==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/HYDROLASE 01-JUN-01 1JB1 . COMPND 2 MOLECULE: HPRK PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS CASEI; . AUTHOR S.FIEULAINE,S.MORERA,S.PONCET,V.MONEDERO,V.GUEGUEN-CHAIGNON, . 161 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9755.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 18.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 39 24.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.9 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 0 0 0 0 1 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 PARALLEL BRIDGES PER LADDER . 1 1 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 0 0 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 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 1 135 A E 0 0 220 0, 0.0 2,-0.3 0, 0.0 50,-0.1 0.000 360.0 360.0 360.0-168.3 63.6 69.1 32.4 2 136 A R - 0 0 136 48,-0.1 2,-0.3 2,-0.0 48,-0.2 -0.870 360.0-160.6-146.5 176.5 63.5 65.4 33.0 3 137 A R E -A 49 0A 48 46,-1.9 46,-1.5 -2,-0.3 2,-0.4 -0.947 14.7-123.2-155.2 171.2 63.2 62.7 35.7 4 138 A S E -A 48 0A 54 -2,-0.3 2,-0.3 44,-0.2 44,-0.2 -0.968 21.6-178.3-129.6 144.8 63.9 59.1 36.4 5 139 A X E -A 47 0A 70 42,-2.5 42,-3.8 -2,-0.4 2,-0.1 -0.927 26.1-115.2-136.8 159.7 61.8 56.2 37.6 6 140 A H E S+A 46 0A 72 -2,-0.3 40,-0.2 40,-0.2 2,-0.1 -0.396 71.1 64.9 -85.5 168.5 62.1 52.5 38.4 7 141 A G S S- 0 0 1 38,-1.1 2,-0.4 -2,-0.1 13,-0.2 -0.235 82.8 -78.0 102.7 165.5 60.4 49.9 36.3 8 142 A V E -D 19 0B 1 11,-1.6 11,-2.8 36,-0.2 2,-0.7 -0.845 29.4-144.5-109.0 142.4 60.9 48.7 32.8 9 143 A L E +DE 18 43B 0 34,-4.1 33,-2.3 -2,-0.4 34,-1.5 -0.853 25.8 172.2-109.3 100.7 59.5 50.5 29.7 10 144 A V E -DE 17 41B 1 7,-1.9 7,-2.3 -2,-0.7 2,-0.5 -0.562 29.1-131.5 -99.9 167.7 58.4 48.1 26.9 11 145 A D E -DE 16 40B 1 29,-3.0 29,-1.8 5,-0.2 2,-0.5 -0.964 25.1-175.8-120.6 110.9 56.6 48.9 23.7 12 146 A I E > S-D 15 0B 0 3,-2.6 3,-2.0 -2,-0.5 27,-0.1 -0.934 72.2 -18.8-113.9 122.1 53.6 46.7 23.1 13 147 A Y T 3 S- 0 0 103 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.850 127.5 -55.3 53.7 35.6 51.7 47.0 19.8 14 148 A G T 3 S+ 0 0 46 1,-0.2 2,-0.6 -3,-0.1 -1,-0.3 