PFRMAT TS TARGET T0415 AUTHOR 4008-1775-0004 METHOD The SAM-T06 hand predictions use methods similar to SAM_T04 in CASP6 and METHOD the SAM-T02 method in CASP5. METHOD METHOD We start with a fully automated method (implemented as the SAM_T06 server): METHOD METHOD Use the SAM-T2K and SAM-T04 methods for finding homologs of the METHOD target and aligning them. The hand method also uses the METHOD experimental new SAM-T06 alignment method, which we hope is both METHOD more sensitive and lass prone to contamination by unrelated sequences. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignments. METHOD METHOD We currently use 10 local-structure alphabets: METHOD DSSP METHOD STRIDE METHOD STR2 an extended version of DSSP that splits the beta strands METHOD into multiple classes (parallel/antiparallel/mixed, METHOD edge/center) METHOD ALPHA an discretization of the alpha torsion angle: METHOD CA(i-i), CA(i), CA(i+1), CA(i+2) METHOD BYS a discretization of Ramachandran plots, due to Bystroff METHOD CB_burial_14_7 a 7-state discretization of the number of C_beta METHOD atoms in a 14 Angstrom radius sphere around the C_beta. METHOD near-backbone-11 an 11-state discretization of the number of METHOD residues (represented by near-backbone points) in a METHOD 9.65 Angstrom radius sphere around the sidechain proxy METHOD spot for the residue. METHOD DSSP_EHL2 CASP's collapse of the DSSP alphabet METHOD DSSP_EHL2 is not predicted directly by a METHOD neural net, but is computed as a weighted METHOD average of the other backbone alphabet predictions. METHOD O_NOTOR2 an alphabet for predicting characteristics of hydrogen METHOD bonds from the carbonyl oxygen METHOD N_NOTOR2 an alphabet for predicting characteristics of hydrogen METHOD bonds from the amide nitrogen METHOD We hope to add more networks for other alphabets over the summer. METHOD METHOD We make 2-track HMMs with each alphabet (1.0 amino acid + 0.3 METHOD local structure) and use them to score a template library of about METHOD 8000 (t06), 10000 (t04), or 15000 (t2k) templates. METHOD The template libraries are expanded weekly, but old template HMMs METHOD are not rebuilt. METHOD METHOD We also used a single-track HMM to score not just the template METHOD library, but a non-redundant copy of the entire PDB. METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence. METHOD METHOD All the logs of e-values were combined in a weighted average (with METHOD rather arbitrary weights, since we still have not taken the time METHOD to optimize them), and the best templates ranked. METHOD METHOD Alignments of the target to the top templates were made using METHOD several different alignment methods (mainly using the SAM hmmscore METHOD program, but a few alignments were made with Bob Edgar's MUSCLE METHOD profile-profile aligner). METHOD METHOD Generate fragments (short 9-residue alignments for each position) METHOD using SAM's "fragfinder" program and the 3-track HMM which tested METHOD best for alignment. METHOD METHOD Residue-residue contact predictions are made using mutual METHOD information, pairwise contact potentials, joint entropy, and other METHOD signals combined by a neural net. The contact prediction method METHOD is expected to evolve over the summer, as new features are METHOD selected and new networks trained. METHOD METHOD Then the "undertaker" program (named because it optimizes burial) METHOD is used to try to combine the alignments and the fragments into a METHOD consistent 3D model. No single alignment or parent template was METHOD used as a frozen core, though in many cases one had much more METHOD influence than the others. The alignment scores were not passed METHOD to undertaker, but were used only to pick the set of alignments METHOD and fragments that undertaker would see. Helix and strand METHOD constraints generated from the secondary-structure predictions are METHOD passed to undertaker to use in the cost function, as are the METHOD residue-residue contact prediction. METHOD METHOD One important change in this server over previous methods is that METHOD sheet constraints are extracted from the top few alignments and METHOD passed to undertaker. METHOD METHOD After the automatic prediction is done, we examine it by hand and try METHOD to fix any flaws that we see. This generally involves rerunning METHOD undertaker with new cost functions, increasing the weights for METHOD features we want to see and decreasing the weights where we think the METHOD optimization has gone overboard. Sometimes we will add new templates METHOD or remove ones that we think are misleading the optimization process. METHOD METHOD New this year, we are also occasionally using ProteinShop to METHOD manipulate proteins by hand, to produce starting points for undertaker METHOD optimization. We expect this to be most useful in new-fold all-alpha METHOD proteins, where undertaker often gets trapped in poor local minima by METHOD extending helices too far. METHOD METHOD Another new trick is to optimize models with gromacs to knock them out METHOD of a local minimum. The gromacs optimization does terrible things to METHOD the model (messing up sidechains and peptide planes), but is good at METHOD removing clashes. The resulting models are only a small distance from METHOD the pre-optimization models, but score much worse with the undertaker METHOD cost functions, so undertaker can move them more freely than models it METHOD has optimized itself. METHOD METHOD METHOD Models from our methods or from metaserver results are nearly identical, METHOD there doesn't seem to be much to choose between them METHOD METHOD METHOD Model METHOD 1 try5-opt3 by undertaker METHOD 2 MQAU-opt3 undertaker optimization from metaserver, based on SAM-T08-server_TS1 METHOD 3 try4-opt3 earlier version of try4-opt3 METHOD 4 MQAC1-opt3 undertaker optimization from metaserver, based on MULTICOM-REFINE_TS3 METHOD 5 try3-opt3 METHOD REMARK 6 REMARK 6 