PFRMAT TS TARGET TR288 AUTHOR 5370-1100-4902 METHOD The supplied conformation was superimposed on our previous complete METHOD models, and the missing residues were grafted on. Residues 1-5 were METHOD taken from T0288.try2-opt2.repack-nonPC.pdb and 87-end from the first METHOD undertaker-align model (an alignment with 1g9oA). METHOD METHOD The resulting chimera was optimized with undertaker to produce METHOD try6-opt2 (Model 5). METHOD METHOD The model was further optimized by undertaker for try7-opt2 (Model 3) METHOD which also had th sidechains repacked by rosetta (Model 4). This METHOD optimization included alignment insertion, which is almost the same as METHOD starting over with a different initial model, which is not in the METHOD spirit of the refinement experiment. However, try8-opt2 came from an METHOD optimization run with the same starting points and cost function, but METHOD with alignment insertion turned off. It arrived at a very similar METHOD model to try7-opt2. METHOD METHOD try9-opt2 is the optimization of try8-opt2 with break and clash costs METHOD turned up high. It is probably about as good as we can get with the METHOD crude cost functions of undertaker. It is submitted as model 1, METHOD and the same backboen with sidechains repacked by rosetta is submitted METHOD as model 2. METHOD METHOD METHOD METHOD REMARK 6 REMARK 6 TR288 model 3 Thu Jun 15 22:01:38 2006 MODEL 3 PARENT 2fne_A 1xz9_A 1t2m_A 1wfv_A 1x6d_A REMARK 7 REMARK 7 ALLPARENTS 2fne_A 1xz9_A 1t2m_A 1wfv_A 1x6d_A 2fcf_A 1g9o_A REMARK 7 ALLPARENTS 1ihj_A 1q3o_A 1mfg_A ATOM 1 N SER 1 8.093 -2.226 90.885 1.00 0.00 ATOM 2 CA SER 1 9.435 -2.334 91.528 1.00 0.00 ATOM 3 CB SER 1 10.505 -2.550 90.463 1.00 0.00 ATOM 4 OG SER 1 10.633 -1.392 89.658 1.00 0.00 ATOM 5 O SER 1 9.415 0.019 91.929 1.00 0.00 ATOM 6 C SER 1 9.854 -1.071 92.262 1.00 0.00 ATOM 7 N MET 2 10.732 -1.202 93.266 1.00 0.00 ATOM 8 CA MET 2 11.214 -0.004 93.965 1.00 0.00 ATOM 9 CB MET 2 10.946 -0.261 95.506 1.00 0.00 ATOM 10 CG MET 2 9.540 -0.432 96.058 1.00 0.00 ATOM 11 SD MET 2 9.583 -0.840 97.823 1.00 0.00 ATOM 12 CE MET 2 9.996 0.705 98.574 1.00 0.00 ATOM 13 O MET 2 13.538 -0.305 93.609 1.00 0.00 ATOM 14 C MET 2 12.563 0.400 93.409 1.00 0.00 ATOM 15 N VAL 3 12.606 1.524 92.701 1.00 0.00 ATOM 16 CA VAL 3 13.810 2.002 92.029 1.00 0.00 ATOM 17 CB VAL 3 13.486 2.328 90.544 1.00 0.00 ATOM 18 CG1 VAL 3 14.709 2.848 89.824 1.00 0.00 ATOM 19 CG2 VAL 3 12.908 1.136 89.818 1.00 0.00 ATOM 20 O VAL 3 13.631 4.272 92.784 1.00 0.00 ATOM 21 C VAL 3 14.350 3.282 92.664 1.00 0.00 ATOM 22 N PRO 4 15.601 3.286 93.052 1.00 0.00 ATOM 23 CA PRO 4 16.153 4.492 93.670 1.00 0.00 ATOM 24 CB PRO 4 17.524 4.029 94.164 1.00 0.00 ATOM 25 CG PRO 4 17.910 3.002 93.160 1.00 0.00 ATOM 26 CD PRO 4 16.627 2.233 92.937 1.00 0.00 ATOM 27 O PRO 4 16.798 5.622 91.665 1.00 0.00 ATOM 28 C PRO 4 16.402 5.731 92.825 1.00 0.00 ATOM 29 N GLY 5 16.146 6.904 93.397 1.00 0.00 ATOM 30 CA GLY 5 16.344 8.154 92.680 1.00 0.00 ATOM 31 O GLY 5 16.969 9.105 94.790 1.00 0.00 ATOM 32 C GLY 5 17.039 9.180 93.565 1.00 0.00 ATOM 33 N LYS 6 17.614 10.198 92.938 1.00 0.00 ATOM 34 CA LYS 6 18.285 11.259 93.673 1.00 0.00 ATOM 35 CB LYS 6 19.716 11.430 93.162 1.00 0.00 ATOM 36 CG LYS 6 20.533 12.455 93.932 1.00 0.00 ATOM 37 CD LYS 6 21.942 12.569 93.376 1.00 0.00 ATOM 38 CE LYS 6 22.768 13.574 94.165 1.00 0.00 ATOM 39 NZ LYS 6 24.190 13.591 93.724 1.00 0.00 ATOM 40 O LYS 6 17.298 12.971 92.327 1.00 0.00 ATOM 41 C LYS 6 17.528 12.563 93.463 1.00 0.00 ATOM 42 N VAL 7 17.141 13.207 94.558 1.00 0.00 ATOM 43 CA VAL 7 16.393 14.457 94.486 1.00 0.00 ATOM 44 CB VAL 7 14.924 14.237 94.887 1.00 0.00 ATOM 45 CG1 VAL 7 14.835 13.707 96.310 1.00 0.00 ATOM 46 CG2 VAL 7 14.149 15.544 94.812 1.00 0.00 ATOM 47 O VAL 7 17.257 15.228 96.582 1.00 0.00 ATOM 48 C VAL 7 16.990 15.506 95.413 1.00 0.00 ATOM 49 N THR 8 17.196 16.709 94.892 1.00 0.00 ATOM 50 CA THR 8 17.737 17.786 95.707 1.00 0.00 ATOM 51 CB THR 8 18.772 18.622 94.935 1.00 0.00 ATOM 52 CG2 THR 8 19.297 19.756 95.805 1.00 0.00 ATOM 53 OG1 THR 8 19.872 17.789 94.547 1.00 0.00 ATOM 54 O THR 8 15.858 19.232 95.305 1.00 0.00 ATOM 55 C THR 8 16.597 18.700 96.138 1.00 0.00 ATOM 56 N LEU 9 16.446 18.854 97.447 1.00 0.00 ATOM 57 CA LEU 9 15.408 19.704 98.013 1.00 0.00 ATOM 58 CB LEU 9 14.373 18.860 98.786 1.00 0.00 ATOM 59 CG LEU 9 14.711 17.515 99.405 1.00 0.00 ATOM 60 CD1 LEU 9 14.808 17.671 100.896 1.00 0.00 ATOM 61 CD2 LEU 9 13.597 16.568 99.077 1.00 0.00 ATOM 62 O LEU 9 16.931 20.895 99.435 1.00 