0.702 113.8 128.1 71.5 17.6 53.3 50.5 19.4 15 149 A L E < -D 12 0B 16 -3,-2.0 -3,-2.6 77,-0.1 2,-0.6 -0.926 62.0-130.4-112.2 116.0 51.9 51.3 22.8 16 150 A G E -D 11 0B 0 -2,-0.6 80,-1.9 77,-0.5 79,-1.2 -0.514 32.4-179.8 -67.7 112.0 54.4 52.7 25.4 17 151 A V E -Df 10 96B 1 -7,-2.3 -7,-1.9 -2,-0.6 2,-0.7 -0.963 15.9-158.6-120.1 125.0 53.8 50.6 28.6 18 152 A L E -Df 9 97B 9 78,-2.1 80,-1.5 -2,-0.5 2,-0.5 -0.871 10.5-153.3-106.4 105.4 55.8 51.3 31.7 19 153 A I E +Df 8 98B 0 -11,-2.8 -11,-1.6 -2,-0.7 2,-0.3 -0.654 21.0 177.2 -80.8 125.5 55.8 48.2 34.0 20 154 A T E + f 0 99B 26 78,-2.6 80,-3.1 -2,-0.5 2,-0.2 -0.852 13.4 120.1-127.0 161.9 56.3 49.1 37.7 21 155 A G - 0 0 16 -2,-0.3 4,-0.2 78,-0.2 5,-0.2 -0.492 63.1 -56.2 149.4 140.8 56.4 47.3 41.1 22 156 A D S > S- 0 0 137 78,-0.2 3,-1.9 -2,-0.2 4,-0.2 0.053 74.6 -87.0 -35.1 130.5 58.5 46.5 44.1 23 157 A S T 3 S+ 0 0 117 1,-0.2 -1,-0.1 2,-0.1 -3,-0.0 0.054 113.6 29.7 -42.5 149.3 61.8 44.9 43.2 24 158 A G T 3 S+ 0 0 70 -3,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.174 85.6 108.9 83.4 -18.6 61.8 41.1 42.8 25 159 A V S < S- 0 0 29 -3,-1.9 -2,-0.1 -4,-0.2 -3,-0.1 0.794 96.2 -97.9 -60.9 -30.7 58.1 41.1 41.7 26 160 A G S > S+ 0 0 12 -5,-0.2 4,-1.0 -4,-0.2 -1,-0.1 0.791 74.9 137.0 115.0 45.8 59.1 40.2 38.1 27 161 A K H > S+ 0 0 21 -6,-0.2 4,-2.1 2,-0.2 5,-0.1 0.884 79.9 43.1 -85.1 -43.7 59.2 43.3 35.8 28 162 A S H > S+ 0 0 10 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.912 116.0 48.5 -68.7 -42.5 62.5 42.5 34.0 29 163 A E H >> S+ 0 0 76 1,-0.2 4,-1.4 2,-0.2 3,-0.5 0.944 113.1 47.8 -62.7 -48.3 61.6 38.8 33.6 30 164 A T H 3X S+ 0 0 10 -4,-1.0 4,-2.0 1,-0.3 -1,-0.2 0.879 109.8 52.0 -60.7 -39.8 58.1 39.7 32.3 31 165 A A H 3X S+ 0 0 0 -4,-2.1 4,-1.6 1,-0.2 -1,-0.3 0.753 105.6 58.2 -68.4 -22.3 59.6 42.3 29.9 32 166 A L H S+ 0 0 0 -4,-2.0 5,-2.6 2,-0.2 -2,-0.2 0.867 111.4 45.2 -63.0 -37.9 57.3 40.3 26.0 35 169 A V H ><5S+ 0 0 5 -4,-1.6 3,-2.0 3,-0.2 -1,-0.2 0.900 112.0 50.8 -70.4 -43.6 60.5 41.0 24.0 36 170 A Q H 3<5S+ 0 0 115 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.802 105.4 60.1 -63.9 -26.0 60.8 37.3 23.2 37 171 A R T 3<5S- 0 0 111 