==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 17-OCT-08 2W1F . 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, . 253 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13027.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 70.4 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 15.0 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 . 18 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 79 31.2 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 0 1 3 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 . 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 1 127 A Q 0 0 228 0, 0.0 2,-0.3 0, 0.0 73,-0.1 0.000 360.0 360.0 360.0 -39.2 -0.6 17.5 24.0 2 128 A W - 0 0 98 71,-0.4 73,-0.3 2,-0.0 2,-0.3 -0.815 360.0-169.0-112.3 153.0 -2.3 18.5 20.8 3 129 A A > - 0 0 34 -2,-0.3 3,-1.4 71,-0.1 4,-0.2 -0.831 40.5-102.1-126.8 171.8 -4.1 16.5 18.1 4 130 A L G > S+ 0 0 65 1,-0.3 3,-1.7 -2,-0.3 72,-0.0 0.791 115.9 68.8 -65.2 -28.8 -5.4 17.5 14.6 5 131 A E G 3 S+ 0 0 150 1,-0.3 -1,-0.3 3,-0.1 3,-0.0 0.401 87.7 67.5 -73.4 1.2 -8.9 17.7 15.9 6 132 A D G < S+ 0 0 44 -3,-1.4 21,-3.7 21,-0.1 2,-0.3 0.564 100.2 60.7 -88.8 -11.4 -7.9 20.8 17.9 7 133 A F E < -A 26 0A 8 -3,-1.7 2,-0.5 19,-0.3 19,-0.2 -0.797 64.1-146.5-125.9 154.6 -7.4 22.8 14.7 8 134 A E E -A 25 0A 86 17,-1.6 17,-1.5 -2,-0.3 2,-0.2 -0.973 28.2-138.8-119.2 112.3 -9.1 24.0 11.6 9 135 A I E +A 24 0A 72 -2,-0.5 15,-0.3 15,-0.2 2,-0.1 -0.495 28.3 176.5 -76.1 134.3 -6.9 24.1 8.6 10 136 A G E - 0 0 33 13,-4.3 -1,-0.1 1,-0.3 3,-0.1 -0.158 41.7 -10.9-116.1-146.5 -7.2 27.1 6.4 11 137 A R E S- 0 0 160 11,-0.1 12,-2.6 1,-0.1 -1,-0.3 -0.112 72.2-107.3 -58.5 142.3 -5.5 28.4 3.3 12 138 A P E -A 22 0A 79 0, 0.0 10,-0.3 0, 0.0 -1,-0.1 -0.522 33.6-177.6 -65.9 141.4 -2.3 26.8 2.1 13 139 A L E - 0 0 61 8,-3.5 2,-0.3 1,-0.3 9,-0.2 0.538 53.2 -19.0-113.6 -23.6 0.7 29.0 2.8 14 140 A G E -A 21 0A 20 7,-1.4 7,-1.6 2,-0.0 -1,-0.3 -0.994 43.7-129.2-177.3 167.8 3.6 27.0 1.3 15 141 A K + 0 0 169 -2,-0.3 5,-0.2 5,-0.2 3,-0.1 -0.710 20.7 160.4-122.5 175.2 5.4 23.9 -0.0 16 142 A G > - 0 0 47 3,-0.3 2,-2.3 -2,-0.2 3,-1.2 -0.109 59.0 -91.7 155.3 99.6 8.8 22.2 0.6 17 143 A K T 3 S+ 0 0 153 1,-0.3 3,-0.1 -2,-0.0 25,-0.0 0.182 123.0 55.2 -2.7 -38.9 9.6 18.6 -0.3 18 144 A F T 3 S- 0 0 51 -2,-2.3 21,-1.4 1,-0.2 2,-0.3 0.505 122.8 -67.3 -84.7 -5.0 8.6 17.3 3.2 19 145 A G E < - B 0 38A 14 -3,-1.2 -3,-0.3 19,-0.2 2,-0.3 -0.955 56.0 -66.6 152.5-166.8 