T0415 model 2 Tue Jun 3 18:30:51 2008 MODEL 2 PARENT 3bs1_A REMARK 7 REMARK 7 ALLPARENTS 3bs1_A ATOM 1 N GLY 1 28.445 16.181 32.463 1.00 0.00 ATOM 2 CA GLY 1 29.498 15.165 32.743 1.00 0.00 ATOM 3 O GLY 1 29.638 15.826 35.045 1.00 0.00 ATOM 4 C GLY 1 30.243 15.430 34.047 1.00 0.00 ATOM 5 N LYS 2 31.553 15.212 34.038 1.00 0.00 ATOM 6 CA LYS 2 32.395 15.439 35.253 1.00 0.00 ATOM 7 CB LYS 2 33.960 15.077 34.577 1.00 0.00 ATOM 8 CG LYS 2 33.956 14.418 33.224 1.00 0.00 ATOM 9 CD LYS 2 33.647 12.953 33.343 1.00 0.00 ATOM 10 CE LYS 2 33.214 12.340 32.030 1.00 0.00 ATOM 11 NZ LYS 2 32.633 11.008 32.284 1.00 0.00 ATOM 12 O LYS 2 32.608 17.247 36.814 1.00 0.00 ATOM 13 C LYS 2 32.444 16.912 35.641 1.00 0.00 ATOM 14 N SER 3 32.276 17.791 34.657 1.00 0.00 ATOM 15 CA SER 3 32.301 19.230 34.913 1.00 0.00 ATOM 16 CB SER 3 32.447 19.979 33.586 1.00 0.00 ATOM 17 OG SER 3 33.660 19.637 32.939 1.00 0.00 ATOM 18 O SER 3 29.981 19.184 35.425 1.00 0.00 ATOM 19 C SER 3 31.101 19.603 35.720 1.00 0.00 ATOM 20 N VAL 4 31.328 20.361 36.789 1.00 0.00 ATOM 21 CA VAL 4 30.236 20.793 37.653 1.00 0.00 ATOM 22 CB VAL 4 30.263 19.946 39.032 1.00 0.00 ATOM 23 CG1 VAL 4 30.245 18.441 38.815 1.00 0.00 ATOM 24 CG2 VAL 4 31.470 20.350 39.826 1.00 0.00 ATOM 25 O VAL 4 30.995 23.067 37.890 1.00 0.00 ATOM 26 C VAL 4 30.059 22.264 37.999 1.00 0.00 ATOM 27 N VAL 5 28.856 22.591 38.449 1.00 0.00 ATOM 28 CA VAL 5 28.546 23.922 38.955 1.00 0.00 ATOM 29 CB VAL 5 27.272 24.498 38.277 1.00 0.00 ATOM 30 CG1 VAL 5 26.941 25.876 38.823 1.00 0.00 ATOM 31 CG2 VAL 5 27.443 24.531 36.764 1.00 0.00 ATOM 32 O VAL 5 27.436 22.936 40.839 1.00 0.00 ATOM 33 C VAL 5 28.164 23.841 40.428 1.00 0.00 ATOM 34 N THR 6 28.653 24.787 41.223 1.00 0.00 ATOM 35 CA THR 6 28.354 24.803 42.638 1.00 0.00 ATOM 36 CB THR 6 29.509 25.398 43.456 1.00 0.00 ATOM 37 CG2 THR 6 30.697 24.441 43.437 1.00 0.00 ATOM 38 OG1 THR 6 29.912 26.672 42.937 1.00 0.00 ATOM 39 O THR 6 27.228 26.918 42.524 1.00 0.00 ATOM 40 C THR 6 27.164 25.730 42.847 1.00 0.00 ATOM 41 N LEU 7 26.078 25.189 43.389 1.00 0.00 ATOM 42 CA LEU 7 24.881 25.984 43.638 1.00 0.00 ATOM 43 CB LEU 7 23.644 25.206 43.182 1.00 0.00 ATOM 44 CG LEU 7 23.573 24.862 41.692 1.00 0.00 ATOM 45 CD1 LEU 7 22.333 24.034 41.391 1.00 0.00 ATOM 46 CD2 LEU 7 23.512 26.129 40.852 1.00 0.00 ATOM 47 O LEU 7 24.759 25.259 45.921 1.00 0.00 ATOM 48 C LEU 7 24.834 26.211 45.144 1.00 0.00 ATOM 49 N LYS 8 24.901 27.473 45.556 1.00 0.00 ATOM 50 CA LYS 8 24.865 27.809 46.975 1.00 0.00 ATOM 51 CB LYS 8 25.582 29.132 47.203 1.00 0.00 ATOM 52 CG LYS 8 27.084 29.148 47.039 1.00 0.00 ATOM 53 CD LYS 8 27.659 30.495 47.464 1.00 0.00 ATOM 54 CE LYS 8 27.221 30.863 48.892 1.00 0.00 ATOM 55 NZ LYS 8 25.795 31.344 48.979 1.00 0.00 ATOM 56 O LYS 8 22.685 28.762 46.986 1.00 0.00 ATOM 57 C LYS 8 23.513 28.114 47.607 1.00 0.00 ATOM 58 N THR 9 23.346 27.757 48.874 1.00 0.00 ATOM 59 CA THR 9 22.192 28.239 49.634 1.00 0.00 ATOM 60 CB THR 9 21.114 27.148 49.772 1.00 0.00 ATOM 61 CG2 THR 9 19.906 27.684 50.525 1.00 0.00 ATOM 62 OG1 THR 9 20.695 26.718 48.470 1.00 0.00 ATOM 63 O THR 9 23.211 27.771 51.737 1.00 0.00 ATOM 64 C THR 9 22.735 28.629 50.994 1.00 0.00 ATOM 65 N THR 10 22.744 29.932 51.278 1.00 0.00 ATOM 66 CA THR 10 23.458 30.437 52.438 1.00 0.00 ATOM 67 CB THR 10 22.720 30.043 53.730 1.00 0.00 ATOM 68 CG2 THR 10 21.303 30.591 53.722 1.00 0.00 ATOM 69 OG1 THR 10 22.665 28.615 53.839 1.00 0.00 ATOM 70 O THR 10 25.566 29.928 51.412 1.00 0.00 ATOM 71 C THR 10 24.865 29.848 52.422 1.00 0.00 ATOM 72 N ASP 11 25.275 29.259 53.541 1.00 0.00 ATOM 73 CA ASP 11 26.603 28.662 53.637 1.00 0.00 ATOM 74 CB ASP 11 27.102 28.697 55.083 1.00 0.00 ATOM 75 CG ASP 11 26.254 27.848 56.011 1.00 0.00 ATOM 76 OD1 ASP 11 25.259 27.263 55.535 1.00 0.00 ATOM 77 OD2 ASP 11 26.585 27.770 57.212 1.00 0.00 ATOM 78 O ASP 11 27.828 26.749 52.870 1.00 0.00 ATOM 79 C ASP 11 26.722 27.247 53.082 1.00 0.00 ATOM 80 N GLY 12 25.585 26.637 52.763 1.00 0.00 ATOM 81 CA GLY 12 25.576 25.266 52.214 1.00 0.00 ATOM 82 O GLY 12 25.403 26.286 50.063 1.00 0.00 ATOM 83 C GLY 12 25.789 25.319 50.722 1.00 0.00 ATOM 84 N TRP 13 26.370 24.258 50.171 1.00 0.00 ATOM 85 CA TRP 13 26.624 24.195 48.736 1.00 0.00 ATOM 86 CB TRP 13 28.115 24.066 48.555 1.00 0.00 ATOM 87 CG TRP 13 28.839 25.338 48.922 1.00 0.00 ATOM 88 CD1 TRP 13 29.127 25.789 50.178 1.00 0.00 ATOM 89 CD2 TRP 13 29.361 26.315 48.016 1.00 0.00 ATOM 90 CE2 TRP 13 29.963 27.330 48.792 1.00 0.00 ATOM 91 CE3 TRP 13 29.384 26.429 46.623 1.00 0.00 ATOM 92 NE1 TRP 13 29.806 26.988 50.111 1.00 0.00 ATOM 93 CZ2 TRP 13 30.572 28.454 48.215 1.00 0.00 ATOM 94 CZ3 TRP 13 29.998 27.547 46.048 1.00 0.00 ATOM 95 CH2 TRP 13 30.586 28.538 46.843 1.00 0.00 ATOM 96 O TRP 13 26.213 21.850 48.965 1.00 0.00 ATOM 97 C TRP 13 26.145 22.844 48.243 1.00 0.00 ATOM 98 N ILE 14 25.683 22.811 46.999 1.00 0.00 ATOM 99 CA ILE 14 25.444 21.548 46.325 1.00 0.00 ATOM 100 CB ILE 14 23.939 21.292 46.124 1.00 0.00 ATOM 101 CG1 ILE 14 23.224 21.230 47.475 1.00 0.00 ATOM 102 CG2 ILE 14 23.716 19.972 45.399 1.00 0.00 ATOM 103 CD1 ILE 14 21.715 21.189 47.365 1.00 0.00 ATOM 104 O ILE 14 25.767 22.476 44.127 1.00 0.00 ATOM 105 C ILE 14 26.097 21.611 44.949 1.00 0.00 ATOM 106 N PRO 15 27.012 20.680 44.713 1.00 0.00 ATOM 107 CA PRO 15 27.689 20.578 43.438 1.00 0.00 ATOM 108 CB PRO 15 29.039 19.960 43.805 1.00 0.00 ATOM 109 CG PRO 15 28.743 19.087 44.979 1.00 0.00 ATOM 110 CD PRO 15 27.608 19.749 45.713 1.00 0.00 ATOM 111 O PRO 15 26.669 18.519 42.756 1.00 0.00 ATOM 112 C PRO 15 26.922 19.695 42.478 1.00 0.00 ATOM 113 N VAL 16 26.551 20.280 41.351 1.00 0.00 ATOM 114 CA VAL 16 25.725 19.606 40.363 1.00 0.00 ATOM 115 CB VAL 16 24.453 20.428 40.075 1.00 0.00 ATOM 116 CG1 VAL 16 23.601 19.740 39.020 1.00 0.00 ATOM 117 CG2 VAL 16 23.622 20.581 41.339 1.00 0.00 ATOM 118 O VAL 16 26.996 20.432 38.533 1.00 0.00 ATOM 119 C VAL 16 26.515 19.448 39.079 1.00 0.00 ATOM 120 N PRO 17 26.519 18.240 38.521 1.00 0.00 ATOM 121 CA PRO 17 27.153 18.029 37.221 1.00 0.00 ATOM 122 CB PRO 17 