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.212 131.9 -91.7 -85.9 12.9 57.1 37.6 22.1 38 172 A G T < 5S+ 0 0 55 -3,-2.0 -3,-0.2 1,-0.3 2,-0.2 0.482 84.8 128.3 94.0 0.9 58.0 40.2 19.5 39 173 A H < - 0 0 14 -5,-2.6 2,-0.4 -6,-0.2 -1,-0.3 -0.527 57.4-106.7 -91.8 160.6 57.6 43.4 21.5 40 174 A R E -E 11 0B 90 -29,-1.8 -29,-3.0 -2,-0.2 2,-0.4 -0.702 19.5-146.1 -96.5 132.2 60.2 46.3 21.8 41 175 A L E +Eg 10 88B 5 46,-2.8 48,-2.4 -2,-0.4 -31,-0.2 -0.733 23.1 165.4 -91.2 137.6 62.3 47.1 24.9 42 176 A I E - 0 0 10 -33,-2.3 19,-0.4 -2,-0.4 2,-0.3 0.717 66.0 -1.5-114.5 -53.1 63.1 50.8 25.6 43 177 A A E -E 9 0B 1 -34,-1.5 -34,-4.1 17,-0.1 2,-0.4 -0.993 58.6-157.3-148.2 138.2 64.4 50.9 29.1 44 178 A D S S- 0 0 4 -2,-0.3 2,-2.0 -36,-0.3 -36,-0.2 -0.940 70.1 -12.5-120.8 140.2 64.9 48.4 31.9 45 179 A D S S+ 0 0 66 -2,-0.4 -38,-1.1 25,-0.1 2,-0.4 -0.189 130.9 39.9 72.7 -44.8 65.1 48.9 35.7 46 180 A R E S-A 6 0A 123 -2,-2.0 2,-0.4 -40,-0.2 -40,-0.2 -0.993 70.2-164.9-139.8 129.3 65.5 52.7 35.4 47 181 A V E -A 5 0A 1 -42,-3.8 -42,-2.5 -2,-0.4 2,-0.8 -0.937 12.5-148.4-120.8 137.3 63.7 55.0 33.0 48 182 A D E -AB 4 60A 23 12,-3.7 12,-1.0 -2,-0.4 2,-0.3 -0.847 21.4-165.1-104.3 102.6 64.4 58.6 32.1 49 183 A V E -AB 3 59A 13 -46,-1.5 -46,-1.9 -2,-0.8 2,-0.3 -0.631 12.3-178.0 -90.0 143.1 61.1 60.5 31.3 50 184 A Y - 0 0 27 8,-3.1 8,-0.3 -2,-0.3 -48,-0.1 -0.774 26.8-131.0-143.5 93.3 61.0 63.9 29.4 51 185 A Q - 0 0 101 -2,-0.3 6,-0.3 6,-0.2 3,-0.1 -0.138 21.8-174.6 -45.5 121.4 57.5 65.4 29.0 52 186 A Q + 0 0 128 4,-2.3 5,-0.2 0, 0.0 -1,-0.1 0.938 67.4 1.0 -86.1 -57.3 57.0 66.5 25.4 53 187 A D S S- 0 0 80 3,-1.8 0, 0.0 0, 0.0 0, 0.0 -0.229 87.7 -91.8-110.8-156.3 53.6 68.2 25.5 54 188 A E S S+ 0 0 155 -2,-0.1 3,-0.1 1,-0.1 -3,-0.0 0.357 130.1 29.8-101.2 1.8 51.2 68.9 28.4 55 189 A Q S S+ 0 0 136 1,-0.2 2,-0.5 60,-0.0 -1,-0.1 0.382 112.2 71.9-134.6 -8.1 49.5 65.6 27.6 56 190 A T - 0 0 29 59,-0.0 -4,-2.3 37,-0.0 -3,-1.8 -0.954 55.7-174.4-123.4 119.7 52.4 63.5 26.1 57 191 A I - 0 0 13 -2,-0.5 37,-1.8 37,-0.3 2,-0.3 -0.848 8.0-155.6-110.3 145.1 55.3 62.1 28.1 58 192 A V E - C 0 93A 23 -2,-0.3 -8,-3.1 -8,-0.3 2,-0.3 -0.901 6.5-165.6-120.9 148.6 58.3 60.3 26.6 59 193 A G E +BC 49 92A 0 33,-2.6 33,-1.1 -2,-0.3 2,-0.3 -0.951 11.1 164.7-133.1 152.9 60.7 57.8 28.2 60 194 A A E -BC 48 91A 19 -12,-1.0 -12,-3.7 -2,-0.3 -17,-0.1 -0.964 35.3 -97.3-156.9 168.6 64.1 56.4 27.5 61 195 A A - 0 0 22 29,-0.6 -14,-0.1 -19,-0.4 5,-0.1 -0.633 42.8-100.3 -94.4 151.2 66.9 54.4 29.0 62 196 A P >> - 0 0 10 0, 0.0 3,-0.9 0, 0.0 4,-0.9 -0.476 45.9-104.7 -66.0 141.6 70.1 56.0 30.5 63 197 A P G >4 S+ 0 0 121 0, 0.0 3,-0.9 0, 0.0 -2,-0.1 0.785 118.3 51.6 -34.6 -50.4 72.9 55.6 27.9 64 198 A I G 34 S+ 0 0 144 1,-0.2 -3,-0.0 3,-0.0 0, 0.0 0.909 106.4 53.1 -59.1 -45.8 74.6 52.7 29.7 65 199 A L G X4 S+ 0 0 49 -3,-0.9 3,-2.7 2,-0.1 -1,-0.2 0.625 79.6 135.9 -66.5 -13.8 71.5 50.6 30.1 66 200 A S T << S- 0 0 58 -3,-0.9 3,-0.1 -4,-0.9 -23,-0.1 -0.034 80.3 -3.6 -41.2 127.7 70.8 50.8 26.3 67 201 A H T 3 S+ 0 0 68 -25,-0.3 12,-1.6 1,-0.2 13,-0.6 0.536 112.7 119.3 64.7 8.4 69.8 47.4 24.8 68 202 A L E < +J 78 0C 42 -3,-2.7 2,-0.3 10,-0.2 -24,-0.2 -0.752 38.1 177.1-112.5 155.9 70.4 45.8 28.2 69 203 A L E -J 77 0C 2 8,-1.4 8,-1.8 -2,-0.3 2,-0.3 -0.950 18.5-143.6-154.4 126.4 68.2 43.9 30.6 70 204 A E E -J 76 0C 40 -2,-0.3 2,-0.3 6,-0.2 6,-0.2 -0.692 15.9-175.2 -93.1 146.4 69.2 42.3 33.9 71 205 A I E >> -J 75 0C 24 4,-0.6 3,-3.2 -2,-0.3 4,-1.9 -0.875 33.6-115.6-146.5 110.3 67.7 39.1 35.0 72 206 A R T 34 S+ 0 0 95 -2,-0.3 -2,-0.0 1,-0.3 -43,-0.0 -0.192 108.0 29.6 -44.6 105.5 68.3 37.4 38.4 73 207 A G T 34 S+ 0 0 75 -2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.087 129.1 35.0 128.2 -23.6 70.0 34.2 37.3 74 208 A L T <4 S- 0 0 116 -3,-3.2 -2,-0.2 1,-0.1 -4,-0.0 0.348 92.3-151.6-134.5 -8.9 71.7 35.3 34.0 75 209 A G E < +J 71 0C 35 -4,-1.9 -4,-0.6 2,-0.1 -1,-0.1 -0.222 58.3 12.2 66.7-157.1 72.7 38.8 34.9 76 210 A I E S-J 70 0C 115 -6,-0.2 2,-0.4 -8,-0.1 -6,-0.2 -0.243 70.1-169.2 -55.7 135.9 72.9 41.5 32.2 77 211 A I E -J 69 0C 21 -8,-1.8 -8,-1.4 4,-0.0 2,-0.9 -0.993 20.4-143.3-134.6 129.6 71.5 40.6 28.8 78 212 A D E > -J 68 0C 45 -2,-0.4 4,-1.7 -10,-0.2 3,-0.3 -0.801 12.7-170.3 -92.2 105.8 71.8 42.4 25.4 79 213 A V H >>S+ 0 0 0 -12,-1.6 4,-2.5 -2,-0.9 5,-0.5 0.765 84.4 62.2 -67.1 -25.7 68.4 41.9 23.7 80 214 A X H >5S+ 0 0 52 -13,-0.6 