5.1 18.8 3.0 20 146 A N E - B 0 37A 54 17,-0.6 17,-2.5 -2,-0.3 2,-0.5 -0.838 29.6-130.3-117.4 155.7 3.0 21.9 3.1 21 147 A V E -AB 14 36A 25 -7,-1.6 -8,-3.5 -2,-0.3 -7,-1.4 -0.922 26.2-169.0-104.0 128.3 2.3 24.7 5.6 22 148 A Y E -AB 12 35A 67 13,-3.8 13,-3.3 -2,-0.5 -11,-0.1 -0.961 24.8-119.3-118.6 136.1 -1.3 25.6 6.2 23 149 A L E + B 0 34A 35 -12,-2.6 -13,-4.3 -2,-0.4 2,-0.3 -0.409 46.2 175.4 -57.2 142.2 -2.8 28.5 8.1 24 150 A A E -AB 9 33A 2 9,-3.0 9,-2.4 -15,-0.3 2,-0.4 -0.980 27.1-138.2-153.4 166.4 -4.9 27.1 10.9 25 151 A R E -AB 8 32A 92 -17,-1.5 -17,-1.6 -2,-0.3 2,-0.4 -0.992 24.1-120.9-134.1 131.4 -7.0 28.1 13.9 26 152 A E E >> -A 7 0A 24 5,-2.2 4,-2.8 -2,-0.4 3,-0.8 -0.543 25.9-141.0 -72.9 120.0 -7.2 26.5 17.4 27 153 A K T 34 S+ 0 0 95 -21,-3.7 -1,-0.1 -2,-0.4 3,-0.1 0.916 94.5 32.6 -48.2 -62.9 -10.8 25.4 17.9 28 154 A Q T 34 S+ 0 0 190 -22,-0.3 -1,-0.2 1,-0.2 -21,-0.1 0.525 128.3 39.7 -80.9 -5.2 -11.3 26.2 21.6 29 155 A S T <4 S- 0 0 64 -3,-0.8 -1,-0.2 2,-0.1 -2,-0.2 0.623 87.7-137.5-114.0 -24.2 -9.0 29.3 21.5 30 156 A K < + 0 0 158 -4,-2.8 -3,-0.1 1,-0.2 -2,-0.1 0.473 50.5 156.7 68.2 6.6 -9.6 31.0 18.2 31 157 A F - 0 0 95 -5,-0.3 -5,-2.2 -6,-0.1 2,-0.4 -0.306 37.0-135.4 -66.0 139.7 -5.8 31.4 18.0 32 158 A I E +B 25 0A 71 -7,-0.2 54,-0.5 -3,-0.1 2,-0.3 -0.837 39.1 139.7-103.4 134.5 -4.2 31.8 14.6 33 159 A L E -B 24 0A 6 -9,-2.4 -9,-3.0 -2,-0.4 2,-0.5 -0.918 49.1 -99.0-159.2 174.4 -1.1 30.0 13.6 34 160 A A E -BC 23 84A 7 50,-3.3 50,-2.8 -2,-0.3 2,-0.6 -0.957 26.4-154.1-114.3 116.3 0.7 28.1 10.8 35 161 A L E -BC 22 83A 0 -13,-3.3 -13,-3.8 -2,-0.5 2,-0.8 -0.821 4.4-159.4 -89.5 120.2 0.5 24.3 10.8 36 162 A K E -BC 21 82A 52 46,-2.8 46,-2.4 -2,-0.6 2,-0.6 -0.882 11.4-154.5-102.0 103.6 3.5 22.8 8.9 37 163 A V E +BC 20 81A 9 -17,-2.5 -17,-0.6 -2,-0.8 2,-0.4 -0.730 16.8 177.1 -89.6 119.7 2.4 19.2 7.9 38 164 A L E -BC 19 80A 13 42,-3.1 42,-3.9 -2,-0.6 2,-0.2 -0.967 22.8-127.7-125.0 135.7 5.3 16.7 7.5 39 165 A F E > - C 0 79A 60 -21,-1.4 4,-1.4 -2,-0.4 40,-0.3 -0.574 5.0-142.6 -87.9 144.0 5.0 13.0 6.6 40 166 A K H > S+ 0 0 45 38,-1.4 4,-1.4 -2,-0.2 5,-0.2 0.819 102.8 55.0 -70.5 -34.3 6.7 10.2 8.6 41 167 A A H > S+ 0 0 70 37,-0.6 4,-2.7 1,-0.2 3,-0.4 0.973 110.9 42.1 -59.6 -58.1 7.4 8.3 5.3 42 168 A Q H > S+ 0 0 77 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.755 113.2 53.4 -64.4 -28.6 9.3 11.2 3.7 43 169 A L H <>S+ 0 0 14 -4,-1.4 5,-2.4 2,-0.2 6,-1.2 0.790 116.0 37.8 -80.3 -31.2 11.2 12.1 6.8 44 170 A E H ><5S+ 0 0 111 -4,-1.4 3,-1.4 -3,-0.4 -2,-0.2 0.833 114.9 54.5 -84.8 -39.3 12.6 8.6 7.4 45 171 A K H 3<5S+ 0 0 192 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.973 113.8 40.7 -57.6 -57.0 13.1 7.9 3.7 46 172 A A T 3<5S- 0 0 47 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.1 -0.009 114.4-121.4 -85.4 30.1 15.2 11.0 3.2 47 173 A G T < 5S+ 0 0 37 -3,-1.4 -3,-0.2 1,-0.1 -2,-0.1 0.791 73.1 120.4 28.4 80.4 17.0 10.4 6.6 48 174 A V >>< + 0 0 18 -5,-2.4 3,-2.6 2,-0.1 4,-1.3 0.537 24.7 109.1-138.4 -25.7 16.2 13.5 8.5 49 175 A E H 3> S+ 0 0 68 -6,-1.2 4,-1.6 1,-0.3 5,-0.2 0.734 83.8 57.9 -24.4 -43.2 14.2 12.7 11.7 50 176 A H H 3> S+ 0 0 118 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.893 104.9 47.9 -62.7 -44.1 17.4 13.6 13.6 51 177 A Q H <> S+ 0 0 41 -3,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.835 108.0 57.3 -65.4 -34.8 17.5 17.1 12.2 52 178 A L H >X S+ 0 0 19 -4,-1.3 4,-2.9 1,-0.2 3,-0.5 0.943 102.6 49.3 -66.8 -52.0 13.8 17.8 12.9 53 179 A R H 3X S+ 0 0 196 -4,-1.6 4,-1.6 1,-0.3 -1,-0.2 0.673 110.7 55.0 -66.0 -14.8 13.9 17.1 16.7 54 180 A R H 3X S+ 0 0 90 -4,-0.6 4,-2.4 2,-0.2 -1,-0.3 0.773 106.5 49.1 -83.3 -34.3 16.9 19.5 16.7 55 181 A E H X S+ 0 0 3 -4,-2.4 4,-0.9 1,-0.2 3,-0.5 0.939 122.5 44.5 -70.5 -49.0 16.2 24.9 19.3 59 185 A Q H 3< S+ 0 0 2 -4,-3.7 11,-0.9 1,-0.2 -1,-0.2 0.718 110.7 56.2 -75.9 -21.0 13.1 26.7 18.0 60 186 A S H 3< S+ 0 0 37 -4,-2.1 -1,-0.2 -5,-0.5 -2,-0.2 0.783 112.0 41.2 -76.5 -29.8 11.0 25.6 20.9 61 187 A H H << S+ 0 0 124 -4,-0.9 -2,-0.2 -3,-0.5 2,-0.2 0.528 96.2 97.7 -98.8 -10.7 13.3 27.0 23.5 62 188 A L < - 0 0 8 -4,-0.9 2,-0.3 6,-0.1 8,-0.3 -0.503 48.6-173.3 -84.3 148.4 14.1 30.2 21.7 63 189 A R + 0 0 130 -2,-0.2 5,-0.1 6,-0.1 3,-0.1 -0.840 27.1 124.7-145.7 104.6 12.3 33.5 22.5 64 190 A H > - 0 0 34 3,-0.5 3,-1.2 -2,-0.3 5,-0.0 -0.972 58.2-126.5-157.7 145.4 12.9 36.5 20.4 65 191 A P T 3 S+ 0 0 85 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.832 113.3 50.0 -61.7 -35.4 10.7 39.0 18.5 66 192 A N T 3 S+ 0 0 19 79,-0.1 80,-1.2 47,-0.1 2,-0.3 -0.214 100.2 79.0 -94.5 39.4 12.7 38.5 15.3 67 193 A I B < S-e 146 0B 4 -3,-1.2 -3,-0.5 78,-0.2 80,-0.2 -0.896 88.1-113.6-147.3 121.4 12.6 34.7 15.6 68 194 A L - 0 0 6 78,-1.5 -6,-0.1 -2,-0.3 -2,-0.1 -0.270 36.8-126.1 -59.3 121.2 9.6 32.6 14.5 69 195 A R - 0 0 66 -4,-0.1 16,-1.9 17,-0.1 2,-0.5 -0.335 12.7-151.6 -63.7 143.8 8.1 31.0 17.6 70 196 A L E -D 84 