27.070 16.515 37.010 1.00 0.00 ATOM 123 CG PRO 17 26.910 15.956 38.382 1.00 0.00 ATOM 124 CD PRO 17 26.075 16.946 39.143 1.00 0.00 ATOM 125 O PRO 17 25.183 18.902 36.183 1.00 0.00 ATOM 126 C PRO 17 26.405 18.793 36.136 1.00 0.00 ATOM 127 N PHE 18 27.151 19.378 35.203 1.00 0.00 ATOM 128 CA PHE 18 26.550 20.196 34.142 1.00 0.00 ATOM 129 CB PHE 18 27.581 20.503 33.053 1.00 0.00 ATOM 130 CG PHE 18 28.640 21.478 33.480 1.00 0.00 ATOM 131 CD1 PHE 18 28.488 22.226 34.633 1.00 0.00 ATOM 132 CD2 PHE 18 29.791 21.646 32.729 1.00 0.00 ATOM 133 CE1 PHE 18 29.463 23.125 35.027 1.00 0.00 ATOM 134 CE2 PHE 18 30.766 22.543 33.120 1.00 0.00 ATOM 135 CZ PHE 18 30.606 23.280 34.264 1.00 0.00 ATOM 136 O PHE 18 24.282 20.025 33.285 1.00 0.00 ATOM 137 C PHE 18 25.385 19.452 33.457 1.00 0.00 ATOM 138 N SER 19 25.600 18.178 33.129 1.00 0.00 ATOM 139 CA SER 19 24.586 17.404 32.385 1.00 0.00 ATOM 140 CB SER 19 25.169 16.294 31.510 1.00 0.00 ATOM 141 OG SER 19 25.662 15.226 32.299 1.00 0.00 ATOM 142 O SER 19 22.541 16.183 32.676 1.00 0.00 ATOM 143 C SER 19 23.482 16.765 33.228 1.00 0.00 ATOM 144 N LYS 20 23.576 16.901 34.553 1.00 0.00 ATOM 145 CA LYS 20 22.431 16.647 35.438 1.00 0.00 ATOM 146 CB LYS 20 22.879 16.628 36.901 1.00 0.00 ATOM 147 CG LYS 20 23.824 15.489 37.246 1.00 0.00 ATOM 148 CD LYS 20 23.139 14.139 37.096 1.00 0.00 ATOM 149 CE LYS 20 24.051 13.007 37.538 1.00 0.00 ATOM 150 NZ LYS 20 23.415 11.675 37.345 1.00 0.00 ATOM 151 O LYS 20 20.243 17.603 35.626 1.00 0.00 ATOM 152 C LYS 20 21.403 17.762 35.254 1.00 0.00 ATOM 153 N VAL 21 21.849 18.906 34.727 1.00 0.00 ATOM 154 CA VAL 21 21.023 20.110 34.666 1.00 0.00 ATOM 155 CB VAL 21 21.851 21.384 34.919 1.00 0.00 ATOM 156 CG1 VAL 21 20.972 22.621 34.801 1.00 0.00 ATOM 157 CG2 VAL 21 22.459 21.359 36.312 1.00 0.00 ATOM 158 O VAL 21 21.043 20.646 32.341 1.00 0.00 ATOM 159 C VAL 21 20.363 20.295 33.305 1.00 0.00 ATOM 160 N MET 22 19.037 20.373 33.318 1.00 0.00 ATOM 161 CA MET 22 18.274 20.626 32.093 1.00 0.00 ATOM 162 CB MET 22 16.850 20.310 32.192 1.00 0.00 ATOM 163 CG MET 22 16.175 20.540 30.866 1.00 0.00 ATOM 164 SD MET 22 14.522 19.578 30.769 1.00 0.00 ATOM 165 CE MET 22 13.742 20.492 31.902 1.00 0.00 ATOM 166 O MET 22 18.652 22.480 30.617 1.00 0.00 ATOM 167 C MET 22 18.330 22.110 31.748 1.00 0.00 ATOM 168 N TYR 23 18.022 22.959 32.723 1.00 0.00 ATOM 169 CA TYR 23 18.045 24.405 32.507 1.00 0.00 ATOM 170 CB TYR 23 16.823 24.997 31.850 1.00 0.00 ATOM 171 CG TYR 23 15.469 24.898 32.497 1.00 0.00 ATOM 172 CD1 TYR 23 14.672 23.770 32.329 1.00 0.00 ATOM 173 CD2 TYR 23 14.962 25.932 33.279 1.00 0.00 ATOM 174 CE1 TYR 23 13.432 23.700 32.925 1.00 0.00 ATOM 175 CE2 TYR 23 13.716 25.862 33.884 1.00 0.00 ATOM 176 CZ TYR 23 12.948 24.730 33.701 1.00 0.00 ATOM 177 OH TYR 23 11.701 24.618 34.286 1.00 0.00 ATOM 178 O TYR 23 18.058 24.427 34.888 1.00 0.00 ATOM 179 C TYR 23 18.091 25.091 33.858 1.00 0.00 ATOM 180 N LEU 24 18.361 26.390 33.836 1.00 0.00 ATOM 181 CA LEU 24 18.277 27.234 35.019 1.00 0.00 ATOM 182 CB LEU 24 19.641 27.895 35.251 1.00 0.00 ATOM 183 CG LEU 24 19.713 28.790 36.495 1.00 0.00 ATOM 184 CD1 LEU 24 19.583 27.970 37.760 1.00 0.00 ATOM 185 CD2 LEU 24 21.012 29.604 36.500 1.00 0.00 ATOM 186 O LEU 24 17.540 29.037 33.643 1.00 0.00 ATOM 187 C LEU 24 17.372 28.410 34.679 1.00 0.00 ATOM 188 N GLU 25 16.409 28.693 35.548 1.00 0.00 ATOM 189 CA GLU 25 15.560 29.866 35.419 1.00 0.00 ATOM 190 CB GLU 25 14.083 29.474 35.303 1.00 0.00 ATOM 191 CG GLU 25 13.136 30.647 35.079 1.00 0.00 ATOM 192 CD GLU 25 11.720 30.200 34.748 1.00 0.00 ATOM 193 OE1 GLU 25 10.784 30.994 34.954 1.00 0.00 ATOM 194 OE2 GLU 25 11.543 29.058 34.280 1.00 0.00 ATOM 195 O GLU 25 15.745 30.266 37.777 1.00 0.00 ATOM 196 C GLU 25 15.817 30.744 36.649 1.00 0.00 ATOM 197 N ALA 26 16.219 31.994 36.400 1.00 0.00 ATOM 198 CA ALA 26 16.623 32.910 37.464 1.00 0.00 ATOM 199 CB ALA 26 17.679 33.907 36.995 1.00 0.00 ATOM 200 O ALA 26 14.937 34.563 37.191 1.00 0.00 ATOM 201 C ALA 26 15.479 33.767 37.961 1.00 0.00 ATOM 202 N LYS 27 15.305 33.844 39.285 1.00 0.00 ATOM 203 CA LYS 27 14.239 34.628 39.889 1.00 0.00 ATOM 204 CB LYS 27 13.236 33.531 40.396 1.00 0.00 ATOM 205 CG LYS 27 12.136 34.083 41.294 1.00 0.00 ATOM 206 CD LYS 27 11.083 33.030 41.627 1.00 0.00 ATOM 207 CE LYS 27 10.177 32.740 40.436 1.00 0.00 ATOM 208 NZ LYS 27 10.918 32.210 39.257 1.00 0.00 ATOM 209 O LYS 27 15.124 34.689 42.107 1.00 0.00 ATOM 210 C LYS 27 14.774 35.334 41.125 1.00 0.00 ATOM 211 N ASP 28 14.826 36.656 41.094 1.00 0.00 ATOM 212 CA ASP 28 15.419 37.382 42.197 1.00 0.00 ATOM 213 CB ASP 28 14.515 37.428 43.419 1.00 0.00 ATOM 214 CG ASP 28 13.175 37.968 43.116 1.00 0.00 ATOM 215 OD1 ASP 28 13.022 38.866 42.262 1.00 0.00 ATOM 216 OD2 ASP 28 12.177 37.456 43.701 1.00 0.00 ATOM 217 O ASP 28 17.584 36.689 41.438 1.00 0.00 ATOM 218 C ASP 28 16.837 36.889 42.391 1.00 0.00 ATOM 219 N LYS 29 17.332 37.228 43.692 1.00 0.00 ATOM 220 CA LYS 29 18.743 36.834 43.646 1.00 0.00 ATOM 221 CB LYS 29 19.506 37.401 44.885 1.00 0.00 ATOM 222 CG LYS 29 19.705 38.916 44.870 1.00 0.00 ATOM 223 CD LYS 29 18.436 39.676 44.984 1.00 0.00 ATOM 224 CE LYS 29 18.688 41.175 45.230 1.00 0.00 ATOM 225 NZ LYS 29 17.413 41.906 45.487 1.00 0.00 ATOM 226 O LYS 29 20.098 34.837 43.904 1.00 0.00 ATOM 227 C LYS 29 18.964 35.296 43.702 1.00 0.00 ATOM 228 N LYS 30 17.895 34.518 43.508 1.00 0.00 ATOM 229 CA LYS 30 18.043 33.074 43.532 1.00 0.00 ATOM 230 CB LYS 30 17.144 32.409 44.576 1.00 0.00 ATOM 231 CG LYS 30 17.527 32.721 46.014 1.00 0.00 ATOM 232 CD LYS 30 16.623 31.991 46.996 1.00 0.00 ATOM 233 CE LYS 30 17.034 32.270 48.434 1.00 0.00 ATOM 234 NZ LYS 30 16.188 31.525 49.406 1.00 0.00 ATOM 235 O LYS 30 17.129 33.211 41.318 1.00 0.00 ATOM 236 C LYS 30 17.732 32.524 42.144 1.00 0.00 ATOM 237 N THR 31 18.142 31.286 41.889 1.00 0.00 ATOM 238 CA THR 31 17.897 30.676 40.615 1.00 0.00 ATOM 239 CB THR 31 19.160 30.584 39.741 1.00 0.00 ATOM 240 CG2 THR 31 19.722 31.970 39.465 1.00 0.00 ATOM 241 OG1 THR 31 20.157 29.807 40.417 1.00 0.00 ATOM 242 O THR 31 