4,-2.0 3,-0.2 -1,-0.2 0.938 106.6 46.4 -62.9 -43.8 69.8 43.2 20.4 81 215 A N H 45S+ 0 0 126 -3,-0.3 -2,-0.2 -14,-0.2 -1,-0.2 0.923 119.3 37.2 -62.1 -51.5 72.2 40.3 20.4 82 216 A L H <5S+ 0 0 115 -4,-1.7 -2,-0.2 1,-0.1 -1,-0.2 0.779 133.9 18.6 -76.2 -29.9 69.8 37.6 21.2 83 217 A F H <5S- 0 0 84 -4,-2.5 3,-0.3 -5,-0.2 -3,-0.2 0.531 99.3-120.9-122.7 -8.4 66.7 38.8 19.3 84 218 A G ><< - 0 0 28 -4,-2.0 3,-1.6 -5,-0.5 4,-0.2 -0.142 51.2 -46.0 90.7 168.8 67.7 41.3 16.7 85 219 A A G > S+ 0 0 72 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.732 124.0 69.9 -47.7 -33.1 66.8 45.0 16.0 86 220 A G G 3 S+ 0 0 55 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.309 88.6 65.6 -74.5 13.4 63.1 44.4 16.5 87 221 A A G < S+ 0 0 2 -3,-1.6 -46,-2.8 -47,-0.1 2,-0.3 0.453 99.5 53.8-111.4 -2.4 63.6 43.8 20.2 88 222 A V B < -g 41 0B 20 -3,-1.5 2,-0.3 -48,-0.3 -46,-0.2 -0.925 53.2-175.8-133.4 155.9 64.7 47.4 21.0 89 223 A R - 0 0 91 -48,-2.4 -22,-0.1 -2,-0.3 3,-0.0 -0.971 23.2-138.9-150.3 134.2 63.5 50.9 20.5 90 224 A E S S- 0 0 168 -2,-0.3 -29,-0.6 1,-0.1 2,-0.2 0.968 77.2 -9.3 -58.3 -63.2 65.3 54.2 21.4 91 225 A D E +C 60 0A 82 -31,-0.1 2,-0.3 -33,-0.0 -31,-0.2 -0.789 62.7 170.9-132.7 176.7 62.4 56.3 22.8 92 226 A T E -C 59 0A 6 -33,-1.1 -33,-2.6 -2,-0.2 2,-0.3 -0.938 35.8 -93.6-180.0 158.9 58.6 56.2 23.2 93 227 A T E -C 58 0A 56 -2,-0.3 2,-1.1 -35,-0.2 -77,-0.5 -0.643 34.1-130.7 -84.7 137.7 55.5 57.8 24.6 94 228 A I + 0 0 13 -37,-1.8 -37,-0.3 -2,-0.3 -77,-0.2 -0.768 37.2 163.5 -91.0 97.2 54.2 56.3 27.9 95 229 A S + 0 0 35 -79,-1.2 2,-0.3 -2,-1.1 -1,-0.2 0.667 65.2 12.1 -87.3 -19.0 50.5 55.8 27.1 96 230 A L E -f 17 0B 5 -80,-1.9 -78,-2.1 -3,-0.1 2,-0.4 -0.994 59.5-151.5-156.3 154.6 49.9 53.4 30.0 97 231 A I E -fh 18 117B 15 19,-1.5 21,-2.1 -2,-0.3 2,-0.5 -0.982 6.6-158.1-130.9 145.0 51.4 52.0 33.1 98 232 A V E -fh 19 118B 0 -80,-1.5 -78,-2.6 -2,-0.4 2,-0.7 -0.984 6.8-155.3-126.1 119.1 50.9 48.7 34.8 99 233 A H E -fh 20 119B 43 19,-2.9 21,-1.7 -2,-0.5 2,-0.8 -0.857 9.2-148.6 -98.4 113.7 51.6 48.3 38.5 100 234 A L E + h 0 120B 2 -80,-3.1 -78,-0.2 -2,-0.7 2,-0.1 -0.722 34.6 152.0 -84.1 110.9 52.4 44.7 39.4 101 235 A E E - h 0 121B 101 