0A 2 -11,-0.9 14,-0.2 -8,-0.3 3,-0.1 -0.994 11.3-174.3-112.6 118.5 7.6 27.3 17.6 71 197 A Y E - 0 0 85 12,-2.2 2,-0.3 -2,-0.5 13,-0.2 0.774 53.4 -67.2 -83.9 -28.3 4.7 26.7 19.9 72 198 A G E -D 83 0A 13 11,-1.1 11,-0.9 2,-0.0 2,-0.3 -0.952 44.2-122.3 172.0-156.9 4.8 22.9 19.8 73 199 A Y E +D 82 0A 129 -2,-0.3 -71,-0.4 9,-0.2 2,-0.3 -0.967 19.7 167.4-172.1 167.8 4.4 19.7 17.8 74 200 A F E -D 81 0A 12 7,-2.1 7,-3.2 -2,-0.3 2,-0.3 -0.957 10.4-158.2-173.5-179.8 2.6 16.5 17.5 75 201 A H E -D 80 0A 105 -73,-0.3 5,-0.2 -2,-0.3 2,-0.1 -0.958 6.4-159.3-162.1 177.4 1.9 13.5 15.1 76 202 A D - 0 0 64 3,-2.1 -73,-0.0 -2,-0.3 4,-0.0 -0.142 56.7 -64.5-132.3-134.0 -0.4 10.6 14.3 77 203 A A S S+ 0 0 91 -2,-0.1 -37,-0.1 3,-0.0 3,-0.1 0.829 129.8 35.9 -88.6 -47.6 0.1 7.4 12.2 78 204 A T S S- 0 0 84 1,-0.1 -38,-1.4 -38,-0.1 -37,-0.6 0.778 121.2 -2.4 -78.1 -31.1 0.6 9.1 8.8 79 205 A R E -C 39 0A 79 -40,-0.3 -3,-2.1 -39,-0.1 2,-0.4 -0.975 54.6-111.1-163.0 160.5 2.6 12.3 9.7 80 206 A V E -CD 38 75A 20 -42,-3.9 -42,-3.1 -2,-0.3 2,-0.5 -0.916 28.9-155.6-107.4 133.6 4.2 14.9 12.0 81 207 A Y E -CD 37 74A 2 -7,-3.2 -7,-2.1 -2,-0.4 2,-0.5 -0.927 4.5-156.3-113.8 128.7 2.8 18.4 12.6 82 208 A L E -CD 36 73A 1 -46,-2.4 -46,-2.8 -2,-0.5 2,-1.0 -0.912 12.2-146.1-104.3 122.5 4.7 21.5 13.6 83 209 A I E -CD 35 72A 4 -11,-0.9 -12,-2.2 -2,-0.5 -11,-1.1 -0.737 30.3-178.2 -89.9 99.3 2.6 24.2 15.3 84 210 A L E -CD 34 70A 11 -50,-2.8 -50,-3.3 -2,-1.0 -14,-0.2 -0.750 33.1-104.4-109.3 144.8 4.2 27.5 14.2 85 211 A E - 0 0 26 -16,-1.9 2,-0.4 -2,-0.3 -52,-0.2 -0.302 43.3-122.2 -52.4 147.8 3.6 31.1 14.9 86 212 A Y - 0 0 62 -54,-0.5 -1,-0.1 -62,-0.0 -17,-0.1 -0.834 15.5-153.8-106.6 134.9 2.0 32.8 11.8 87 213 A A > - 0 0 9 -2,-0.4 3,-2.0 1,-0.1 51,-0.4 -0.838 6.0-155.6-118.2 92.0 3.6 35.7 10.1 88 214 A P T 3 S+ 0 0 55 0, 0.0 51,-0.2 0, 0.0 -1,-0.1 0.611 85.2 51.4 -40.8 -35.4 1.0 37.8 8.4 89 215 A L T 3 S- 0 0 95 49,-1.5 50,-0.2 1,-0.3 51,-0.0 0.172 97.4-138.4-104.3 16.4 3.1 39.4 5.7 90 216 A G < - 0 0 31 -3,-2.0 48,-1.3 48,-0.4 -1,-0.3 -0.052 44.0 -19.4 67.2-162.8 4.8 36.4 4.2 91 217 A T B > -F 137 0B 38 46,-0.2 4,-1.4 1,-0.1 46,-0.3 -0.457 42.9-133.2 -85.9 148.8 8.4 35.8 3.2 92 218 A V H > S+ 0 0 0 44,-3.2 4,-0.9 41,-0.6 42,-0.2 0.735 108.7 67.9 -65.5 -28.4 11.0 38.4 2.4 93 219 A Y H >> S+ 0 0 94 40,-1.2 4,-2.1 43,-0.4 3,-1.6 0.989 101.3 45.3 -49.0 -59.0 11.7 36.2 -0.7 94 220 A R H 3> S+ 0 0 149 1,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.869 