17.749 28.715 41.957 1.00 0.00 ATOM 243 C THR 31 17.483 29.259 40.886 1.00 0.00 ATOM 244 N TYR 32 16.824 28.644 39.909 1.00 0.00 ATOM 245 CA TYR 32 16.372 27.264 40.054 1.00 0.00 ATOM 246 CB TYR 32 14.863 27.133 39.858 1.00 0.00 ATOM 247 CG TYR 32 14.036 27.969 40.814 1.00 0.00 ATOM 248 CD1 TYR 32 13.786 29.318 40.559 1.00 0.00 ATOM 249 CD2 TYR 32 13.511 27.414 41.979 1.00 0.00 ATOM 250 CE1 TYR 32 13.032 30.092 41.441 1.00 0.00 ATOM 251 CE2 TYR 32 12.755 28.178 42.866 1.00 0.00 ATOM 252 CZ TYR 32 12.519 29.516 42.592 1.00 0.00 ATOM 253 OH TYR 32 11.772 30.273 43.469 1.00 0.00 ATOM 254 O TYR 32 16.893 26.607 37.803 1.00 0.00 ATOM 255 C TYR 32 17.048 26.382 39.004 1.00 0.00 ATOM 256 N VAL 33 17.792 25.379 39.458 1.00 0.00 ATOM 257 CA VAL 33 18.479 24.473 38.545 1.00 0.00 ATOM 258 CB VAL 33 19.770 23.927 39.162 1.00 0.00 ATOM 259 CG1 VAL 33 20.292 22.769 38.328 1.00 0.00 ATOM 260 CG2 VAL 33 20.799 25.045 39.197 1.00 0.00 ATOM 261 O VAL 33 17.304 22.553 39.375 1.00 0.00 ATOM 262 C VAL 33 17.511 23.301 38.419 1.00 0.00 ATOM 263 N ASN 34 16.922 23.142 37.239 1.00 0.00 ATOM 264 CA ASN 34 15.979 22.053 37.004 1.00 0.00 ATOM 265 CB ASN 34 14.924 22.470 35.972 1.00 0.00 ATOM 266 CG ASN 34 13.920 21.356 35.686 1.00 0.00 ATOM 267 ND2 ASN 34 12.638 21.731 35.540 1.00 0.00 ATOM 268 OD1 ASN 34 14.287 20.190 35.549 1.00 0.00 ATOM 269 O ASN 34 17.333 20.902 35.389 1.00 0.00 ATOM 270 C ASN 34 16.806 20.871 36.501 1.00 0.00 ATOM 271 N ALA 35 16.918 19.830 37.321 1.00 0.00 ATOM 272 CA ALA 35 17.681 18.647 36.943 1.00 0.00 ATOM 273 CB ALA 35 18.267 18.101 38.237 1.00 0.00 ATOM 274 O ALA 35 15.628 17.937 35.914 1.00 0.00 ATOM 275 C ALA 35 16.763 17.622 36.272 1.00 0.00 ATOM 276 N GLU 36 17.258 16.400 36.106 1.00 0.00 ATOM 277 CA GLU 36 16.470 15.344 35.481 1.00 0.00 ATOM 278 CB GLU 36 17.190 14.004 35.647 1.00 0.00 ATOM 279 CG GLU 36 16.484 12.835 34.982 1.00 0.00 ATOM 280 CD GLU 36 17.290 11.552 35.050 1.00 0.00 ATOM 281 OE1 GLU 36 18.400 11.577 35.624 1.00 0.00 ATOM 282 OE2 GLU 36 16.812 10.522 34.531 1.00 0.00 ATOM 283 O GLU 36 14.059 15.232 35.556 1.00 0.00 ATOM 284 C GLU 36 15.110 15.165 36.196 1.00 0.00 ATOM 285 N GLU 37 15.144 14.943 37.505 1.00 0.00 ATOM 286 CA GLU 37 13.918 14.760 38.273 1.00 0.00 ATOM 287 CB GLU 37 13.818 13.265 38.591 1.00 0.00 ATOM 288 CG GLU 37 13.652 12.380 37.368 1.00 0.00 ATOM 289 CD GLU 37 13.570 10.908 37.720 1.00 0.00 ATOM 290 OE1 GLU 37 13.766 10.571 38.908 1.00 0.00 ATOM 291 OE2 GLU 37 13.309 10.094 36.812 1.00 0.00 ATOM 292 O GLU 37 13.194 15.128 40.528 1.00 0.00 ATOM 293 C GLU 37 13.892 15.524 39.587 1.00 0.00 ATOM 294 N LEU 38 14.663 16.605 39.665 1.00 0.00 ATOM 295 CA LEU 38 14.752 17.405 40.895 1.00 0.00 ATOM 296 CB LEU 38 15.937 16.931 41.739 1.00 0.00 ATOM 297 CG LEU 38 15.824 15.529 42.339 1.00 0.00 ATOM 298 CD1 LEU 38 17.153 15.092 42.938 1.00 0.00 ATOM 299 CD2 LEU 38 14.774 15.497 43.439 1.00 0.00 ATOM 300 O LEU 38 15.240 19.174 39.365 1.00 0.00 ATOM 301 C LEU 38 14.875 18.866 40.499 1.00 0.00 ATOM 302 N THR 39 14.595 19.758 41.444 1.00 0.00 ATOM 303 CA THR 39 14.881 21.175 41.267 1.00 0.00 ATOM 304 CB THR 39 13.603 21.993 41.233 1.00 0.00 ATOM 305 CG2 THR 39 13.884 23.483 41.135 1.00 0.00 ATOM 306 OG1 THR 39 12.891 21.667 40.032 1.00 0.00 ATOM 307 O THR 39 15.210 21.404 43.634 1.00 0.00 ATOM 308 C THR 39 15.606 21.697 42.504 1.00 0.00 ATOM 309 N GLY 40 16.666 22.468 42.289 1.00 0.00 ATOM 310 CA GLY 40 17.418 23.015 43.386 1.00 0.00 ATOM 311 O GLY 40 17.872 25.113 42.338 1.00 0.00 ATOM 312 C GLY 40 17.458 24.524 43.337 1.00 0.00 ATOM 313 N THR 41 17.028 25.161 44.421 1.00 0.00 ATOM 314 CA THR 41 17.022 26.618 44.490 1.00 0.00 ATOM 315 CB THR 41 15.773 27.141 45.260 1.00 0.00 ATOM 316 CG2 THR 41 15.582 28.654 45.083 1.00 0.00 ATOM 317 OG1 THR 41 14.605 26.458 44.796 1.00 0.00 ATOM 318 O THR 41 18.625 26.586 46.263 1.00 0.00 ATOM 319 C THR 41 18.278 27.085 45.191 1.00 0.00 ATOM 320 N HIS 42 18.966 28.049 44.588 1.00 0.00 ATOM 321 CA HIS 42 20.192 28.581 45.172 1.00 0.00 ATOM 322 CB HIS 42 21.344 27.750 44.603 1.00 0.00 ATOM 323 CG HIS 42 21.266 26.295 44.947 1.00 0.00 ATOM 324 CD2 HIS 42 20.873 25.081 44.245 1.00 0.00 ATOM 325 ND1 HIS 42 21.612 25.804 46.189 1.00 0.00 ATOM 326 CE1 HIS 42 21.438 24.469 46.196 1.00 0.00 ATOM 327 NE2 HIS 42 20.996 24.030 45.035 1.00 0.00 ATOM 328 O HIS 42 19.849 30.580 43.890 1.00 0.00 ATOM 329 C HIS 42 20.484 30.028 44.789 1.00 0.00 ATOM 330 N LYS 43 21.445 30.641 45.472 1.00 0.00 ATOM 331 CA LYS 43 21.803 32.016 45.191 1.00 0.00 ATOM 332 CB LYS 43 22.437 32.706 46.402 1.00 0.00 ATOM 333 CG LYS 43 22.868 34.139 46.145 1.00 0.00 ATOM 334 CD LYS 43 23.432 34.782 47.402 1.00 0.00 ATOM 335 CE LYS 43 23.862 36.216 47.144 1.00 0.00 ATOM 336 NZ LYS 43 24.419 36.857 48.367 1.00 0.00 ATOM 337 O LYS 43 23.919 31.436 44.232 1.00 0.00 ATOM 338 C LYS 43 22.852 32.035 44.094 1.00 0.00 ATOM 339 N TYR 44 22.550 32.726 42.998 1.00 0.00 ATOM 340 CA TYR 44 23.482 32.816 41.881 1.00 0.00 ATOM 341 CB TYR 44 23.205 31.918 40.886 1.00 0.00 ATOM 342 CG TYR 44 24.496 31.136 40.891 1.00 0.00 ATOM 343 CD1 TYR 44 25.697 31.733 40.519 1.00 0.00 ATOM 344 CD2 TYR 44 24.514 29.791 41.257 1.00 0.00 ATOM 345 CE1 TYR 44 26.888 31.012 40.510 1.00 0.00 ATOM 346 CE2 TYR 44 25.700 29.060 41.252 1.00 0.00 ATOM 347 CZ TYR 44 26.882 29.675 40.879 1.00 0.00 ATOM 348 OH TYR 44 28.058 28.958 40.881 1.00 0.00 ATOM 349 O TYR 44 21.830 34.278 40.962 1.00 0.00 ATOM 350 C TYR 44 22.929 33.732 40.818 1.00 0.00 ATOM 351 N SER 45 23.710 33.927 39.760 1.00 0.00 ATOM 352 CA SER 45 23.262 34.748 38.656 1.00 0.00 ATOM 353 CB SER 45 24.101 36.013 38.534 1.00 0.00 ATOM 354 OG SER 45 23.682 36.751 37.403 1.00 0.00 ATOM 355 O SER 45 24.317 33.201 37.176 1.00 0.00 ATOM 356 C SER 45 23.396 33.998 37.353 1.00 0.00 ATOM 357 N LEU 46 22.488 34.248 36.415 1.00 0.00 ATOM 358 CA LEU 46 22.514 33.583 35.119 1.00 0.00 ATOM 359 CB LEU 46 21.317 33.964 34.256 1.00 0.00 ATOM 360 CG LEU 46 20.008 33.304 34.721 1.00 0.00 ATOM 361 CD1 LEU 46 18.817 33.987 34.074 1.00 0.00 ATOM 362 