19,-2.7 21,-1.7 -2,-0.8 -1,-0.0 -0.159 34.8-125.3-116.0-149.2 51.3 44.1 43.0 102 236 A N - 0 0 91 19,-0.3 2,-0.4 -2,-0.1 -1,-0.1 0.468 50.9 -13.2-131.0 -89.4 50.1 41.0 44.9 103 237 A W + 0 0 178 18,-0.1 -1,-0.1 2,-0.0 20,-0.0 -0.970 63.0 90.6-145.9 139.8 46.9 40.2 46.9 104 238 A T S S- 0 0 125 -2,-0.4 2,-0.3 2,-0.1 0, 0.0 -0.644 71.0 -51.3-171.0-129.9 43.8 41.7 48.5 105 239 A P 0 0 87 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.993 360.0 360.0-138.8 144.0 40.3 42.2 47.1 106 240 A D 0 0 154 -2,-0.3 -2,-0.1 0, 0.0 0, 0.0 -0.561 360.0 360.0 159.9 360.0 38.8 43.9 44.0 107 ! 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 0.0 108 253 A Q 0 0 228 0, 0.0 10,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 48.7 40.9 53.6 36.4 109 254 A L B -I 117 0B 54 8,-0.6 8,-1.2 1,-0.1 2,-0.2 0.181 360.0-169.3 -71.2-168.7 43.8 55.3 38.2 110 255 A I - 0 0 86 6,-0.2 2,-0.3 4,-0.1 -1,-0.1 -0.858 0.9-159.4-162.3-167.1 46.5 57.6 36.8 111 256 A F > + 0 0 37 -2,-0.2 4,-0.6 6,-0.0 -14,-0.0 -0.988 52.3 2.3-176.8 173.7 49.9 59.2 37.7 112 257 A D T 4 S+ 0 0 72 -2,-0.3 0, 0.0 1,-0.3 0, 0.0 0.363 139.0 6.0 -6.9 70.8 52.6 61.8 37.3 113 258 A V T 4 S- 0 0 47 2,-0.0 -1,-0.3 -62,-0.0 -56,-0.1 0.672 125.3 -80.8 105.0 48.1 50.9 63.8 34.5 114 259 A P T 4 + 0 0 100 0, 0.0 -2,-0.2 0, 0.0 -4,-0.1 0.831 68.8 173.9 23.0 84.2 47.6 61.8 34.6 115 260 A V < - 0 0 20 -4,-0.6 -18,-0.1 -59,-0.0 -19,-0.1 -0.970 41.7 -95.6-119.0 127.5 48.5 58.7 32.6 116 261 A P - 0 0 57 0, 0.0 -19,-1.5 0, 0.0 2,-0.3 -0.029 53.6-176.8 -37.0 130.8 46.1 55.7 32.2 117 262 A K E -hI 97 109B 59 -8,-1.2 -8,-0.6 -21,-0.2 2,-0.3 -0.997 18.2-178.2-143.4 145.9 47.1 53.2 34.8 118 263 A I E -h 98 0B 63 -21,-2.1 -19,-2.9 -2,-0.3 2,-0.5 -0.962 16.0-143.7-138.5 155.2 46.1 49.7 35.9 119 264 A T E -h 99 0B 75 -2,-0.3 -19,-0.2 -21,-0.2 -21,-0.1 -0.979 14.1-169.5-125.7 122.2 47.2 47.4 38.7 120 265 A V E -h 100 0B 16 -21,-1.7 -19,-2.7 -2,-0.5 2,-0.2 -0.909 21.2-122.8-114.5 140.4 47.5 43.6 38.3 121 266 A P E -h 101 0B 61 0, 0.0 2,-0.6 0, 0.0 -19,-0.3 -0.539 17.6-134.2 -79.8 143.0 48.1 41.1 41.1 122 267 A V + 0 0 32 -21,-1.7 2,-0.3 -2,-0.2 -96,-0.0 -0.868 45.2 134.5-100.7 120.5 51.0 38.7 41.1 123 