389 A E H 4 S+ 0 0 99 2,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.795 110.4 49.8 -66.6 -31.1 30.4 45.4 14.9 247 390 A V H >< S+ 0 0 0 -4,-1.5 3,-1.4 2,-0.2 6,-0.2 0.937 110.2 48.0 -70.4 -50.1 27.5 45.1 12.4 248 391 A L H 3< S+ 0 0 39 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.710 117.2 44.4 -63.6 -21.7 25.0 46.8 14.7 249 392 A E T 3< S+ 0 0 129 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.285 83.9 124.7-107.2 6.9 27.5 49.5 15.3 250 393 A H <> - 0 0 14 -3,-1.4 4,-2.8 1,-0.1 3,-0.4 -0.486 67.7-125.3 -68.8 136.5 28.5 50.0 11.7 251 394 A P H > S+ 0 0 96 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.864 109.4 48.7 -49.5 -47.8 28.1 53.6 10.4 252 395 A W H > S+ 0 0 12 -27,-0.2 4,-1.4 2,-0.2 5,-0.2 0.834 113.0 47.9 -65.7 -36.4 25.9 52.6 7.4 253 396 A I H > S+ 0 0 2 -3,-0.4 4,-2.7 -6,-0.2 3,-0.2 0.954 113.4 47.1 -66.3 -51.3 23.7 50.5 9.7 254 397 A K H < S+ 0 0 133 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.853 113.8 48.9 -58.3 -38.3 23.3 53.2 12.3 255 398 A A H < S+ 0 0 82 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.823 123.4 27.8 -73.1 -34.2 22.6 55.9 9.6 256 399 A N H < S+ 0 0 23 -4,-1.4 -146,-0.2 -3,-0.2 -2,-0.2 0.670 97.3 97.2-105.5 -22.6 19.9 53.9 7.7 257 400 A S < 0 0 31 -4,-2.7 -150,-0.1 -148,-0.2 -147,-0.1 -0.342 360.0 360.0 -72.4 152.0 18.3 51.6 10.4 258 401 A S 0 0 133 -152,-0.3 -1,-0.1 -151,-0.1 -151,-0.0 0.677 360.0 360.0-105.6 360.0 15.1 52.6 12.2