CD2 LEU 46 20.011 31.835 34.330 1.00 0.00 ATOM 363 O LEU 46 24.452 33.053 33.809 1.00 0.00 ATOM 364 C LEU 46 23.790 33.933 34.361 1.00 0.00 ATOM 365 N GLN 47 24.153 35.240 34.358 1.00 0.00 ATOM 366 CA GLN 47 25.345 35.664 33.641 1.00 0.00 ATOM 367 CB GLN 47 25.714 37.033 34.592 1.00 0.00 ATOM 368 CG GLN 47 24.588 38.018 34.911 1.00 0.00 ATOM 369 CD GLN 47 25.120 39.128 35.786 1.00 0.00 ATOM 370 OE1 GLN 47 24.992 39.138 36.999 1.00 0.00 ATOM 371 NE2 GLN 47 25.757 40.100 35.103 1.00 0.00 ATOM 372 O GLN 47 27.244 34.329 33.032 1.00 0.00 ATOM 373 C GLN 47 26.567 34.805 33.946 1.00 0.00 ATOM 374 N GLU 48 26.848 34.604 35.229 1.00 0.00 ATOM 375 CA GLU 48 27.976 33.807 35.624 1.00 0.00 ATOM 376 CB GLU 48 28.136 33.917 37.167 1.00 0.00 ATOM 377 CG GLU 48 28.485 35.323 37.655 1.00 0.00 ATOM 378 CD GLU 48 28.654 35.430 39.146 1.00 0.00 ATOM 379 OE1 GLU 48 28.102 34.595 39.901 1.00 0.00 ATOM 380 OE2 GLU 48 29.334 36.386 39.608 1.00 0.00 ATOM 381 O GLU 48 28.834 31.801 34.584 1.00 0.00 ATOM 382 C GLU 48 27.859 32.382 35.098 1.00 0.00 ATOM 383 N PHE 49 26.662 31.773 35.236 1.00 0.00 ATOM 384 CA PHE 49 26.436 30.391 34.799 1.00 0.00 ATOM 385 CB PHE 49 25.013 29.957 35.198 1.00 0.00 ATOM 386 CG PHE 49 24.777 28.475 35.090 1.00 0.00 ATOM 387 CD1 PHE 49 25.658 27.571 35.680 1.00 0.00 ATOM 388 CD2 PHE 49 23.665 27.982 34.414 1.00 0.00 ATOM 389 CE1 PHE 49 25.435 26.191 35.601 1.00 0.00 ATOM 390 CE2 PHE 49 23.429 26.606 34.326 1.00 0.00 ATOM 391 CZ PHE 49 24.316 25.709 34.922 1.00 0.00 ATOM 392 O PHE 49 27.240 29.218 32.867 1.00 0.00 ATOM 393 C PHE 49 26.630 30.196 33.299 1.00 0.00 ATOM 394 N GLU 50 26.109 31.128 32.506 1.00 0.00 ATOM 395 CA GLU 50 26.233 31.051 31.015 1.00 0.00 ATOM 396 CB GLU 50 25.793 32.557 30.442 1.00 0.00 ATOM 397 CG GLU 50 24.674 33.330 31.093 1.00 0.00 ATOM 398 CD GLU 50 24.538 34.715 30.493 1.00 0.00 ATOM 399 OE1 GLU 50 25.569 35.411 30.364 1.00 0.00 ATOM 400 OE2 GLU 50 23.403 35.103 30.143 1.00 0.00 ATOM 401 O GLU 50 28.169 30.496 29.709 1.00 0.00 ATOM 402 C GLU 50 27.704 31.171 30.628 1.00 0.00 ATOM 403 N TYR 51 28.434 32.031 31.331 1.00 0.00 ATOM 404 CA TYR 51 29.847 32.222 31.049 1.00 0.00 ATOM 405 CB TYR 51 30.346 33.346 31.955 1.00 0.00 ATOM 406 CG TYR 51 31.841 33.401 32.035 1.00 0.00 ATOM 407 CD1 TYR 51 32.571 33.838 30.938 1.00 0.00 ATOM 408 CD2 TYR 51 32.503 33.058 33.204 1.00 0.00 ATOM 409 CE1 TYR 51 33.924 33.951 30.996 1.00 0.00 ATOM 410 CE2 TYR 51 33.919 33.179 33.272 1.00 0.00 ATOM 411 CZ TYR 51 34.579 33.632 32.152 1.00 0.00 ATOM 412 OH TYR 51 35.937 33.829 32.207 1.00 0.00 ATOM 413 O TYR 51 31.520 30.564 30.744 1.00 0.00 ATOM 414 C TYR 51 30.588 30.984 31.431 1.00 0.00 ATOM 415 N LEU 52 30.179 30.376 32.540 1.00 0.00 ATOM 416 CA LEU 52 30.823 29.156 33.014 1.00 0.00 ATOM 417 CB LEU 52 29.826 28.512 34.236 1.00 0.00 ATOM 418 CG LEU 52 30.341 27.602 35.366 1.00 0.00 ATOM 419 CD1 LEU 52 31.163 28.364 36.424 1.00 0.00 ATOM 420 CD2 LEU 52 29.180 26.864 36.015 1.00 0.00 ATOM 421 O LEU 52 31.462 27.133 31.905 1.00 0.00 ATOM 422 C LEU 52 30.583 27.976 32.091 1.00 0.00 ATOM 423 N LEU 53 29.389 27.912 31.509 1.00 0.00 ATOM 424 CA LEU 53 29.049 26.824 30.599 1.00 0.00 ATOM 425 CB LEU 53 27.538 26.708 30.473 1.00 0.00 ATOM 426 CG LEU 53 26.824 26.410 31.801 1.00 0.00 ATOM 427 CD1 LEU 53 25.319 26.478 31.576 1.00 0.00 ATOM 428 CD2 LEU 53 27.240 25.119 32.404 1.00 0.00 ATOM 429 O LEU 53 29.726 28.102 28.681 1.00 0.00 ATOM 430 C LEU 53 29.740 27.010 29.251 1.00 0.00 ATOM 431 N PRO 54 30.365 25.945 28.722 1.00 0.00 ATOM 432 CA PRO 54 31.054 26.037 27.426 1.00 0.00 ATOM 433 CB PRO 54 31.800 24.706 27.334 1.00 0.00 ATOM 434 CG PRO 54 32.009 24.315 28.769 1.00 0.00 ATOM 435 CD PRO 54 30.680 24.673 29.391 1.00 0.00 ATOM 436 O PRO 54 28.928 25.703 26.339 1.00 0.00 ATOM 437 C PRO 54 30.080 26.139 26.243 1.00 0.00 ATOM 438 N LYS 55 30.541 26.734 25.140 1.00 0.00 ATOM 439 CA LYS 55 29.720 26.907 23.947 1.00 0.00 ATOM 440 CB LYS 55 30.436 27.515 22.791 1.00 0.00 ATOM 441 CG LYS 55 31.660 26.742 22.257 1.00 0.00 ATOM 442 CD LYS 55 32.312 27.554 21.137 1.00 0.00 ATOM 443 CE LYS 55 33.338 26.749 20.321 1.00 0.00 ATOM 444 NZ LYS 55 34.068 27.729 19.441 1.00 0.00 ATOM 445 O LYS 55 28.041 25.455 22.982 1.00 0.00 ATOM 446 C LYS 55 29.200 25.554 23.385 1.00 0.00 ATOM 447 N ASP 56 30.059 24.539 23.367 1.00 0.00 ATOM 448 CA ASP 56 29.669 23.228 22.863 1.00 0.00 ATOM 449 CB ASP 56 30.849 22.307 22.768 1.00 0.00 ATOM 450 CG ASP 56 31.837 22.765 21.712 1.00 0.00 ATOM 451 OD1 ASP 56 31.409 23.415 20.732 1.00 0.00 ATOM 452 OD2 ASP 56 33.034 22.465 21.856 1.00 0.00 ATOM 453 O ASP 56 27.756 21.814 23.211 1.00 0.00 ATOM 454 C ASP 56 28.608 22.547 23.728 1.00 0.00 ATOM 455 N SER 57 28.696 22.749 25.044 1.00 0.00 ATOM 456 CA SER 57 27.816 22.064 25.996 1.00 0.00 ATOM 457 CB SER 57 28.477 21.883 27.342 1.00 0.00 ATOM 458 OG SER 57 29.591 21.009 27.240 1.00 0.00 ATOM 459 O SER 57 25.419 22.257 26.091 1.00 0.00 ATOM 460 C SER 57 26.508 22.823 26.217 1.00 0.00 ATOM 461 N PHE 58 26.623 24.119 26.545 1.00 0.00 ATOM 462 CA PHE 58 25.448 24.864 26.961 1.00 0.00 ATOM 463 CB PHE 58 25.446 25.083 28.492 1.00 0.00 ATOM 464 CG PHE 58 25.400 23.818 29.317 1.00 0.00 ATOM 465 CD1 PHE 58 24.212 23.407 29.919 1.00 0.00 ATOM 466 CD2 PHE 58 26.541 23.057 29.514 1.00 0.00 ATOM 467 CE1 PHE 58 24.145 22.223 30.707 1.00 0.00 ATOM 468 CE2 PHE 58 26.486 21.868 30.306 1.00 0.00 ATOM 469 CZ PHE 58 25.290 21.461 30.905 1.00 0.00 ATOM 470 O PHE 58 26.444 26.708 25.835 1.00 0.00 ATOM 471 C PHE 58 25.413 26.211 26.272 1.00 0.00 ATOM 472 N ILE 59 24.217 26.773 26.201 1.00 0.00 ATOM 473 CA ILE 59 24.014 28.075 25.591 1.00 0.00 ATOM 474 CB ILE 59 23.241 28.038 24.280 1.00 0.00 ATOM 475 CG1 ILE 59 23.997 27.181 23.235 1.00 0.00 ATOM 476 CG2 ILE 59 23.027 29.475 23.761 1.00 0.00 ATOM 477 CD1 ILE 59 23.258 27.054 21.844 1.00 0.00 ATOM 478 O ILE 59 22.136 28.509 27.014 1.00 0.00 ATOM 479 C ILE 59 23.173 28.941 26.525 1.00 0.00 ATOM 480 N ARG 60 23.540 30.213 26.628 1.00 0.00 ATOM 481 CA ARG 60 22.717 31.172 27.356 1.00 