268 A K - 0 0 37 -2,-0.6 3,-0.3 3,-0.1 -21,-0.0 -0.968 59.0 -71.3-164.2 147.4 50.2 35.1 41.9 124 269 A V S S+ 0 0 159 -2,-0.3 3,-0.1 1,-0.2 0, 0.0 0.043 113.2 31.5 -37.8 139.6 50.8 31.5 40.8 125 270 A G S S+ 0 0 86 1,-0.2 2,-0.4 0, 0.0 -1,-0.2 0.766 91.6 113.0 78.6 27.6 49.0 30.6 37.5 126 271 A R - 0 0 38 -3,-0.3 2,-1.3 4,-0.0 -1,-0.2 -0.934 56.2-150.1-137.7 113.0 49.1 34.0 35.9 127 272 A N > - 0 0 67 -2,-0.4 4,-2.4 1,-0.2 3,-0.4 -0.667 11.9-171.4 -81.5 95.1 51.1 34.9 32.8 128 273 A L H > S+ 0 0 26 -2,-1.3 4,-2.6 1,-0.2 5,-0.2 0.847 81.9 61.7 -56.1 -35.1 51.9 38.5 33.5 129 274 A A H > S+ 0 0 1 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.923 109.6 38.7 -58.5 -46.7 53.3 38.8 29.9 130 275 A I H > S+ 0 0 60 -3,-0.4 4,-3.2 2,-0.2 -1,-0.2 0.862 113.5 55.0 -74.7 -33.9 50.0 37.9 28.3 131 276 A I H X S+ 0 0 70 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.898 110.9 45.8 -65.1 -36.8 48.0 39.9 30.8 132 277 A I H X S+ 0 0 1 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.856 111.6 52.7 -72.8 -33.3 50.0 42.9 30.0 133 278 A E H X S+ 0 0 4 -4,-1.7 4,-2.6 -5,-0.2 -2,-0.2 0.945 113.5 43.3 -64.7 -45.5 49.6 42.1 26.3 134 279 A V H X S+ 0 0 71 -4,-3.2 4,-3.4 1,-0.2 5,-0.3 0.931 108.3 58.4 -64.2 -45.7 45.9 41.9 26.8 135 280 A A H X S+ 0 0 18 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.893 111.6 42.7 -50.2 -42.3 45.9 45.1 28.9 136 281 A A H X S+ 0 0 1 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.947 112.3 50.3 -71.8 -50.4 47.5 46.9 25.9 137 282 A X H X S+ 0 0 82 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.938 114.9 47.7 -51.1 -48.2 45.2 45.4 23.3 138 283 A N H X S+ 0 0 83 -4,-3.4 4,-2.4 2,-0.2 -1,-0.2 0.933 108.1 50.6 -59.3 -53.1 42.3 46.4 25.4 139 284 A F H X S+ 0 0 48 -4,-2.3 4,-1.6 -5,-0.3 -1,-0.2 0.890 115.0 47.2 -52.6 -40.1 43.4 49.9 26.1 140 285 A R H X S+ 0 0 124 -4,-2.5 4,-0.7 1,-0.2 -1,-0.2 0.888 106.7 57.0 -69.1 -41.1 43.8 50.2 22.4 141 286 A A H ><>S+ 0 0 24 -4,-2.5 5,-1.5 -5,-0.2 3,-1.0 0.898 106.0 50.1 -58.4 -44.8 40.4 48.7 21.7 142 287 A K H ><5S+ 0 0 104 -4,-2.4 3,-5.1 1,-0.3 -1,-0.2 0.960 98.9 63.6 -60.5 -52.7 38.6 51.3 23.8 143 288 A S H 3<5S+ 0 0 91 