0.00 ATOM 63 C LEU 9 16.022 20.977 98.585 1.00 0.00 ATOM 64 N GLN 10 15.530 22.135 98.151 1.00 0.00 ATOM 65 CA GLN 10 16.046 23.392 98.632 1.00 0.00 ATOM 66 CB GLN 10 16.387 24.287 97.438 1.00 0.00 ATOM 67 CG GLN 10 16.998 25.625 97.819 1.00 0.00 ATOM 68 CD GLN 10 17.324 26.482 96.613 1.00 0.00 ATOM 69 OE1 GLN 10 16.997 26.127 95.480 1.00 0.00 ATOM 70 NE2 GLN 10 17.971 27.617 96.852 1.00 0.00 ATOM 71 O GLN 10 13.901 24.367 99.046 1.00 0.00 ATOM 72 C GLN 10 15.002 24.068 99.503 1.00 0.00 ATOM 73 N LYS 11 15.321 24.217 100.782 1.00 0.00 ATOM 74 CA LYS 11 14.377 24.799 101.721 1.00 0.00 ATOM 75 CB LYS 11 13.964 23.780 102.785 1.00 0.00 ATOM 76 CG LYS 11 15.126 23.198 103.572 1.00 0.00 ATOM 77 CD LYS 11 14.641 22.225 104.634 1.00 0.00 ATOM 78 CE LYS 11 15.803 21.659 105.435 1.00 0.00 ATOM 79 NZ LYS 11 15.345 20.687 106.467 1.00 0.00 ATOM 80 O LYS 11 16.102 26.157 102.703 1.00 0.00 ATOM 81 C LYS 11 14.898 26.000 102.499 1.00 0.00 ATOM 82 N ASP 12 13.961 26.835 102.938 1.00 0.00 ATOM 83 CA ASP 12 14.255 28.016 103.739 1.00 0.00 ATOM 84 CB ASP 12 13.569 29.245 103.140 1.00 0.00 ATOM 85 CG ASP 12 14.084 29.582 101.754 1.00 0.00 ATOM 86 OD1 ASP 12 15.319 29.630 101.576 1.00 0.00 ATOM 87 OD2 ASP 12 13.253 29.801 100.848 1.00 0.00 ATOM 88 O ASP 12 12.990 26.757 105.340 1.00 0.00 ATOM 89 C ASP 12 13.722 27.730 105.145 1.00 0.00 ATOM 90 N ALA 13 14.078 28.564 106.119 1.00 0.00 ATOM 91 CA ALA 13 13.611 28.366 107.493 1.00 0.00 ATOM 92 CB ALA 13 14.194 29.433 108.409 1.00 0.00 ATOM 93 O ALA 13 11.520 27.853 108.505 1.00 0.00 ATOM 94 C ALA 13 12.106 28.517 107.659 1.00 0.00 ATOM 95 N GLN 14 11.506 29.422 106.896 1.00 0.00 ATOM 96 CA GLN 14 10.058 29.647 107.008 1.00 0.00 ATOM 97 CB GLN 14 9.663 30.817 106.105 1.00 0.00 ATOM 98 CG GLN 14 10.111 32.176 106.617 1.00 0.00 ATOM 99 CD GLN 14 9.735 33.306 105.680 1.00 0.00 ATOM 100 OE1 GLN 14 9.092 33.085 104.653 1.00 0.00 ATOM 101 NE2 GLN 14 10.136 34.522 106.028 1.00 0.00 ATOM 102 O GLN 14 8.023 28.377 106.925 1.00 0.00 ATOM 103 C GLN 14 9.201 28.458 106.569 1.00 0.00 ATOM 104 N ASN 15 9.800 27.495 105.874 1.00 0.00 ATOM 105 CA ASN 15 9.017 26.362 105.412 1.00 0.00 ATOM 106 CB ASN 15 9.032 26.296 103.917 1.00 0.00 ATOM 107 CG ASN 15 8.243 27.423 103.307 1.00 0.00 ATOM 108 ND2 ASN 15 8.928 28.326 102.616 1.00 0.00 ATOM 109 OD1 ASN 15 7.023 27.487 103.462 1.00 0.00 ATOM 110 O ASN 15 8.611 24.104 106.058 1.00 0.00 ATOM 111 C ASN 15 9.455 24.962 105.798 1.00 0.00 ATOM 112 N LEU 16 10.756 24.703 105.785 1.00 0.00 ATOM 113 CA LEU 16 11.226 23.372 106.126 1.00 0.00 ATOM 114 CB LEU 16 10.440 22.821 107.318 1.00 0.00 ATOM 115 CG LEU 16 10.533 23.623 108.618 1.00 0.00 ATOM 116 CD1 LEU 16 9.640 23.015 109.689 1.00 0.00 ATOM 117 CD2 LEU 16 11.962 23.636 109.142 1.00 0.00 ATOM 118 O LEU 16 10.722 22.867 103.840 1.00 0.00 ATOM 119 C LEU 16 11.062 22.430 104.945 1.00 0.00 ATOM 120 N ILE 17 11.299 21.142 105.175 1.00 0.00 ATOM 121 CA ILE 17 11.197 20.128 104.128 1.00 0.00 ATOM 122 CB ILE 17 11.768 18.750 104.692 1.00 0.00 ATOM 123 CG1 ILE 17 13.288 18.877 104.867 1.00 0.00 ATOM 124 CG2 ILE 17 11.427 17.582 103.749 1.00 0.00 ATOM 125 CD1 ILE 17 13.955 17.736 105.591 1.00 0.00 ATOM 126 O ILE 17 9.590 19.700 102.403 1.00 0.00 ATOM 127 C ILE 17 9.781 19.970 103.589 1.00 0.00 ATOM 128 N GLY 18 8.792 20.128 104.461 1.00 0.00 ATOM 129 CA GLY 18 7.408 19.999 104.030 1.00 0.00 ATOM 130 O GLY 18 6.104 18.289 102.978 1.00 0.00 ATOM 131 C GLY 18 6.928 18.571 103.855 1.00 0.00 ATOM 132 N ILE 19 7.352 17.687 104.756 1.00 0.00 ATOM 133 CA ILE 19 6.949 16.285 104.700 1.00 0.00 ATOM 134 CB ILE 19 8.042 15.432 104.031 1.00 0.00 ATOM 135 CG1 ILE 19 9.349 15.525 104.820 1.00 0.00 ATOM 136 CG2 ILE 19 8.301 15.914 102.611 1.00 0.00 ATOM 137 CD1 ILE 19 10.413 14.551 104.359 1.00 0.00 ATOM 138 O ILE 19 7.265 16.223 107.074 1.00 0.00 ATOM 139 C ILE 19 6.753 15.695 106.088 1.00 0.00 ATOM 140 N SER 20 6.038 14.575 106.139 1.00 0.00 ATOM 141 CA SER 20 5.834 13.820 107.368 1.00 0.00 ATOM 142 CB SER 20 4.339 13.753 107.683 1.00 0.00 ATOM 143 OG SER 20 3.802 15.048 107.895 1.00 0.00 ATOM 144 O SER 20 6.309 11.959 105.933 1.00 0.00 ATOM 145 C SER 20 6.422 12.439 107.063 1.00 0.00 ATOM 146 N ILE 21 6.972 11.768 108.068 1.00 0.00 ATOM 147 CA ILE 21 7.552 10.443 107.850 1.00 0.00 ATOM 148 CB ILE 21 9.090 10.482 107.910 1.00 0.00 ATOM 149 CG1 ILE 21 9.557 10.980 109.280 1.00 0.00 ATOM 150 CG2 ILE 21 9.642 11.414 106.844 1.00 0.00 ATOM 151 CD1 ILE 21 11.051 10.872 109.492 1.00 0.00 ATOM 152 O ILE 21 6.656 9.807 109.960 1.00 0.00 ATOM 