0.00 ATOM 482 CB ARG 60 23.687 32.036 28.221 1.00 0.00 ATOM 483 CG ARG 60 24.182 33.258 27.437 1.00 0.00 ATOM 484 CD ARG 60 25.094 32.931 26.269 1.00 0.00 ATOM 485 NE ARG 60 26.435 32.545 26.737 1.00 0.00 ATOM 486 CZ ARG 60 27.321 31.841 26.042 1.00 0.00 ATOM 487 NH1 ARG 60 26.991 31.303 24.880 1.00 0.00 ATOM 488 NH2 ARG 60 28.526 31.592 26.577 1.00 0.00 ATOM 489 O ARG 60 21.808 32.325 25.466 1.00 0.00 ATOM 490 C ARG 60 21.592 31.571 26.414 1.00 0.00 ATOM 491 N CYS 61 20.208 31.051 26.272 1.00 0.00 ATOM 492 CA CYS 61 19.315 31.288 25.170 1.00 0.00 ATOM 493 CB CYS 61 18.610 29.999 24.774 1.00 0.00 ATOM 494 SG CYS 61 19.734 28.638 24.345 1.00 0.00 ATOM 495 O CYS 61 17.460 32.700 24.600 1.00 0.00 ATOM 496 C CYS 61 18.237 32.338 25.471 1.00 0.00 ATOM 497 N HIS 62 18.233 33.018 26.522 1.00 0.00 ATOM 498 CA HIS 62 17.338 34.127 26.869 1.00 0.00 ATOM 499 CB HIS 62 15.937 33.569 27.128 1.00 0.00 ATOM 500 CG HIS 62 14.892 34.624 27.319 1.00 0.00 ATOM 501 CD2 HIS 62 14.180 35.186 28.456 1.00 0.00 ATOM 502 ND1 HIS 62 14.357 35.338 26.270 1.00 0.00 ATOM 503 CE1 HIS 62 13.449 36.206 26.749 1.00 0.00 ATOM 504 NE2 HIS 62 13.338 36.122 28.061 1.00 0.00 ATOM 505 O HIS 62 18.643 34.067 28.881 1.00 0.00 ATOM 506 C HIS 62 17.931 34.739 28.134 1.00 0.00 ATOM 507 N ARG 63 17.638 36.013 28.371 1.00 0.00 ATOM 508 CA ARG 63 18.144 36.682 29.533 1.00 0.00 ATOM 509 CB ARG 63 17.143 38.115 29.446 1.00 0.00 ATOM 510 CG ARG 63 16.667 38.579 28.074 1.00 0.00 ATOM 511 CD ARG 63 17.683 39.553 27.475 1.00 0.00 ATOM 512 NE ARG 63 17.057 39.978 26.232 1.00 0.00 ATOM 513 CZ ARG 63 17.008 39.202 25.167 1.00 0.00 ATOM 514 NH1 ARG 63 17.707 38.064 25.072 1.00 0.00 ATOM 515 NH2 ARG 63 16.335 39.678 24.124 1.00 0.00 ATOM 516 O ARG 63 18.495 36.056 31.824 1.00 0.00 ATOM 517 C ARG 63 17.782 35.948 30.825 1.00 0.00 ATOM 518 N SER 64 16.655 35.195 30.811 1.00 0.00 ATOM 519 CA SER 64 16.186 34.477 31.998 1.00 0.00 ATOM 520 CB SER 64 14.675 34.659 32.160 1.00 0.00 ATOM 521 OG SER 64 14.345 36.024 32.351 1.00 0.00 ATOM 522 O SER 64 16.136 32.313 32.997 1.00 0.00 ATOM 523 C SER 64 16.447 32.969 32.002 1.00 0.00 ATOM 524 N PHE 65 17.064 32.431 30.940 1.00 0.00 ATOM 525 CA PHE 65 17.240 30.974 30.812 1.00 0.00 ATOM 526 CB PHE 65 16.206 30.406 29.836 1.00 0.00 ATOM 527 CG PHE 65 14.783 30.615 30.272 1.00 0.00 ATOM 528 CD1 PHE 65 14.070 31.724 29.851 1.00 0.00 ATOM 529 CD2 PHE 65 14.159 29.701 31.102 1.00 0.00 ATOM 530 CE1 PHE 65 12.763 31.916 30.253 1.00 0.00 ATOM 531 CE2 PHE 65 12.849 29.892 31.504 1.00 0.00 ATOM 532 CZ PHE 65 12.153 30.996 31.083 1.00 0.00 ATOM 533 O PHE 65 19.085 31.082 29.297 1.00 0.00 ATOM 534 C PHE 65 18.589 30.523 30.268 1.00 0.00 ATOM 535 N ILE 66 19.155 29.488 30.885 1.00 0.00 ATOM 536 CA ILE 66 20.354 28.813 30.367 1.00 0.00 ATOM 537 CB ILE 66 21.464 28.876 31.384 1.00 0.00 ATOM 538 CG1 ILE 66 21.950 30.334 31.516 1.00 0.00 ATOM 539 CG2 ILE 66 22.597 27.978 30.950 1.00 0.00 ATOM 540 CD1 ILE 66 22.848 30.602 32.680 1.00 0.00 ATOM 541 O ILE 66 19.267 26.753 30.981 1.00 0.00 ATOM 542 C ILE 66 19.897 27.394 30.120 1.00 0.00 ATOM 543 N VAL 67 20.112 26.899 28.863 1.00 0.00 ATOM 544 CA VAL 67 19.652 25.586 28.480 1.00 0.00 ATOM 545 CB VAL 67 18.875 25.640 27.161 1.00 0.00 ATOM 546 CG1 VAL 67 18.624 24.233 26.591 1.00 0.00 ATOM 547 CG2 VAL 67 17.589 26.433 27.364 1.00 0.00 ATOM 548 O VAL 67 21.849 24.943 27.764 1.00 0.00 ATOM 549 C VAL 67 20.768 24.579 28.229 1.00 0.00 ATOM 550 N ASN 68 20.507 23.312 28.536 1.00 0.00 ATOM 551 CA ASN 68 21.483 22.296 28.337 1.00 0.00 ATOM 552 CB ASN 68 21.290 21.146 29.328 1.00 0.00 ATOM 553 CG ASN 68 22.361 20.082 29.202 1.00 0.00 ATOM 554 ND2 ASN 68 22.548 19.301 30.261 1.00 0.00 ATOM 555 OD1 ASN 68 23.014 19.965 28.165 1.00 0.00 ATOM 556 O ASN 68 20.469 20.993 26.597 1.00 0.00 ATOM 557 C ASN 68 21.365 21.778 26.908 1.00 0.00 ATOM 558 N VAL 69 22.271 22.218 26.039 1.00 0.00 ATOM 559 CA VAL 69 22.254 21.787 24.649 1.00 0.00 ATOM 560 CB VAL 69 23.384 22.506 23.798 1.00 0.00 ATOM 561 CG1 VAL 69 23.382 22.029 22.351 1.00 0.00 ATOM 562 CG2 VAL 69 23.211 24.016 23.840 1.00 0.00 ATOM 563 O VAL 69 21.614 19.735 23.532 1.00 0.00 ATOM 564 C VAL 69 22.215 20.241 24.481 1.00 0.00 ATOM 565 N ASN 70 22.850 19.519 25.399 1.00 0.00 ATOM 566 CA ASN 70 22.871 18.062 25.334 1.00 0.00 ATOM 567 CB ASN 70 23.748 17.493 26.451 1.00 0.00 ATOM 568 CG ASN 70 25.226 17.728 26.206 1.00 0.00 ATOM 569 ND2 ASN 70 26.020 17.648 27.270 1.00 0.00 ATOM 570 OD1 ASN 70 25.646 17.979 25.077 1.00 0.00 ATOM 571 O ASN 70 21.261 16.296 25.010 1.00 0.00 ATOM 572 C ASN 70 21.495 17.428 25.470 1.00 0.00 ATOM 573 N HIS 71 20.603 18.164 26.100 1.00 0.00 ATOM 574 CA HIS 71 19.254 17.639 26.248 1.00 0.00 ATOM 575 CB HIS 71 18.829 17.685 27.734 1.00 0.00 ATOM 576 CG HIS 71 19.596 16.757 28.625 1.00 0.00 ATOM 577 CD2 HIS 71 19.361 15.474 28.988 1.00 0.00 ATOM 578 ND1 HIS 71 20.763 17.126 29.257 1.00 0.00 ATOM 579 CE1 HIS 71 21.213 16.110 29.975 1.00 0.00 ATOM 580 NE2 HIS 71 20.380 15.096 29.828 1.00 0.00 ATOM 581 O HIS 71 17.073 17.835 25.276 1.00 0.00 ATOM 582 C HIS 71 18.255 18.188 25.234 1.00 0.00 ATOM 583 N ILE 72 18.716 19.055 24.364 1.00 0.00 ATOM 584 CA ILE 72 17.832 19.651 23.370 1.00 0.00 ATOM 585 CB ILE 72 18.441 20.863 22.607 1.00 0.00 ATOM 586 CG1 ILE 72 18.957 21.925 23.584 1.00 0.00 ATOM 587 CG2 ILE 72 17.397 21.465 21.652 1.00 0.00 ATOM 588 CD1 ILE 72 19.720 23.070 22.916 1.00 0.00 ATOM 589 O ILE 72 18.159 17.950 21.710 1.00 0.00 ATOM 590 C ILE 72 17.352 18.592 22.383 1.00 0.00 ATOM 591 N LYS 73 16.037 18.411 22.299 1.00 0.00 ATOM 592 CA LYS 73 15.458 17.418 21.379 1.00 0.00 ATOM 593 CB LYS 73 14.294 16.726 22.092 1.00 0.00 ATOM 594 CG LYS 73 13.668 15.591 21.298 1.00 0.00 ATOM 595 CD LYS 73 12.509 14.964 22.055 1.00 0.00 ATOM 596 CE LYS 73 11.906 13.803 21.279 1.00 0.00 ATOM 597 NZ LYS 73 10.763 13.186 22.004 1.00 0.00 ATOM 598 O LYS 73 15.142 17.493 18.996 1.00 0.00 ATOM 599 C LYS 73 14.945 18.047 20.079 1.00 0.00 ATOM 600 N ALA 74 14.290 19.198 20.191 1.00 0.00 ATOM 601 CA ALA 74 13.760 