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.750 106.2 49.0 -43.1 -24.2 40.3 54.2 22.0 144 289 A X T <<5S- 0 0 107 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.459 127.9-101.2 -97.5 -2.0 38.5 52.8 19.0 145 290 A G T < 5S+ 0 0 27 -3,-5.1 2,-0.4 1,-0.3 -3,-0.2 0.095 80.0 131.0 106.7 -22.9 35.2 52.6 20.8 146 291 A Y < + 0 0 168 -5,-1.5 -1,-0.3 -6,-0.1 2,-0.3 -0.529 31.4 165.9 -70.9 121.9 35.1 48.9 21.5 147 292 A D > - 0 0 55 -2,-0.4 4,-1.7 -3,-0.1 5,-0.2 -0.956 48.3-129.4-137.0 153.6 34.3 48.4 25.1 148 293 A A H > S+ 0 0 74 -2,-0.3 4,-2.6 1,-0.2 5,-0.1 0.840 111.2 59.6 -68.6 -33.3 33.2 45.5 27.4 149 294 A T H > S+ 0 0 88 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.919 103.5 49.3 -61.0 -45.7 30.3 47.8 28.6 150 295 A K H > S+ 0 0 127 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.933 113.2 45.7 -61.3 -46.6 28.9 48.1 25.1 151 296 A T H X S+ 0 0 71 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.897 113.2 52.8 -62.8 -36.8 29.0 44.4 24.5 152 297 A F H X S+ 0 0 135 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.871 109.3 46.3 -65.7 -40.1 27.5 44.0 28.0 153 298 A E H X S+ 0 0 56 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.851 112.0 54.1 -69.9 -33.2 24.6 46.4 27.2 154 299 A K H X S+ 0 0 125 -4,-2.3 4,-1.5 -5,-0.2 -2,-0.2 0.877 108.3 47.8 -67.6 -39.3 24.3 44.5 23.9 155 300 A N H X S+ 0 0 81 -4,-2.2 4,-1.1 1,-0.2 -2,-0.2 0.895 106.3 58.5 -68.1 -40.8 23.9 41.2 25.7 156 301 A L H >X S+ 0 0 88 -4,-1.9 4,-1.8 1,-0.2 3,-0.5 0.899 102.1 53.6 -56.8 -43.9 21.4 42.6 28.1 157 302 A N H 3X S+ 0 0 90 -4,-1.6 4,-3.6 1,-0.2 5,-0.2 0.967 96.6 68.2 -54.0 -53.5 19.1 43.5 25.3 158 303 A H H 3< S+ 0 0 141 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.810 107.0 38.2 -32.4 -52.0 19.3 39.9 24.1 159 304 A L H X< S+ 0 0 119 -4,-1.1 3,-2.8 -3,-0.5 -1,-0.2 0.986 115.4 50.6 -66.7 -61.6 17.3 38.8 27.2 160 305 A I H 3< S+ 0 0 106 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.857 126.0 29.7 -43.2 -43.1 14.9 41.7 27.4 161 306 A E T 3< 0 0 143 -4,-3.6 -1,-0.3 -5,-0.2 -2,-0.2 0.042 360.0 360.0-109.8 26.0 14.1 41.2 23.7 162 307 A H < 0 0 107 -3,-2.8 -3,-0.1 -5,-0.2 -4,-0.1 -0.084 360.0 360.0 -58.6 360.0 14.7 37.4 23.5