153 C ILE 21 7.013 9.452 108.846 1.00 0.00 ATOM 154 N GLY 22 6.957 8.164 108.480 1.00 0.00 ATOM 155 CA GLY 22 6.693 7.061 109.384 1.00 0.00 ATOM 156 O GLY 22 8.642 6.117 108.365 1.00 0.00 ATOM 157 C GLY 22 7.749 5.987 109.209 1.00 0.00 ATOM 158 N GLY 23 7.772 4.966 110.003 1.00 0.00 ATOM 159 CA GLY 23 8.734 3.886 109.889 1.00 0.00 ATOM 160 O GLY 23 10.198 5.102 111.450 1.00 0.00 ATOM 161 C GLY 23 9.991 4.097 110.750 1.00 0.00 ATOM 162 N GLY 24 10.796 2.977 110.657 1.00 0.00 ATOM 163 CA GLY 24 12.072 2.873 111.381 1.00 0.00 ATOM 164 O GLY 24 11.477 0.582 111.709 1.00 0.00 ATOM 165 C GLY 24 12.393 1.406 111.611 1.00 0.00 ATOM 166 N ALA 25 13.677 1.067 111.698 1.00 0.00 ATOM 167 CA ALA 25 14.078 -0.327 111.883 1.00 0.00 ATOM 168 CB ALA 25 15.594 -0.448 111.861 1.00 0.00 ATOM 169 O ALA 25 13.480 -2.221 113.219 1.00 0.00 ATOM 170 C ALA 25 13.586 -0.995 113.164 1.00 0.00 ATOM 171 N GLN 26 13.358 -0.200 114.213 1.00 0.00 ATOM 172 CA GLN 26 12.896 -0.776 115.476 1.00 0.00 ATOM 173 CB GLN 26 12.740 0.307 116.545 1.00 0.00 ATOM 174 CG GLN 26 14.052 0.936 116.987 1.00 0.00 ATOM 175 CD GLN 26 13.857 2.021 118.026 1.00 0.00 ATOM 176 OE1 GLN 26 12.734 2.292 118.452 1.00 0.00 ATOM 177 NE2 GLN 26 14.953 2.649 118.438 1.00 0.00 ATOM 178 O GLN 26 11.383 -2.615 115.802 1.00 0.00 ATOM 179 C GLN 26 11.621 -1.566 115.197 1.00 0.00 ATOM 180 N TYR 27 10.825 -1.101 114.279 1.00 0.00 ATOM 181 CA TYR 27 9.587 -1.778 113.917 1.00 0.00 ATOM 182 CB TYR 27 8.377 -0.610 114.238 1.00 0.00 ATOM 183 CG TYR 27 8.568 0.442 115.319 1.00 0.00 ATOM 184 CD1 TYR 27 9.280 1.608 115.080 1.00 0.00 ATOM 185 CD2 TYR 27 8.038 0.266 116.593 1.00 0.00 ATOM 186 CE1 TYR 27 9.457 2.576 116.073 1.00 0.00 ATOM 187 CE2 TYR 27 8.211 1.212 117.594 1.00 0.00 ATOM 188 CZ TYR 27 8.933 2.362 117.337 1.00 0.00 ATOM 189 OH TYR 27 9.105 3.313 118.331 1.00 0.00 ATOM 190 O TYR 27 8.713 -2.866 111.953 1.00 0.00 ATOM 191 C TYR 27 9.710 -2.498 112.573 1.00 0.00 ATOM 192 N CYS 28 10.957 -2.758 112.180 1.00 0.00 ATOM 193 CA CYS 28 11.284 -3.450 110.932 1.00 0.00 ATOM 194 CB CYS 28 10.759 -4.887 110.939 1.00 0.00 ATOM 195 SG CYS 28 11.419 -5.916 112.271 1.00 0.00 ATOM 196 O CYS 28 10.526 -3.441 108.656 1.00 0.00 ATOM 197 C CYS 28 10.769 -2.776 109.664 1.00 0.00 ATOM 198 N PRO 29 10.732 -1.448 109.671 1.00 0.00 ATOM 199 CA PRO 29 10.260 -0.696 108.516 1.00 0.00 ATOM 200 CB PRO 29 9.169 -0.048 108.796 1.00 0.00 ATOM 201 CG PRO 29 8.682 -0.309 110.194 1.00 0.00 ATOM 202 CD PRO 29 9.108 -1.794 110.341 1.00 0.00 ATOM 203 O PRO 29 11.925 1.000 108.839 1.00 0.00 ATOM 204 C PRO 29 11.222 0.384 108.043 1.00 0.00 ATOM 205 N CYS 30 11.265 0.630 106.729 1.00 0.00 ATOM 206 CA CYS 30 12.168 1.676 106.243 1.00 0.00 ATOM 207 CB CYS 30 12.689 1.886 105.163 1.00 0.00 ATOM 208 SG CYS 30 14.365 1.195 105.427 1.00 0.00 ATOM 209 O CYS 30 10.504 3.069 107.258 1.00 0.00 ATOM 210 C CYS 30 11.593 3.010 106.674 1.00 0.00 ATOM 211 N LEU 31 12.322 4.078 106.372 1.00 0.00 ATOM 212 CA LEU 31 11.849 5.424 106.648 1.00 0.00 ATOM 213 CB LEU 31 12.985 6.430 106.837 1.00 0.00 ATOM 214 CG LEU 31 12.571 7.872 107.138 1.00 0.00 ATOM 215 CD1 LEU 31 11.870 7.960 108.485 1.00 0.00 ATOM 216 CD2 LEU 31 13.786 8.785 107.174 1.00 0.00 ATOM 217 O LEU 31 11.520 5.785 104.305 1.00 0.00 ATOM 218 C LEU 31 11.014 5.773 105.427 1.00 0.00 ATOM 219 N TYR 32 9.728 6.013 105.635 1.00 0.00 ATOM 220 CA TYR 32 8.840 6.320 104.522 1.00 0.00 ATOM 221 CB TYR 32 7.678 5.327 104.474 1.00 0.00 ATOM 222 CG TYR 32 8.101 3.901 104.205 1.00 0.00 ATOM 223 CD1 TYR 32 8.400 3.038 105.252 1.00 0.00 ATOM 224 CD2 TYR 32 8.200 3.422 102.905 1.00 0.00 ATOM 225 CE1 TYR 32 8.788 1.733 105.015 1.00 0.00 ATOM 226 CE2 TYR 32 8.585 2.119 102.649 1.00 0.00 ATOM 227 CZ TYR 32 8.881 1.274 103.718 1.00 0.00 ATOM 228 OH TYR 32 9.267 -0.025 103.480 1.00 0.00 ATOM 229 O TYR 32 7.894 8.190 105.739 1.00 0.00 ATOM 230 C TYR 32 8.272 7.723 104.631 1.00 0.00 ATOM 231 N ILE 33 8.086 8.380 103.485 1.00 0.00 ATOM 232 CA ILE 33 7.400 9.638 103.402 1.00 0.00 ATOM 233 CB ILE 33 7.723 10.383 102.093 1.00 0.00 ATOM 234 CG1 ILE 33 9.229 10.638 101.983 1.00 0.00 ATOM 235 CG2 ILE 33 7.004 11.723 102.051 1.00 0.00 ATOM 236 CD1 ILE 33 9.663 11.156 100.631 1.00 0.00 ATOM 237 O ILE 33 5.353 8.620 102.667 1.00 0.00 ATOM 238 C ILE 33 5.900 9.340 103.500 1.00 0.00 ATOM 239 N VAL 34 5.243 9.879 104.524 1.00 0.00 ATOM 240 CA VAL 34 3.815 9.635 104.727 1.00 0.00 ATOM 241 CB VAL 34 3.498 9.382 106.213 1.00 0.00 ATOM 242 CG1 VAL 34 4.288 8.190 106.732 1.00 0.00 ATOM 243 CG2 VAL 34 3.862 10.600 107.050 