19.884 19.017 1.00 0.00 ATOM 602 CB ALA 74 12.385 19.375 18.614 1.00 0.00 ATOM 603 O ALA 74 13.836 21.739 20.542 1.00 0.00 ATOM 604 C ALA 74 13.685 21.366 19.378 1.00 0.00 ATOM 605 N ILE 75 13.485 22.208 18.396 1.00 0.00 ATOM 606 CA ILE 75 13.208 23.645 18.546 1.00 0.00 ATOM 607 CB ILE 75 14.464 24.511 18.180 1.00 0.00 ATOM 608 CG1 ILE 75 14.170 26.002 18.392 1.00 0.00 ATOM 609 CG2 ILE 75 14.988 24.247 16.758 1.00 0.00 ATOM 610 CD1 ILE 75 15.405 26.897 18.474 1.00 0.00 ATOM 611 O ILE 75 11.977 23.330 16.505 1.00 0.00 ATOM 612 C ILE 75 12.197 24.045 17.502 1.00 0.00 ATOM 613 N TYR 76 11.503 25.148 17.754 1.00 0.00 ATOM 614 CA TYR 76 10.418 25.512 16.890 1.00 0.00 ATOM 615 CB TYR 76 9.229 24.538 17.145 1.00 0.00 ATOM 616 CG TYR 76 8.089 24.563 16.162 1.00 0.00 ATOM 617 CD1 TYR 76 8.241 24.122 14.862 1.00 0.00 ATOM 618 CD2 TYR 76 6.841 25.041 16.551 1.00 0.00 ATOM 619 CE1 TYR 76 7.174 24.123 13.964 1.00 0.00 ATOM 620 CE2 TYR 76 5.784 25.052 15.673 1.00 0.00 ATOM 621 CZ TYR 76 5.952 24.612 14.389 1.00 0.00 ATOM 622 OH TYR 76 4.879 24.651 13.528 1.00 0.00 ATOM 623 O TYR 76 9.799 27.580 17.899 1.00 0.00 ATOM 624 C TYR 76 9.856 26.925 16.860 1.00 0.00 ATOM 625 N PRO 77 9.590 27.419 15.648 1.00 0.00 ATOM 626 CA PRO 77 8.879 28.691 15.480 1.00 0.00 ATOM 627 CB PRO 77 9.177 28.883 14.015 1.00 0.00 ATOM 628 CG PRO 77 9.751 27.626 13.428 1.00 0.00 ATOM 629 CD PRO 77 10.523 26.979 14.554 1.00 0.00 ATOM 630 O PRO 77 6.745 28.015 14.619 1.00 0.00 ATOM 631 C PRO 77 7.354 28.653 15.477 1.00 0.00 ATOM 632 N ASP 78 6.740 29.323 16.449 1.00 0.00 ATOM 633 CA ASP 78 5.284 29.358 16.541 1.00 0.00 ATOM 634 CB ASP 78 4.856 29.759 17.954 1.00 0.00 ATOM 635 CG ASP 78 5.028 28.636 18.957 1.00 0.00 ATOM 636 OD1 ASP 78 5.233 27.481 18.525 1.00 0.00 ATOM 637 OD2 ASP 78 4.959 28.910 20.173 1.00 0.00 ATOM 638 O ASP 78 5.477 31.133 14.918 1.00 0.00 ATOM 639 C ASP 78 4.727 30.396 15.538 1.00 0.00 ATOM 640 N THR 79 3.412 30.471 15.395 1.00 0.00 ATOM 641 CA THR 79 2.834 31.331 14.357 1.00 0.00 ATOM 642 CB THR 79 1.367 30.967 14.064 1.00 0.00 ATOM 643 CG2 THR 79 1.260 29.529 13.580 1.00 0.00 ATOM 644 OG1 THR 79 0.587 31.113 15.259 1.00 0.00 ATOM 645 O THR 79 2.488 33.658 13.882 1.00 0.00 ATOM 646 C THR 79 2.824 32.827 14.729 1.00 0.00 ATOM 647 N HIS 80 3.207 33.149 15.955 1.00 0.00 ATOM 648 CA HIS 80 3.493 34.528 16.389 1.00 0.00 ATOM 649 CB HIS 80 2.950 34.771 17.797 1.00 0.00 ATOM 650 CG HIS 80 1.458 34.673 17.895 1.00 0.00 ATOM 651 CD2 HIS 80 0.515 33.706 18.441 1.00 0.00 ATOM 652 ND1 HIS 80 0.614 35.644 17.404 1.00 0.00 ATOM 653 CE1 HIS 80 -0.658 35.277 17.639 1.00 0.00 ATOM 654 NE2 HIS 80 -0.725 34.116 18.261 1.00 0.00 ATOM 655 O HIS 80 5.447 35.826 16.977 1.00 0.00 ATOM 656 C HIS 80 5.006 34.823 16.396 1.00 0.00 ATOM 657 N SER 81 5.790 33.907 15.822 1.00 0.00 ATOM 658 CA SER 81 7.232 34.070 15.703 1.00 0.00 ATOM 659 CB SER 81 7.519 35.383 14.867 1.00 0.00 ATOM 660 OG SER 81 6.947 35.307 13.591 1.00 0.00 ATOM 661 O SER 81 9.285 33.836 16.922 1.00 0.00 ATOM 662 C SER 81 8.059 33.721 16.936 1.00 0.00 ATOM 663 N THR 82 7.395 33.230 17.977 1.00 0.00 ATOM 664 CA THR 82 8.086 32.857 19.215 1.00 0.00 ATOM 665 CB THR 82 7.097 32.368 20.282 1.00 0.00 ATOM 666 CG2 THR 82 7.815 31.805 21.484 1.00 0.00 ATOM 667 OG1 THR 82 6.246 33.426 20.696 1.00 0.00 ATOM 668 O THR 82 8.495 30.714 18.246 1.00 0.00 ATOM 669 C THR 82 8.929 31.636 18.937 1.00 0.00 ATOM 670 N PHE 83 10.179 31.667 19.390 1.00 0.00 ATOM 671 CA PHE 83 11.085 30.544 19.185 1.00 0.00 ATOM 672 CB PHE 83 12.450 31.055 18.720 1.00 0.00 ATOM 673 CG PHE 83 12.426 31.701 17.364 1.00 0.00 ATOM 674 CD1 PHE 83 12.190 33.058 17.230 1.00 0.00 ATOM 675 CD2 PHE 83 12.640 30.949 16.221 1.00 0.00 ATOM 676 CE1 PHE 83 12.167 33.651 15.982 1.00 0.00 ATOM 677 CE2 PHE 83 12.618 31.543 14.973 1.00 0.00 ATOM 678 CZ PHE 83 12.382 32.886 14.850 1.00 0.00 ATOM 679 O PHE 83 11.416 30.379 21.556 1.00 0.00 ATOM 680 C PHE 83 11.125 29.793 20.512 1.00 0.00 ATOM 681 N LEU 84 10.834 28.498 20.470 1.00 0.00 ATOM 682 CA LEU 84 10.843 27.666 21.692 1.00 0.00 ATOM 683 CB LEU 84 9.406 27.250 22.011 1.00 0.00 ATOM 684 CG LEU 84 8.430 28.382 22.340 1.00 0.00 ATOM 685 CD1 LEU 84 7.010 27.849 22.460 1.00 0.00 ATOM 686 CD2 LEU 84 8.802 29.046 23.658 1.00 0.00 ATOM 687 O LEU 84 11.777 25.784 20.516 1.00 0.00 ATOM 688 C LEU 84 11.719 26.408 21.577 1.00 0.00 ATOM 689 N LEU 85 12.393 26.048 22.665 1.00 0.00 ATOM 690 CA LEU 85 13.252 24.868 22.664 1.00 0.00 ATOM 691 CB LEU 85 14.590 25.094 23.371 1.00 0.00 ATOM 692 CG LEU 85 15.560 26.063 22.693 1.00 0.00 ATOM 693 CD1 LEU 85 16.811 26.252 23.538 1.00 0.00 ATOM 694 CD2 LEU 85 15.983 25.534 21.331 1.00 0.00 ATOM 695 O LEU 85 12.189 23.958 24.608 1.00 0.00 ATOM 696 C LEU 85 12.581 23.763 23.456 1.00 0.00 ATOM 697 N SER 86 12.436 22.690 22.785 1.00 0.00 ATOM 698 CA SER 86 11.805 21.556 23.451 1.00 0.00 ATOM 699 CB SER 86 10.868 20.842 22.471 1.00 0.00 ATOM 700 OG SER 86 10.329 19.694 23.103 1.00 0.00 ATOM 701 O SER 86 13.674 20.076 23.156 1.00 0.00 ATOM 702 C SER 86 12.863 20.563 23.947 1.00 0.00 ATOM 703 N MET 87 12.819 20.234 25.228 1.00 0.00 ATOM 704 CA MET 87 13.880 19.430 25.847 1.00 0.00 ATOM 705 CB MET 87 14.431 20.178 27.072 1.00 0.00 ATOM 706 CG MET 87 14.936 21.568 26.783 1.00 0.00 ATOM 707 SD MET 87 16.172 21.579 25.488 1.00 0.00 ATOM 708 CE MET 87 17.593 21.067 26.426 1.00 0.00 ATOM 709 O MET 87 12.271 17.743 26.343 1.00 0.00 ATOM 710 C MET 87 13.462 18.035 26.220 1.00 0.00 ATOM 711 N ASP 88 14.442 17.157 26.405 1.00 0.00 ATOM 712 CA ASP 88 14.159 15.775 26.772 1.00 0.00 ATOM 713 CB ASP 88 15.441 14.964 26.579 1.00 0.00 ATOM 714 CG ASP 88 15.833 14.832 25.120 1.00 0.00 ATOM 715 OD1 ASP 88 14.994 15.146 24.250 1.00 0.00 ATOM 716 OD2 ASP 88 16.979 14.416 24.848 1.00 0.00 ATOM 717 O ASP 88 13.510 14.403 28.621 1.00 0.00 ATOM 718 C ASP 88 13.705 15.540 28.222 1.00 0.00 ATOM 719 N ASN 89 13.647 16.589 29.019 1.00 0.00 ATOM 720 CA ASN 89 13.013 16.488 30.339 1.00 0.00 ATOM 721 CB ASN 89 14.223 16.544 31.394 1.00 0.00 ATOM 722 CG ASN 89 13.833 