109.9 52.7 -57.6 -42.6 8.3 37.2 -2.0 95 221 A E H 3X S+ 0 0 42 -4,-1.4 4,-1.4 1,-0.2 -1,-0.3 0.645 108.6 52.8 -70.7 -14.3 8.7 40.9 -1.3 96 222 A L H - 0 0 82 -2,-0.3 4,-2.9 1,-0.1 5,-0.2 -0.433 30.0-102.5 -94.6 174.5 16.4 50.3 -0.5 104 230 A E H > S+ 0 0 48 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.800 121.5 50.7 -69.9 -30.2 19.2 51.1 2.0 105 231 A Q H > S+ 0 0 87 2,-0.2 4,-1.5 1,-0.2 148,-0.3 0.891 114.0 42.7 -75.3 -41.8 16.8 52.0 4.7 106 232 A R H > S+ 0 0 66 2,-0.2 4,-1.9 1,-0.1 -2,-0.2 0.845 117.1 48.6 -69.1 -37.6 14.7 48.8 4.3 107 233 A T H X S+ 0 0 0 -4,-2.9 4,-3.3 2,-0.2 -2,-0.2 0.957 112.1 46.1 -69.1 -51.2 17.9 46.7 4.0 108 234 A A H X S+ 0 0 0 -4,-2.3 4,-3.8 2,-0.2 5,-0.2 0.880 110.9 54.5 -59.8 -38.5 19.6 48.1 7.0 109 235 A T H X S+ 0 0 17 -4,-1.5 4,-3.1 142,-0.3 -1,-0.2 0.963 112.7 41.9 -58.0 -53.1 16.5 47.8 9.0 110 236 A Y H X S+ 0 0 9 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.890 114.0 53.6 -59.5 -43.3 16.3 44.1 8.1 111 237 A I H X S+ 0 0 2 -4,-3.3 4,-3.7 2,-0.2 -2,-0.2 0.961 112.2 43.7 -56.7 -56.1 20.0 43.8 8.7 112 238 A T H X S+ 0 0 14 -4,-3.8 4,-3.0 2,-0.2 5,-0.3 0.949 115.7 48.1 -47.6 -56.9 19.7 45.3 12.2 113 239 A E H X S+ 0 0 13 -4,-3.1 4,-1.5 1,-0.2 -1,-0.2 0.848 117.1 42.9 -57.3 -36.9 16.7 43.2 12.9 114 240 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 -5,-0.2 -1,-0.2 0.862 110.6 56.2 -78.8 -37.9 18.5 40.1 11.7 115 241 A A H X S+ 0 0 0 -4,-3.7 4,-2.5 -5,-0.2 -2,-0.2 0.971 111.0 43.3 -55.5 -56.0 21.7 41.2 13.5 116 242 A N H X S+ 0 0 62 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.860 111.9 55.0 -59.9 -39.7 19.9 41.3 16.8 117 243 A A H X S+ 0 0 0 -4,-1.5 4,-1.1 -5,-0.3 -1,-0.2 0.943 114.1 39.8 -55.6 -48.9 18.1 38.1 15.9 118 244 A L H X S+ 0 0 1 -4,-2.8 4,-2.0 1,-0.2 5,-0.2 0.792 107.8 63.6 -76.5 -27.3 21.5 36.4 15.3 119 245 A S H X S+ 0 0 56 -4,-2.5 4,-0.9 -5,-0.2 -1,-0.2 0.881 104.6 47.6 -62.2 -39.5 23.0 38.2 18.3 120 246 A Y H X S+ 0 0 59 -4,-1.9 4,-0.5 2,-0.2 -1,-0.2 0.847 110.7 50.7 -66.8 -38.0 20.6 36.3 20.6 121 247 A C H ><>S+ 0 0 6 -4,-1.1 5,-2.6 1,-0.2 3,-0.9 0.862 105.4 52.2 -77.2 -37.9 21.2 32.9 19.0 122 248 A H H ><5S+ 0 0 29 -4,-2.0 3,-2.3 1,-0.2 -1,-0.2 0.848 100.1 67.7 -63.4 -33.8 25.0 32.9 19.2 123 249 A S H 3<5S+ 0 0 85 -4,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.779 103.2 43.3 -53.4 -34.7 24.5 33.7 22.9 124 250 A K T <<5S- 0 0 111 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.011 