1.00 0.00 ATOM 244 O VAL 34 1.788 10.589 103.840 1.00 0.00 ATOM 245 C VAL 34 2.945 10.791 104.241 1.00 0.00 ATOM 246 N GLN 35 3.559 11.959 104.101 1.00 0.00 ATOM 247 CA GLN 35 2.847 13.132 103.624 1.00 0.00 ATOM 248 CB GLN 35 2.114 13.787 104.797 1.00 0.00 ATOM 249 CG GLN 35 1.351 15.048 104.426 1.00 0.00 ATOM 250 CD GLN 35 0.521 15.586 105.575 1.00 0.00 ATOM 251 OE1 GLN 35 0.599 15.088 106.698 1.00 0.00 ATOM 252 NE2 GLN 35 -0.282 16.607 105.296 1.00 0.00 ATOM 253 O GLN 35 4.885 14.391 103.545 1.00 0.00 ATOM 254 C GLN 35 3.787 14.173 103.032 1.00 0.00 ATOM 255 N VAL 36 3.296 14.900 102.033 1.00 0.00 ATOM 256 CA VAL 36 4.061 15.971 101.398 1.00 0.00 ATOM 257 CB VAL 36 4.473 15.588 99.965 1.00 0.00 ATOM 258 CG1 VAL 36 5.255 16.720 99.315 1.00 0.00 ATOM 259 CG2 VAL 36 5.351 14.344 99.979 1.00 0.00 ATOM 260 O VAL 36 2.098 17.163 100.704 1.00 0.00 ATOM 261 C VAL 36 3.123 17.173 101.389 1.00 0.00 ATOM 262 N PHE 37 3.486 18.208 102.139 1.00 0.00 ATOM 263 CA PHE 37 2.658 19.403 102.249 1.00 0.00 ATOM 264 CB PHE 37 3.134 20.280 103.408 1.00 0.00 ATOM 265 CG PHE 37 2.846 19.703 104.766 1.00 0.00 ATOM 266 CD1 PHE 37 3.835 19.051 105.480 1.00 0.00 ATOM 267 CD2 PHE 37 1.585 19.811 105.325 1.00 0.00 ATOM 268 CE1 PHE 37 3.568 18.519 106.727 1.00 0.00 ATOM 269 CE2 PHE 37 1.319 19.280 106.573 1.00 0.00 ATOM 270 CZ PHE 37 2.305 18.636 107.274 1.00 0.00 ATOM 271 O PHE 37 3.692 20.472 100.357 1.00 0.00 ATOM 272 C PHE 37 2.656 20.250 100.989 1.00 0.00 ATOM 273 N ASP 38 1.459 20.677 100.613 1.00 0.00 ATOM 274 CA ASP 38 1.247 21.494 99.430 1.00 0.00 ATOM 275 CB ASP 38 -0.230 21.868 99.294 1.00 0.00 ATOM 276 CG ASP 38 -1.088 20.699 98.850 1.00 0.00 ATOM 277 OD1 ASP 38 -0.517 19.657 98.465 1.00 0.00 ATOM 278 OD2 ASP 38 -2.329 20.825 98.887 1.00 0.00 ATOM 279 O ASP 38 2.007 23.524 100.468 1.00 0.00 ATOM 280 C ASP 38 2.029 22.807 99.467 1.00 0.00 ATOM 281 N ASN 39 2.777 23.071 98.397 1.00 0.00 ATOM 282 CA ASN 39 3.531 24.309 98.287 1.00 0.00 ATOM 283 CB ASN 39 2.723 25.475 98.874 1.00 0.00 ATOM 284 CG ASN 39 1.628 25.805 97.923 1.00 0.00 ATOM 285 ND2 ASN 39 0.426 25.914 98.467 1.00 0.00 ATOM 286 OD1 ASN 39 1.842 25.801 96.674 1.00 0.00 ATOM 287 O ASN 39 5.492 25.501 98.910 1.00 0.00 ATOM 288 C ASN 39 4.843 24.464 99.036 1.00 0.00 ATOM 289 N THR 40 5.268 23.450 99.783 1.00 0.00 ATOM 290 CA THR 40 6.517 23.574 100.523 1.00 0.00 ATOM 291 CB THR 40 6.477 22.850 101.882 1.00 0.00 ATOM 292 CG2 THR 40 5.343 23.391 102.739 1.00 0.00 ATOM 293 OG1 THR 40 6.273 21.448 101.672 1.00 0.00 ATOM 294 O THR 40 7.560 22.684 98.607 1.00 0.00 ATOM 295 C THR 40 7.709 23.076 99.763 1.00 0.00 ATOM 296 N PRO 41 8.907 23.002 100.374 1.00 0.00 ATOM 297 CA PRO 41 10.086 22.523 99.648 1.00 0.00 ATOM 298 CB PRO 41 11.208 22.670 100.632 1.00 0.00 ATOM 299 CG PRO 41 10.808 23.954 101.288 1.00 0.00 ATOM 300 CD PRO 41 9.323 24.136 101.193 1.00 0.00 ATOM 301 O PRO 41 10.446 21.057 97.796 1.00 0.00 ATOM 302 C PRO 41 10.026 21.167 98.946 1.00 0.00 ATOM 303 N ALA 42 9.528 20.140 99.625 1.00 0.00 ATOM 304 CA ALA 42 9.449 18.816 99.012 1.00 0.00 ATOM 305 CB ALA 42 8.902 17.805 100.008 1.00 0.00 ATOM 306 O ALA 42 8.880 18.282 96.737 1.00 0.00 ATOM 307 C ALA 42 8.537 18.826 97.787 1.00 0.00 ATOM 308 N ALA 43 7.365 19.431 97.942 1.00 0.00 ATOM 309 CA ALA 43 6.392 19.528 96.858 1.00 0.00 ATOM 310 CB ALA 43 5.141 20.251 97.332 1.00 0.00 ATOM 311 O ALA 43 6.687 20.002 94.520 1.00 0.00 ATOM 312 C ALA 43 6.978 20.301 95.679 1.00 0.00 ATOM 313 N LEU 44 7.782 21.319 95.979 1.00 0.00 ATOM 314 CA LEU 44 8.403 22.131 94.938 1.00 0.00 ATOM 315 CB LEU 44 9.250 23.242 95.559 1.00 0.00 ATOM 316 CG LEU 44 8.489 24.333 96.316 1.00 0.00 ATOM 317 CD1 LEU 44 9.455 25.293 96.993 1.00 0.00 ATOM 318 CD2 LEU 44 7.609 25.132 95.367 1.00 0.00 ATOM 319 O LEU 44 9.448 21.732 92.814 1.00 0.00 ATOM 320 C LEU 44 9.296 21.349 93.969 1.00 0.00 ATOM 321 N ASP 45 9.874 20.259 94.437 1.00 0.00 ATOM 322 CA ASP 45 10.755 19.426 93.621 1.00 0.00 ATOM 323 CB ASP 45 11.464 18.352 94.447 1.00 0.00 ATOM 324 CG ASP 45 12.525 18.928 95.364 1.00 0.00 ATOM 325 OD1 ASP 45 12.884 20.111 95.188 1.00 0.00 ATOM 326 OD2 ASP 45 12.997 18.196 96.259 1.00 0.00 ATOM 327 O ASP 45 10.636 18.377 91.467 1.00 0.00 ATOM 328 C ASP 45 10.026 18.703 92.491 1.00 0.00 ATOM 329 N GLY 46 8.723 18.474 92.664 1.00 0.00 ATOM 330 CA GLY 46 7.934 17.735 91.672 1.00 0.00 ATOM 331 O GLY 46 7.978 15.566 90.658 1.00 0.00 ATOM 332 C GLY 46 8.445 16.313 91.535 1.00 0.00 ATOM 333 N THR 47 9.391 15.944 92.401 1.00 0.00 ATOM 334 CA THR 47 10.055 14.635 92.269 1.00 0.00 ATOM 335 CB THR 47 11.521 14.943 91.804 1.00 0.00 ATOM 336 CG2 THR 47 11.544 15.610 90.429 1.00 0.00 ATOM 337 OG1 THR 47 12.127 15.823 92.758 1.00 0.00 ATOM 338 O THR 47 10.653 12.649 93.463 1.00 0.00 ATOM 339 C THR 47 9.979 13.678 93.459 1.00 0.00 ATOM 340 N VAL 48 9.171 14.013 94.462 1.00 0.00 ATOM 341 CA VAL 48 9.007 13.166 95.647 1.00 0.00 ATOM 342 CB VAL 48 9.446 13.898 96.928 1.00 0.00 ATOM 343 CG1 VAL 48 10.927 14.239 96.867 1.00 0.00 ATOM 344 CG2 VAL 48 8.662 15.191 97.099 1.00 0.00 ATOM 345 O VAL 48 6.644 13.501 95.375 1.00 0.00 ATOM 346 C VAL 48 7.537 12.761 95.786 1.00 0.00 ATOM 347 N ALA 49 7.294 11.575 96.338 1.00 0.00 ATOM 348 CA ALA 49 5.929 11.085 96.492 1.00 0.00 ATOM 349 CB ALA 49 5.557 10.151 95.350 1.00 0.00 ATOM 350 O ALA 49 6.685 9.795 98.359 1.00 0.00 ATOM 351 C ALA 49 5.735 10.320 97.787 1.00 0.00 ATOM 352 N ALA 50 4.496 10.306 98.265 1.00 0.00 ATOM 353 CA ALA 50 4.151 9.563 99.465 1.00 0.00 ATOM 354 CB ALA 50 2.690 9.783 99.824 1.00 0.00 ATOM 355 O ALA 50 4.163 7.684 97.972 1.00 0.00 ATOM 356 C ALA 50 4.425 8.105 99.100 1.00 0.00 ATOM 357 N GLY 51 4.983 7.344 100.031 1.00 0.00 ATOM 358 CA GLY 51 5.287 5.957 99.736 1.00 0.00 ATOM 359 O GLY 51 7.223 4.618 99.325 1.00 0.00 ATOM 360 C GLY 51 6.750 5.756 99.376 1.00 0.00 ATOM 361 N ASP 52 7.479 6.852 99.173 1.00 0.00 ATOM 362 CA ASP 52 8.908 6.776 98.859 1.00 0.00 ATOM 363 CB ASP 52 9.402 8.110 98.295 1.00 0.00 ATOM 364 CG ASP 52 8.894 8.373 96.891 1.00 0.00 ATOM 365 OD1 ASP 52 8.355 7.433 96.268 1.00 0.00 ATOM 366 OD2 ASP 52 9.034 9.517 96.412 1.00 0.00 ATOM 367 O ASP 52 9.217 6.830 101.247 1.00 0.00 ATOM 368 C ASP 52 9.611 6.392 100.155 1.00 0.00 ATOM 369 N GLU 53 10.613 5.543 100.054 1.00 0.00 ATOM 370 CA GLU 53 11.503 5.310 101.192 1.00 0.00 ATOM 371 CB GLU 53 11.936 3.843 101.164 1.00 0.00 ATOM 372 CG GLU 53 12.689 3.394 102.405 1.00 0.00 ATOM 373 CD GLU 53 13.082 1.930 102.353 1.00 0.00 ATOM 374 OE1 GLU 53 12.193 1.086 102.113 1.00 0.00 ATOM 375 OE2 GLU 53 14.276 1.627 102.553 1.00 0.00 ATOM 376 O GLU 53 13.189 6.485 99.975 1.00 0.00 ATOM 377 C GLU 53 12.706 6.239 101.077 1.00 0.00 ATOM 378 N ILE 54 13.128 6.831 102.188 1.00 0.00 ATOM 379 CA ILE 54 14.292 7.709 102.176 1.00 0.00 ATOM 380 CB ILE 54 14.142 8.848 103.202 1.00 0.00 ATOM 381 CG1 ILE 54 12.919 9.706 102.872 1.00 0.00 ATOM 382 CG2 ILE 54 15.374 9.741 103.189 1.00 0.00 ATOM 383 CD1 ILE 54 12.567 10.708 103.950 1.00 0.00 ATOM 384 O ILE 54 15.463 6.153 103.571 1.00 0.00 ATOM 385 C ILE 54 15.466 6.802 102.526 1.00 0.00 ATOM 386 N THR 55 16.413 6.673 101.605 1.00 0.00 ATOM 387 CA THR 55 17.555 5.791 101.818 1.00 0.00 ATOM 388 CB THR 55 17.881 4.966 100.558 1.00 0.00 ATOM 389 CG2 THR 55 16.683 4.121 100.150 1.00 0.00 ATOM 390 OG1 THR 55 18.215 5.848 99.479 1.00 0.00 ATOM 391 O THR 55 19.729 5.898 102.818 1.00 0.00 ATOM 392 C THR 55 18.855 6.494 102.184 1.00 0.00 ATOM 393 N GLY 56 18.962 7.767 101.835 1.00 0.00 ATOM 394 CA GLY 56 20.165 8.519 102.156 1.00 0.00 ATOM 395 O GLY 56 19.115 10.532 101.383 1.00 0.00 ATOM 396 C GLY 56 19.872 10.012 102.205 1.00 0.00 ATOM 397 N VAL 57 20.514 10.698 103.144 1.00 0.00 ATOM 398 CA VAL 57 20.368 12.145 103.308 1.00 0.00 ATOM 399 CB VAL 57 19.642 12.487 104.623 1.00 0.00 ATOM 400 CG1 VAL 57 19.512 13.993 104.783 1.00 0.00 ATOM 401 CG2 VAL 57 18.247 11.880 104.634 1.00 0.00 ATOM 402 O VAL 57 22.543 12.461 104.258 1.00 0.00 ATOM 403 C VAL 57 21.782 12.709 103.321 1.00 0.00 ATOM 404 N ASN 58 22.119 13.493 102.306 1.00 0.00 ATOM 405 CA ASN 58 23.458 14.066 102.203 1.00 0.00 ATOM 406 CB ASN 58 23.654 15.158 103.257 1.00 0.00 ATOM 407 CG ASN 58 24.854 16.039 102.966 1.00 0.00 ATOM 408 ND2 ASN 58 25.439 16.604 104.016 1.00 0.00 ATOM 409 OD1 ASN 58 25.249 16.206 101.812 1.00 0.00 ATOM 410 O ASN 58 25.566 13.280 103.062 1.00 0.00 ATOM 411 C ASN 58 24.560 13.021 102.401 1.00 0.00 ATOM 412 N GLY 59 24.401 11.870 101.761 1.00 0.00 ATOM 413 CA GLY 59 25.408 10.826 101.859 1.00 0.00 ATOM 414 O GLY 59 25.970 8.904 103.164 1.00 0.00 ATOM 415 C GLY 59 25.277 9.920 103.067 1.00 0.00 ATOM 416 N ARG 60 24.423 10.297 104.009 1.00 0.00 ATOM 417 CA ARG 60 24.233 9.490 105.200 1.00 0.00 ATOM 418 CB ARG 60 24.031 10.370 106.462 1.00 0.00 ATOM 419 CG ARG 60 25.181 11.348 106.744 1.00 0.00 ATOM 420 CD ARG 60 24.813 12.276 107.863 1.00 0.00 ATOM 421 NE ARG 60 25.814 13.248 108.291 1.00 0.00 ATOM 422 CZ ARG 60 26.018 14.450 107.774 1.00 0.00 ATOM 423 NH1 ARG 60 25.245 14.806 106.744 1.00 0.00 ATOM 424 NH2 ARG 60 26.946 15.277 108.246 1.00 0.00 ATOM 425 O ARG 60 