125.4-105.2-101.5 25.2 23.0 30.2 23.4 125 251 A R T < 5S+ 0 0 157 -3,-2.3 2,-0.3 1,-0.2 -3,-0.2 0.548 75.8 143.0 65.6 13.5 25.8 28.8 21.2 126 252 A V < - 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0 0 58 -2,-0.4 3,-2.0 0, 0.0 4,-0.2 -0.555 57.7 -67.3-122.4-173.4 32.0 28.6 14.0 173 308 A E T > S+ 0 0 42 1,-0.3 3,-0.6 -2,-0.2 4,-0.2 0.543 115.6 83.7 -59.1 -4.6 29.3 31.2 14.6 174 309 A K T >> S+ 0 0 20 1,-0.2 4,-1.0 2,-0.2 3,-0.9 0.619 70.2 77.7 -75.3 -13.0 31.1 33.5 12.1 175 310 A V H X> S+ 0 0 0 -3,-2.0 4,-2.3 1,-0.2 3,-0.9 0.922 85.4 62.1 -59.5 -40.3 29.3 31.8 9.2 176 311 A D H <> S+ 0 0 1 -3,-0.6 4,-0.9 1,-0.3 -1,-0.2 0.698 98.6 55.3 -65.4 -17.7 26.2 33.8 10.1 177 312 A L H <> S+ 0 0 1 -3,-0.9 4,-1.6 -4,-0.2 -1,-0.3 0.780 105.2 51.5 -83.1 -30.2 28.0 37.0 9.3 178 313 A W H - 0 0 7 0, 0.0 3,-1.8 0, 0.0 -9,-0.1 -0.373 34.6-124.2 -73.8 150.5 23.1 37.0 -4.4 193 328 A P T 3 S+ 0 0 2 0, 0.0 19,-0.2 0, 0.0 -11,-0.0 0.616 110.8 45.7 -68.0 -16.2 26.7 38.2 -5.1 194 329 A F T 3 S+ 0 0 0 -35,-0.3 12,-0.2 17,-0.1 11,-0.1 0.201 79.6 142.9-109.9 12.3 27.8 34.5 -5.8 195 330 A E < + 0 0 90 -3,-1.8 2,-0.2 10,-0.1 -4,-0.0 -0.248 20.8 163.5 -57.7 134.2 24.8 33.5 -8.0 196 331 A A - 0 0 30 1,-0.0 3,-0.1 2,-0.0 -37,-0.1 -0.808 49.4-112.6-139.5-179.7 25.8 31.3 -10.8 197 332 A N S S+ 0 0 171 -2,-0.2 2,-0.3 1,-0.1 -2,-0.1 0.619 97.2 40.5 -92.7 -18.0 24.1 28.9 -13.3 198 333 A T S > S- 0 0 67 1,-0.1 4,-2.5 -3,-0.0 5,-0.2 -0.913 74.0-125.9-134.5 163.1 25.7 25.8 -11.8 199 334 A Y H > S+ 0 0 122 -2,-0.3 4,-1.5 1,-0.2 -1,-0.1 0.872 113.7 50.4 -66.1 -41.7 26.6 24.3 -8.4 200 335 A Q H > S+ 0 0 136 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.909 112.2 44.6 -67.0 -46.4 30.1 23.9 -9.5 201 336 A E H > S+ 0 0 40 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.901 111.9 52.7 -67.5 -42.2 30.6 27.5 -10.7 202 337 A T H X S+ 0 0 8 -4,-2.5 4,-2.3 1,-0.2 5,-0.3 0.877 105.0 58.6 -58.1 -36.6 28.9 28.9 -7.6 203 338 A Y H X S+ 0 0 74 -4,-1.5 4,-3.3 2,-0.2 -2,-0.2 0.939 110.4 40.3 -58.8 -49.2 31.3 26.8 -5.6 204 339 A K H X S+ 0 0 126 -4,-1.6 4,-2.1 2,-0.2 6,-0.3 0.943 112.2 55.4 -66.7 -45.9 34.3 28.6 -7.2 205 340 A R H <>S+ 0 0 70 -4,-3.2 5,-2.1 1,-0.2 -1,-0.2 0.886 118.3 36.0 -54.8 -37.0 32.6 32.0 -7.1 206 341 A I H ><5S+ 0 0 0 -4,-2.3 3,-1.9 -5,-0.2 -2,-0.2 0.931 113.5 55.2 -80.6 -51.3 32.2 31.5 -3.3 207 342 A S H 3<5S+ 0 0 25 -4,-3.3 -2,-0.2 1,-0.3 -3,-0.2 0.720 118.0 38.1 -52.6 -25.8 35.4 29.6 -2.7 208 343 A R T 3<5S- 0 0 150 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.128 104.5-126.5-116.0 18.0 37.2 32.6 -4.3 209 344 A V T < 5 + 0 0 32 -3,-1.9 2,-1.2 1,-0.2 -3,-0.2 0.800 44.1 172.1 43.2 38.1 35.0 35.4 -2.9 210 345 A E < + 0 0 87 -5,-2.1 2,-0.3 -6,-0.3 -1,-0.2 -0.669 13.9 139.7 -81.4 96.1 34.4 36.7 -6.3 211 346 A F - 0 0 38 -2,-1.2 2,-0.3 -3,-0.1 -17,-0.1 -0.957 27.0-169.1-133.1 154.8 31.7 39.5 -6.0 212 347 A T - 0 0 100 -2,-0.3 -2,-0.0 -19,-0.2 0, 0.0 -0.981 18.6-120.3-144.7 159.5 31.2 42.9 -7.6 213 348 A F - 0 0 39 -2,-0.3 2,-0.0 4,-0.1 -2,-0.0 -0.798 16.8-127.7-108.7 128.7 28.9 45.9 -7.0 214 349 A P > - 0 0 40 0, 0.0 3,-1.8 0, 0.0 -1,-0.0 -0.379 38.5-106.1 -64.5 156.7 26.5 47.5 -9.4 215 350 A D T 3 S+ 0 0 157 1,-0.3 -2,-0.0 -2,-0.0 0, 0.0 0.774 114.4 63.3 -57.2 -31.3 27.0 51.2 -9.6 216 351 A F T 3 S+ 0 0 110 2,-0.1 2,-0.7 -27,-0.0 -1,-0.3 0.517 73.5 107.3 -75.2 -6.9 24.0 52.1 -7.5 217 352 A V S < S- 0 0 6 -3,-1.8 -4,-0.1 1,-0.1 5,-0.1 -0.660 74.5-127.1 -77.5 114.9 25.4 50.5 -4.4 218 353 A T > - 0 0 49 -2,-0.7 4,-1.8 1,-0.1 3,-0.5 -0.116 21.3-104.3 -60.7 162.6 26.4 53.3 -2.1 219 354 A E H > S+ 0 0 158 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.849 117.5 48.8 -60.7 -43.7 29.9 53.5 -0.7 220 355 A G H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.746 106.0 57.1 -72.9 -28.5 29.0 52.4 2.9 221 356 A A H > S+ 0 0 0 -3,-0.5 4,-2.8 2,-0.2 5,-0.3 0.959 108.1 48.3 -59.6 -53.7 26.9 49.4 1.6 222 357 A R H X S+ 0 0 66 -4,-1.8 4,-2.9 1,-0.2 -2,-0.2 0.884 110.5 53.4 -51.9 -43.0 30.1 48.2 -0.2 223 358 A D H X S+ 0 0 66 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.955 111.5 41.7 -62.5 -53.1 32.0 48.7 3.0 224 359 A L H X S+ 0 0 1 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.904 117.9 46.8 -64.2 -41.8 29.8 46.7 5.3 225 360 A I H X S+ 0 0 1 -4,-2.8 4,-3.1 2,-0.2 3,-0.4 0.955 111.7 52.4 -63.9 -47.3 29.4 43.9 2.7 226 361 A S H < S+ 0 0 40 -4,-2.9 -2,-0.2 -5,-0.3 -1,-0.2 0.887 109.4 48.1 -56.5 -42.1 33.1 43.9 2.1 227 362 A R H < S+ 0 0 117 -4,-2.3 3,-0.3 1,-0.2 -1,-0.3 0.816 115.5 45.6 -70.1 -28.3 33.9 43.5 5.7 228 363 A L H < S+ 0 0 2 -4,-1.5 2,-1.3 -3,-0.4 -2,-0.2 0.831 104.4 62.5 -84.3 -34.9 31.4 40.7 6.1 229 364 A L S < S+ 0 0 4 -4,-3.1 2,-0.5 -5,-0.1 -1,-0.2 -0.478 70.3 139.8 -92.3 64.0 32.4 38.8 3.0 230 365 A K - 0 0 92 -2,-1.3 6,-0.1 -3,-0.3 5,-0.1 -0.931 54.7-137.1-108.1 131.5 36.0 38.0 4.0 231 366 A H S S+ 0 0 68 -2,-0.5 -67,-0.3 -68,-0.1 -1,-0.1 0.888 93.9 65.7 -51.4 -43.5 37.3 34.5 3.1 232 367 A N S > S- 0 0 69 1,-0.2 3,-1.3 -69,-0.1 4,-0.3 -0.716 80.0-144.4 -86.2 122.8 38.9 34.4 6.6 233 368 A P G > S+ 0 0 17 0, 0.0 3,-3.4 0, 0.0 -1,-0.2 0.943 93.2 65.5 -47.8 -56.1 36.3 34.3 9.4 234 369 A S G 3 S+ 0 0 95 1,-0.3 -3,-0.0 -3,-0.1 -2,-0.0 0.676 92.8 59.9 -41.6 -32.5 38.4 36.3 11.8 235 370 A Q G < S+ 0 0 98 -3,-1.3 -1,-0.3 -5,-0.1 -6,-0.1 0.563 83.6 107.0 -78.5 -5.7 38.3 39.5 9.7 236 371 A R S < S- 0 0 5 -3,-3.4 -8,-0.2 -4,-0.3 -58,-0.1 -0.563 75.2-112.5 -80.8 132.4 34.5 39.6 10.0 237 372 A P - 0 0 8 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.051 30.5-109.7 -46.0 164.2 32.9 42.2 12.2 238 373 A M > - 0 0 96 1,-0.1 4,-2.6 -61,-0.0 5,-0.2 -0.665 31.5-107.2 -92.1 159.8 31.1 41.2 15.3 239 374 A L H > S+ 0 0 10 -2,-0.3 4,-3.2 1,-0.3 5,-0.3 0.916 124.8 57.9 -53.9 -40.8 27.3 41.6 15.4 240 375 A R H > S+ 0 0 194 1,-0.2 4,-3.2 2,-0.2 -1,-0.3 0.935 106.9 46.0 -46.6 -55.9 28.0 44.5 17.6 241 376 A E H > S+ 0 0 90 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.850 110.1 54.4 -64.2 -35.3 30.1 46.2 14.9 242 377 A V H < S+ 0 0 1 -4,-2.6 3,-0.3 2,-0.2 -2,-0.2 0.960 113.4 41.3 -61.6 -51.0 27.5 45.4 12.3 243 378 A L H < S+ 0 0 39 -4,-3.2 6,-0.3 1,-0.2 -2,-0.2 0.881 117.9 50.3 -59.3 -40.0 24.9 47.2 14.5 244 379 A E H < S+ 0 0 136 -4,-3.2 -2,-0.2 -5,-0.3 -1,-0.2 0.731 82.5 117.7 -70.3 -23.9 27.5 49.8 15.1 245 380 A H X - 0 0 22 -4,-1.8 4,-1.9 -3,-0.3 3,-0.4 -0.131 67.7-131.8 -53.6 138.2 28.4 50.3 11.4 246 381 A P H > S+ 0 0 87 0, 0.0 4,-2.8 0, 0.0 5,-0.1 0.823 103.9 54.0 -65.6 -34.6 27.6 53.9 10.2 247 382 A W H > S+ 0 0 16 -27,-0.2 4,-0.6 2,-0.2 -139,-0.1 0.794 110.5 50.8 -68.6 -28.7 25.7 52.9 7.0 248 383 A I H >> S+ 0 0 2 -3,-0.4 4,-2.9 -6,-0.2 3,-2.0 0.992 116.1 37.3 -63.9 -69.1 23.5 50.8 9.3 249 384 A T H 3< S+ 0 0 96 -4,-1.9 -2,-0.2 -6,-0.3 -1,-0.1 0.838 113.5 58.9 -51.3 -39.4 22.8 53.6 11.9 250 385 A A H 3< S+ 0 0 77 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.781 127.8 14.2 -60.9 -26.2 22.6 56.2 9.1 251 386 A N H << S+ 0 0 33 -3,-2.0 2,-1.7 -4,-0.6 -142,-0.3 0.430 92.8 109.4-128.7 -8.0 19.8 54.2 7.4 252 387 A S < - 0 0 15 -4,-2.9 -147,-0.1 1,-0.2 -146,-0.1 -0.499 44.4-169.7 -90.5 74.8 18.4 51.7 9.9 253 388 A S 0 0 111 -2,-1.7 -1,-0.2 -148,-0.3 -147,-0.1 0.717 360.0 360.0 -20.3 -65.9 15.0 53.0 10.9 254 389 A K 0 0 190 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.990 360.0 360.0 -66.5 360.0 14.5 50.5 13.8