22.025 8.709 104.671 1.00 0.00 ATOM 426 C ARG 60 23.179 8.413 104.969 1.00 0.00 ATOM 427 N SER 61 23.603 7.160 105.073 1.00 0.00 ATOM 428 CA SER 61 22.716 6.025 104.862 1.00 0.00 ATOM 429 CB SER 61 23.517 4.723 104.831 1.00 0.00 ATOM 430 OG SER 61 22.665 3.603 104.667 1.00 0.00 ATOM 431 O SER 61 21.948 5.837 107.133 1.00 0.00 ATOM 432 C SER 61 21.645 5.869 105.941 1.00 0.00 ATOM 433 N ILE 62 20.388 5.782 105.518 1.00 0.00 ATOM 434 CA ILE 62 19.276 5.626 106.449 1.00 0.00 ATOM 435 CB ILE 62 18.362 6.854 106.475 1.00 0.00 ATOM 436 CG1 ILE 62 17.782 7.135 105.084 1.00 0.00 ATOM 437 CG2 ILE 62 19.146 8.047 106.976 1.00 0.00 ATOM 438 CD1 ILE 62 16.753 8.253 105.061 1.00 0.00 ATOM 439 O ILE 62 17.405 4.156 106.713 1.00 0.00 ATOM 440 C ILE 62 18.485 4.354 106.160 1.00 0.00 ATOM 441 N LYS 63 19.035 3.474 105.327 1.00 0.00 ATOM 442 CA LYS 63 18.340 2.243 104.960 1.00 0.00 ATOM 443 CB LYS 63 19.190 1.414 103.996 1.00 0.00 ATOM 444 CG LYS 63 19.346 2.035 102.616 1.00 0.00 ATOM 445 CD LYS 63 20.224 1.176 101.721 1.00 0.00 ATOM 446 CE LYS 63 20.347 1.776 100.329 1.00 0.00 ATOM 447 NZ LYS 63 21.228 0.959 99.449 1.00 0.00 ATOM 448 O LYS 63 17.172 0.445 106.024 1.00 0.00 ATOM 449 C LYS 63 18.016 1.329 106.138 1.00 0.00 ATOM 450 N GLY 64 18.706 1.508 107.260 1.00 0.00 ATOM 451 CA GLY 64 18.435 0.677 108.431 1.00 0.00 ATOM 452 O GLY 64 18.678 1.100 110.786 1.00 0.00 ATOM 453 C GLY 64 18.375 1.547 109.682 1.00 0.00 ATOM 454 N LYS 65 17.970 2.796 109.499 1.00 0.00 ATOM 455 CA LYS 65 17.878 3.736 110.607 1.00 0.00 ATOM 456 CB LYS 65 18.109 5.187 110.086 1.00 0.00 ATOM 457 CG LYS 65 19.556 5.717 110.194 1.00 0.00 ATOM 458 CD LYS 65 20.646 4.728 109.747 1.00 0.00 ATOM 459 CE LYS 65 22.066 5.340 109.834 1.00 0.00 ATOM 460 NZ LYS 65 22.996 4.615 110.754 1.00 0.00 ATOM 461 O LYS 65 15.566 3.124 110.960 1.00 0.00 ATOM 462 C LYS 65 16.628 3.552 111.456 1.00 0.00 ATOM 463 N THR 66 16.757 3.770 112.774 1.00 0.00 ATOM 464 CA THR 66 15.551 3.871 113.600 1.00 0.00 ATOM 465 CB THR 66 15.993 3.807 115.073 1.00 0.00 ATOM 466 CG2 THR 66 16.898 2.609 115.307 1.00 0.00 ATOM 467 OG1 THR 66 16.708 5.002 115.413 1.00 0.00 ATOM 468 O THR 66 15.331 6.049 112.646 1.00 0.00 ATOM 469 C THR 66 14.795 5.155 113.302 1.00 0.00 ATOM 470 N LYS 67 13.561 5.262 113.781 1.00 0.00 ATOM 471 CA LYS 67 12.786 6.479 113.544 1.00 0.00 ATOM 472 CB LYS 67 11.436 6.402 114.258 1.00 0.00 ATOM 473 CG LYS 67 10.544 7.612 114.033 1.00 0.00 ATOM 474 CD LYS 67 9.196 7.438 114.713 1.00 0.00 ATOM 475 CE LYS 67 8.322 8.669 114.528 1.00 0.00 ATOM 476 NZ LYS 67 7.006 8.522 115.208 1.00 0.00 ATOM 477 O LYS 67 13.686 8.717 113.415 1.00 0.00 ATOM 478 C LYS 67 13.567 7.686 114.084 1.00 0.00 ATOM 479 N VAL 68 14.109 7.548 115.289 1.00 0.00 ATOM 480 CA VAL 68 14.858 8.634 115.913 1.00 0.00 ATOM 481 CB VAL 68 15.388 8.229 117.301 1.00 0.00 ATOM 482 CG1 VAL 68 16.334 9.290 117.841 1.00 0.00 ATOM 483 CG2 VAL 68 14.237 8.066 118.283 1.00 0.00 ATOM 484 O VAL 68 16.323 10.219 114.918 1.00 0.00 ATOM 485 C VAL 68 16.099 9.032 115.108 1.00 0.00 ATOM 486 N GLU 69 16.887 8.079 114.648 1.00 0.00 ATOM 487 CA GLU 69 18.079 8.415 113.861 1.00 0.00 ATOM 488 CB GLU 69 18.794 7.131 113.436 1.00 0.00 ATOM 489 CG GLU 69 19.488 6.401 114.574 1.00 0.00 ATOM 490 CD GLU 69 20.079 5.074 114.142 1.00 0.00 ATOM 491 OE1 GLU 69 19.883 4.690 112.970 1.00 0.00 ATOM 492 OE2 GLU 69 20.739 4.418 114.974 1.00 0.00 ATOM 493 O GLU 69 18.385 10.135 112.212 1.00 0.00 ATOM 494 C GLU 69 17.701 9.189 112.601 1.00 0.00 ATOM 495 N VAL 70 16.605 8.779 111.966 1.00 0.00 ATOM 496 CA VAL 70 16.123 9.438 110.756 1.00 0.00 ATOM 497 CB VAL 70 14.937 8.765 110.120 1.00 0.00 ATOM 498 CG1 VAL 70 14.445 9.585 108.933 1.00 0.00 ATOM 499 CG2 VAL 70 15.337 7.368 109.670 1.00 0.00 ATOM 500 O VAL 70 16.112 11.791 110.307 1.00 0.00 ATOM 501 C VAL 70 15.753 10.883 111.052 1.00 0.00 ATOM 502 N ALA 71 15.023 11.089 112.143 1.00 0.00 ATOM 503 CA ALA 71 14.605 12.422 112.550 1.00 0.00 ATOM 504 CB ALA 71 13.776 12.352 113.823 1.00 0.00 ATOM 505 O ALA 71 15.816 14.489 112.428 1.00 0.00 ATOM 506 C ALA 71 15.808 13.324 112.819 1.00 0.00 ATOM 507 N LYS 72 16.823 12.784 113.486 1.00 0.00 ATOM 508 CA LYS 72 18.011 13.567 113.802 1.00 0.00 ATOM 509 CB LYS 72 18.953 12.770 114.708 1.00 0.00 ATOM 510 CG LYS 72 18.435 12.573 116.122 1.00 0.00 ATOM 511 CD LYS 72 19.419 11.780 116.966 1.00 0.00 ATOM 512 CE LYS 72 18.885 11.553 118.371 1.00 0.00 ATOM 513 NZ LYS 72 19.829 10.756 119.202 1.00 0.00 ATOM 514 O LYS 72 19.217 15.080 112.384 1.00 0.00 ATOM 515 C LYS 72 18.775 13.941 112.536 1.00 0.00 ATOM 516 N MET 73 18.919 12.983 111.627 1.00 0.00 ATOM 517 CA MET 73 19.620 13.233 110.372 1.00 0.00 ATOM 518 CB MET 73 19.817 11.892 109.612 1.00 0.00 ATOM 519 CG MET 73 20.668 12.063 108.366 1.00 0.00 ATOM 520 SD MET 73 20.753 10.660 107.297 1.00 0.00 ATOM 521 CE MET 73 21.424 9.524 108.297 1.00 0.00 ATOM 522 O MET 73 19.557 15.225 109.037 1.00 0.00 ATOM 523 C MET 73 18.914 14.315 109.561 1.00 0.00 ATOM 524 N ILE 74 17.590 14.234 109.492 1.00 0.00 ATOM 525 CA ILE 74 16.807 15.209 108.742 1.00 0.00 ATOM 526 CB ILE 74 15.365 14.637 108.473 1.00 0.00 ATOM 527 CG1 ILE 74 15.409 13.437 107.527 1.00 0.00 ATOM 528 CG2 ILE 74 14.415 15.748 108.036 1.00 0.00 ATOM 529 CD1 ILE 74 14.134 12.593 107.489 1.00 0.00 ATOM 530 O ILE 74 16.840 17.610 108.779 1.00 0.00 ATOM 531 C ILE 74 16.786 16.569 109.432 1.00 0.00 ATOM 532 N GLN 75 16.748 16.554 110.758 1.00 0.00 ATOM 533 CA GLN 75 16.718 17.787 111.536 1.00 0.00 ATOM 534 CB GLN 75 16.539 17.479 113.023 1.00 0.00 ATOM 535 CG GLN 75 16.334 18.709 113.894 1.00 0.00 ATOM 536 CD GLN 75 15.077 19.475 113.532 1.00 0.00 ATOM 537 OE1 GLN 75 14.019 18.884 113.319 1.00 0.00 ATOM 538 NE2 GLN 75 15.191 20.796 113.463 1.00 0.00 ATOM 539 O GLN 75 17.976 19.829 111.457 1.00 0.00 ATOM 540 C GLN 75 18.006 18.602 111.402 1.00 0.00 ATOM 541 N GLU 76 19.129 17.919 111.214 1.00 0.00 ATOM 542 CA GLU 76 20.425 18.590 111.110 1.00 0.00 ATOM 543 CB GLU 76 21.545 17.687 111.630 1.00 0.00 ATOM 544 CG GLU 76 21.443 17.358 113.110 1.00 0.00 ATOM 545 CD GLU 76 22.581 16.480 113.594 1.00 0.00 ATOM 546 OE1 GLU 76 23.448 16.126 112.768 1.00 0.00 ATOM 547 OE2 GLU 76 22.605 16.149 114.796 1.00 0.00 ATOM 548 O GLU 76 22.008 19.279 109.442 1.00 0.00 ATOM 549 C GLU 76 20.831 19.018 109.699 1.00 0.00 ATOM 550 N VAL 77 19.880 19.045 108.774 1.00 0.00 ATOM 551 CA VAL 77 20.187 19.448 107.404 1.00 0.00 ATOM 552 CB VAL 77 19.316 18.687 106.395 1.00 0.00 ATOM 553 CG1 VAL 77 19.561 17.170 106.522 1.00 0.00 ATOM 554 CG2 VAL 77 17.846 19.024 106.625 1.00 0.00 ATOM 555 O VAL 77 19.251 21.633 107.826 1.00 0.00 ATOM 556 C VAL 77 20.049 20.973 107.161 1.00 0.00 ATOM 557 N LYS 78 20.784 21.427 106.204 1.00 0.00 ATOM 558 CA LYS 78 20.850 22.875 105.925 1.00 0.00 ATOM 559 CB LYS 78 22.235 23.316 105.451 1.00 0.00 ATOM 560 CG LYS 78 23.301 23.288 106.535 1.00 0.00 ATOM 561 CD LYS 78 24.661 23.682 105.983 1.00 0.00 ATOM 562 CE LYS 78 25.714 23.711 107.077 1.00 0.00 ATOM 563 NZ LYS 78 27.067 24.018 106.539 1.00 0.00 ATOM 564 O LYS 78 18.797 22.628 104.717 1.00 0.00 ATOM 565 C LYS 78 19.862 23.238 104.831 1.00 0.00 ATOM 566 N GLY 79 20.228 24.269 103.970 1.00 0.00 ATOM 567 CA GLY 79 19.366 24.705 102.879 1.00 0.00 ATOM 568 O GLY 79 18.296 23.473 101.122 1.00 0.00 ATOM 569 C GLY 79 19.340 23.711 101.729 1.00 0.00 ATOM 570 N GLU 80 20.502 23.141 101.437 1.00 0.00 ATOM 571 CA GLU 80 20.663 22.194 100.346 1.00 0.00 ATOM 572 CB GLU 80 21.994 22.432 99.628 1.00 0.00 ATOM 573 CG GLU 80 22.237 21.508 98.447 1.00 0.00 ATOM 574 CD GLU 80 23.516 21.837 97.704 1.00 0.00 ATOM 575 OE1 GLU 80 24.222 22.779 98.123 1.00 0.00 ATOM 576 OE2 GLU 80 23.813 21.154 96.702 1.00 0.00 ATOM 577 O GLU 80 21.621 20.302 101.474 1.00 0.00 ATOM 578 C GLU 80 20.649 20.763 100.874 1.00 0.00 ATOM 579 N VAL 81 19.551 20.057 100.622 1.00 0.00 ATOM 580 CA VAL 81 19.397 18.685 101.095 1.00 0.00 ATOM 581 CB VAL 81 18.132 18.533 101.959 1.00 0.00 ATOM 582 CG1 VAL 81 17.974 17.093 102.424 1.00 0.00 ATOM 583 CG2 VAL 81 18.213 19.427 103.187 1.00 0.00 ATOM 584 O VAL 81 18.319 17.813 99.164 1.00 0.00 ATOM 585 C VAL 81 19.284 17.736 99.919 1.00 0.00 ATOM 586 N THR 82 20.210 16.787 99.834 1.00 0.00 ATOM 587 CA THR 82 20.225 15.811 98.756 1.00 0.00 ATOM 588 CB THR 82 21.638 15.602 98.179 1.00 0.00 ATOM 589 CG2 THR 82 21.620 14.526 97.102 1.00 0.00 ATOM 590 OG1 THR 82 22.109 16.827 97.603 1.00 0.00 ATOM 591 O THR 82 20.304 13.961 100.283 1.00 0.00 ATOM 592 C THR 82 19.730 14.490 99.336 1.00 0.00 ATOM 593 N ILE 83 18.626 13.987 98.802 1.00 0.00 ATOM 594 CA ILE 83 18.057 12.742 99.292 1.00 0.00 ATOM 595 CB ILE 83 16.575 12.901 99.676 1.00 0.00 ATOM 596 CG1 ILE 83 16.422 13.915 100.811 1.00 0.00 ATOM 597 CG2 ILE 83 15.999 11.571 100.138 1.00 0.00 ATOM 598 CD1 ILE 83 14.990 14.310 101.089 1.00 0.00 ATOM 599 O ILE 83 17.839 11.859 97.085 1.00 0.00 ATOM 600 C ILE 83 18.127 11.632 98.261 1.00 0.00 ATOM 601 N HIS 84 18.493 10.445 98.707 1.00 0.00 ATOM 602 CA HIS 84 18.355 9.240 97.890 1.00 0.00 ATOM 603 CB HIS 84 19.650 8.443 98.067 1.00 0.00 ATOM 604 CG HIS 84 20.882 9.198 97.675 1.00 0.00 ATOM 605 CD2 HIS 84 21.894 9.972 98.379 1.00 0.00 ATOM 606 ND1 HIS 84 21.316 9.287 96.370 1.00 0.00 ATOM 607 CE1 HIS 84 22.440 10.025 96.332 1.00 0.00 ATOM 608 NE2 HIS 84 22.793 10.439 97.534 1.00 0.00 ATOM 609 O HIS 84 16.965 8.449 99.669 1.00 0.00 ATOM 610 C HIS 84 17.108 8.598 98.444 1.00 0.00 ATOM 611 N TYR 85 16.191 8.237 97.552 1.00 0.00 ATOM 612 CA TYR 85 14.910 7.655 97.895 1.00 0.00 ATOM 613 CB TYR 85 13.753 8.655 97.853 1.00 0.00 ATOM 614 CG TYR 85 13.457 9.192 96.470 1.00 0.00 ATOM 615 CD1 TYR 85 12.500 8.591 95.664 1.00 0.00 ATOM 616 CD2 TYR 85 14.135 10.299 95.978 1.00 0.00 ATOM 617 CE1 TYR 85 12.222 9.074 94.400 1.00 0.00 ATOM 618 CE2 TYR 85 13.871 10.796 94.715 1.00 0.00 ATOM 619 CZ TYR 85 12.905 10.173 93.926 1.00 0.00 ATOM 620 OH TYR 85 12.630 10.656 92.668 1.00 0.00 ATOM 621 O TYR 85 15.150 6.398 95.882 1.00 0.00 ATOM 622 C TYR 85 14.549 6.542 96.943 1.00 0.00 ATOM 623 N ASN 86 13.598 5.701 97.346 1.00 0.00 ATOM 624 CA ASN 86 13.156 4.596 96.512 1.00 0.00 ATOM 625 CB ASN 86 13.022 3.339 97.375 1.00 0.00 ATOM 626 CG ASN 86 14.353 2.871 97.931 1.00 0.00 ATOM 627 ND2 ASN 86 14.330 2.334 99.146 1.00 0.00 ATOM 628 OD1 ASN 86 15.388 2.989 97.274 1.00 0.00 ATOM 629 O ASN 86 10.862 5.319 96.629 1.00 0.00 ATOM 630 C ASN 86 11.803 4.966 95.908 1.00 0.00 ATOM 631 N LYS 87 11.705 4.873 94.589 1.00 0.00 ATOM 632 CA LYS 87 10.465 5.204 93.913 1.00 0.00 ATOM 633 CB LYS 87 10.695 5.329 92.406 1.00 0.00 ATOM 634 CG LYS 87 11.571 6.505 92.008 1.00 0.00 ATOM 635 CD LYS 87 11.748 6.574 90.500 1.00 0.00 ATOM 636 CE LYS 87 12.580 7.782 90.097 1.00 0.00 ATOM 637 NZ LYS 87 12.723 7.889 88.618 1.00 0.00 ATOM 638 O LYS 87 9.634 3.065 94.597 1.00 0.00 ATOM 639 C LYS 87 9.381 4.158 94.089 1.00 0.00 ATOM 640 N LEU 88 8.153 4.462 93.673 1.00 0.00 ATOM 641 CA LEU 88 7.001 3.576 93.771 1.00 0.00 ATOM 642 CB LEU 88 5.858 4.274 94.497 1.00 0.00 ATOM 643 CG LEU 88 6.209 4.600 95.954 1.00 0.00 ATOM 644 CD1 LEU 88 5.035 5.285 96.640 1.00 0.00 ATOM 645 CD2 LEU 88 6.577 3.319 96.690 1.00 0.00 ATOM 646 O LEU 88 6.340 4.248 91.573 1.00 0.00 ATOM 647 C LEU 88 6.523 3.303 92.349 1.00 0.00 ATOM 648 N GLN 89 6.374 1.994 92.044 1.00 0.00 ATOM 649 CA GLN 89 6.111 1.650 90.649 1.00 0.00 ATOM 650 CB GLN 89 6.075 0.130 90.471 1.00 0.00 ATOM 651 CG GLN 89 5.928 -0.323 89.029 1.00 0.00 ATOM 652 CD GLN 89 7.110 0.078 88.168 1.00 0.00 ATOM 653 OE1 GLN 89 8.264 -0.090 88.563 1.00 0.00 ATOM 654 NE2 GLN 89 6.824 0.615 86.987 1.00 0.00 ATOM 655 O GLN 89 4.638 2.722 89.087 1.00 0.00 ATOM 656 C GLN 89 4.766 2.226 90.205 1.00 0.00 ATOM 657 N TYR 90 3.778 2.187 91.097 1.00 0.00 ATOM 658 CA TYR 90 2.452 2.724 90.794 1.00 0.00 ATOM 659 CB TYR 90 1.759 2.870 92.348 1.00 0.00 ATOM 660 CG TYR 90 1.903 1.755 93.358 1.00 0.00 ATOM 661 CD1 TYR 90 2.872 1.818 94.365 1.00 0.00 ATOM 662 CD2 TYR 90 1.068 0.639 93.307 1.00 0.00 ATOM 663 CE1 TYR 90 3.003 0.782 95.296 1.00 0.00 ATOM 664 CE2 TYR 90 1.185 -0.385 94.229 1.00 0.00 ATOM 665 CZ TYR 90 2.152 -0.312 95.215 1.00 0.00 ATOM 666 OH TYR 90 2.257 -1.354 96.118 1.00 0.00 ATOM 667 O TYR 90 1.654 4.672 89.641 1.00 0.00 ATOM 668 C TYR 90 2.437 4.199 90.475 1.00 0.00 ATOM 669 N TYR 91 3.252 4.937 91.205 1.00 0.00 ATOM 670 CA TYR 91 3.347 6.380 91.050 1.00 0.00 ATOM 671 CB TYR 91 3.814 7.031 92.354 1.00 0.00 ATOM 672 CG TYR 91 2.776 7.013 93.453 1.00 0.00 ATOM 673 CD1 TYR 91 2.853 6.091 94.489 1.00 0.00 ATOM 674 CD2 TYR 91 1.722 7.916 93.451 1.00 0.00 ATOM 675 CE1 TYR 91 1.909 6.066 95.498 1.00 0.00 ATOM 676 CE2 TYR 91 0.769 7.907 94.451 1.00 0.00 ATOM 677 CZ TYR 91 0.869 6.971 95.480 1.00 0.00 ATOM 678 OH TYR 91 -0.072 6.950 96.482 1.00 0.00 ATOM 679 O TYR 91 4.368 7.979 89.577 1.00 0.00 ATOM 680 C TYR 91 4.371 6.813 89.998 1.00 0.00 ATOM 681 N LYS 92 5.170 5.851 89.554 1.00 0.00 ATOM 682 CA LYS 92 6.216 6.121 88.555 1.00 0.00 ATOM 683 CB LYS 92 5.360 6.172 87.110 1.00 0.00 ATOM 684 CG LYS 92 4.046 5.398 87.049 1.00 0.00 ATOM 685 CD LYS 92 3.214 5.698 85.834 1.00 0.00 ATOM 686 CE LYS 92 1.981 4.816 85.704 1.00 0.00 ATOM 687 NZ LYS 92 0.972 5.165 86.773 1.00 0.00 ATOM 688 O LYS 92 7.739 7.921 88.101 1.00 0.00 ATOM 689 C LYS 92 7.104 7.299 88.953 1.00 0.00 ATOM 690 N VAL 93 7.149 7.605 90.240 1.00 0.00 ATOM 691 CA VAL 93 7.967 8.720 90.751 1.00 0.00 ATOM 692 CB VAL 93 7.094 9.911 91.184 1.00 0.00 ATOM 693 CG1 VAL 93 6.501 10.606 89.967 1.00 0.00 ATOM 694 CG2 VAL 93 5.951 9.440 92.070 1.00 0.00 ATOM 695 O VAL 93 8.286 8.387 93.087 1.00 0.00 ATOM 696 C VAL 93 8.778 8.289 91.950 1.00 0.00 TER END