16.058 32.750 1.00 0.00 ATOM 723 ND2 ASN 89 13.723 14.729 32.913 1.00 0.00 ATOM 724 OD1 ASN 89 13.607 16.850 33.643 1.00 0.00 ATOM 725 O ASN 89 10.906 17.005 31.361 1.00 0.00 ATOM 726 C ASN 89 11.529 16.830 30.313 1.00 0.00 ATOM 727 N GLY 90 10.961 16.925 29.114 1.00 0.00 ATOM 728 CA GLY 90 9.502 17.254 28.953 1.00 0.00 ATOM 729 O GLY 90 8.001 19.079 29.363 1.00 0.00 ATOM 730 C GLY 90 9.169 18.717 29.216 1.00 0.00 ATOM 731 N GLU 91 10.197 19.559 29.275 1.00 0.00 ATOM 732 CA GLU 91 9.996 20.982 29.519 1.00 0.00 ATOM 733 CB GLU 91 10.846 21.412 30.716 1.00 0.00 ATOM 734 CG GLU 91 10.516 20.682 32.006 1.00 0.00 ATOM 735 CD GLU 91 9.155 21.062 32.557 1.00 0.00 ATOM 736 OE1 GLU 91 8.575 22.057 32.074 1.00 0.00 ATOM 737 OE2 GLU 91 8.668 20.364 33.472 1.00 0.00 ATOM 738 O GLU 91 10.895 21.216 27.304 1.00 0.00 ATOM 739 C GLU 91 10.359 21.773 28.263 1.00 0.00 ATOM 740 N ARG 92 10.066 23.070 28.271 1.00 0.00 ATOM 741 CA ARG 92 10.370 23.922 27.127 1.00 0.00 ATOM 742 CB ARG 92 9.106 24.178 26.307 1.00 0.00 ATOM 743 CG ARG 92 8.533 22.936 25.644 1.00 0.00 ATOM 744 CD ARG 92 7.240 23.249 24.908 1.00 0.00 ATOM 745 NE ARG 92 6.694 22.072 24.237 1.00 0.00 ATOM 746 CZ ARG 92 5.568 22.071 23.531 1.00 0.00 ATOM 747 NH1 ARG 92 5.149 20.953 22.954 1.00 0.00 ATOM 748 NH2 ARG 92 4.866 23.185 23.401 1.00 0.00 ATOM 749 O ARG 92 10.486 25.760 28.683 1.00 0.00 ATOM 750 C ARG 92 10.843 25.313 27.593 1.00 0.00 ATOM 751 N VAL 93 11.631 25.988 26.761 1.00 0.00 ATOM 752 CA VAL 93 12.131 27.314 27.103 1.00 0.00 ATOM 753 CB VAL 93 13.615 27.244 27.605 1.00 0.00 ATOM 754 CG1 VAL 93 13.715 26.439 28.897 1.00 0.00 ATOM 755 CG2 VAL 93 14.492 26.638 26.531 1.00 0.00 ATOM 756 O VAL 93 12.391 27.921 24.804 1.00 0.00 ATOM 757 C VAL 93 11.923 28.226 25.910 1.00 0.00 ATOM 758 N PRO 94 11.283 29.368 26.132 1.00 0.00 ATOM 759 CA PRO 94 11.278 30.435 25.138 1.00 0.00 ATOM 760 CB PRO 94 10.343 31.493 25.726 1.00 0.00 ATOM 761 CG PRO 94 9.544 30.759 26.751 1.00 0.00 ATOM 762 CD PRO 94 10.466 29.724 27.334 1.00 0.00 ATOM 763 O PRO 94 13.535 30.911 25.795 1.00 0.00 ATOM 764 C PRO 94 12.717 30.866 24.876 1.00 0.00 ATOM 765 N VAL 95 13.040 31.119 23.611 1.00 0.00 ATOM 766 CA VAL 95 14.383 31.541 23.248 1.00 0.00 ATOM 767 CB VAL 95 15.088 30.467 22.399 1.00 0.00 ATOM 768 CG1 VAL 95 16.474 30.941 21.984 1.00 0.00 ATOM 769 CG2 VAL 95 15.240 29.178 23.193 1.00 0.00 ATOM 770 O VAL 95 13.508 32.877 21.457 1.00 0.00 ATOM 771 C VAL 95 14.296 32.807 22.402 1.00 0.00 ATOM 772 N SER 96 15.105 33.805 22.741 1.00 0.00 ATOM 773 CA SER 96 15.108 35.059 22.001 1.00 0.00 ATOM 774 CB SER 96 16.063 36.070 22.630 1.00 0.00 ATOM 775 OG SER 96 15.662 36.402 23.951 1.00 0.00 ATOM 776 O SER 96 16.494 33.832 20.479 1.00 0.00 ATOM 777 C SER 96 15.746 34.797 20.645 1.00 0.00 ATOM 778 N GLN 97 15.494 35.685 19.688 1.00 0.00 ATOM 779 CA GLN 97 16.055 35.535 18.351 1.00 0.00 ATOM 780 CB GLN 97 15.489 36.622 17.397 1.00 0.00 ATOM 781 CG GLN 97 14.049 36.361 16.974 1.00 0.00 ATOM 782 CD GLN 97 13.495 37.441 16.064 1.00 0.00 ATOM 783 OE1 GLN 97 12.464 37.253 15.416 1.00 0.00 ATOM 784 NE2 GLN 97 14.170 38.584 16.015 1.00 0.00 ATOM 785 O GLN 97 18.232 34.753 17.715 1.00 0.00 ATOM 786 C GLN 97 17.579 35.574 18.361 1.00 0.00 ATOM 787 N SER 98 18.145 36.526 19.096 1.00 0.00 ATOM 788 CA SER 98 19.611 36.660 19.184 1.00 0.00 ATOM 789 CB SER 98 20.019 37.776 20.120 1.00 0.00 ATOM 790 OG SER 98 19.502 37.615 21.428 1.00 0.00 ATOM 791 O SER 98 21.191 34.858 18.940 1.00 0.00 ATOM 792 C SER 98 20.252 35.320 19.589 1.00 0.00 ATOM 793 N TYR 99 19.742 34.712 20.654 1.00 0.00 ATOM 794 CA TYR 99 20.274 33.437 21.122 1.00 0.00 ATOM 795 CB TYR 99 20.053 33.331 22.669 1.00 0.00 ATOM 796 CG TYR 99 20.613 34.523 23.401 1.00 0.00 ATOM 797 CD1 TYR 99 21.994 34.662 23.623 1.00 0.00 ATOM 798 CD2 TYR 99 19.805 35.550 23.866 1.00 0.00 ATOM 799 CE1 TYR 99 22.499 35.739 24.275 1.00 0.00 ATOM 800 CE2 TYR 99 20.337 36.642 24.541 1.00 0.00 ATOM 801 CZ TYR 99 21.685 36.739 24.733 1.00 0.00 ATOM 802 OH TYR 99 22.254 37.822 25.396 1.00 0.00 ATOM 803 O TYR 99 20.621 31.305 20.058 1.00 0.00 ATOM 804 C TYR 99 19.860 32.261 20.235 1.00 0.00 ATOM 805 N ALA 100 18.620 32.281 19.734 1.00 0.00 ATOM 806 CA ALA 100 18.148 31.211 18.867 1.00 0.00 ATOM 807 CB ALA 100 16.675 31.410 18.521 1.00 0.00 ATOM 808 O ALA 100 19.319 29.976 17.143 1.00 0.00 ATOM 809 C ALA 100 19.026 31.087 17.587 1.00 0.00 ATOM 810 N SER 101 19.431 32.220 17.022 1.00 0.00 ATOM 811 CA SER 101 20.259 32.211 15.822 1.00 0.00 ATOM 812 CB SER 101 20.362 33.647 15.243 1.00 0.00 ATOM 813 OG SER 101 21.269 33.715 14.179 1.00 0.00 ATOM 814 O SER 101 22.108 30.729 15.441 1.00 0.00 ATOM 815 C SER 101 21.595 31.567 16.184 1.00 0.00 ATOM 816 N TYR 102 22.154 31.960 17.324 1.00 0.00 ATOM 817 CA TYR 102 23.455 31.402 17.785 1.00 0.00 ATOM 818 CB TYR 102 23.773 32.037 19.163 1.00 0.00 ATOM 819 CG TYR 102 25.015 31.410 19.795 1.00 0.00 ATOM 820 CD1 TYR 102 26.286 31.671 19.287 1.00 0.00 ATOM 821 CD2 TYR 102 24.890 30.489 20.826 1.00 0.00 ATOM 822 CE1 TYR 102 27.410 31.020 19.793 1.00 0.00 ATOM 823 CE2 TYR 102 25.982 29.839 21.333 1.00 0.00 ATOM 824 CZ TYR 102 27.236 30.098 20.826 1.00 0.00 ATOM 825 OH TYR 102 28.301 29.414 21.373 1.00 0.00 ATOM 826 O TYR 102 24.244 29.143 17.569 1.00 0.00 ATOM 827 C TYR 102 23.353 29.887 17.979 1.00 0.00 ATOM 828 N PHE 103 22.263 29.437 18.593 1.00 0.00 ATOM 829 CA PHE 103 22.062 28.013 18.827 1.00 0.00 ATOM 830 CB PHE 103 20.824 27.819 19.711 1.00 0.00 ATOM 831 CG PHE 103 20.167 26.468 19.575 1.00 0.00 ATOM 832 CD1 PHE 103 20.830 25.306 19.955 1.00 0.00 ATOM 833 CD2 PHE 103 18.862 26.369 19.094 1.00 0.00 ATOM 834 CE1 PHE 103 20.203 24.061 19.859 1.00 0.00 ATOM 835 CE2 PHE 103 18.226 25.132 18.995 1.00 0.00 ATOM 836 CZ PHE 103 18.899 23.975 19.381 1.00 0.00 ATOM 837 O PHE 103 22.444 26.210 17.297 1.00 0.00 ATOM 838 C PHE 103 21.896 27.294 17.498 1.00 0.00 ATOM 839 N ARG 104 21.122 27.889 16.596 1.00 0.00 ATOM 840 CA ARG 104 20.893 27.292 15.285 1.00 0.00 ATOM 841 CB ARG 104 20.109 28.160 14.319 1.00 0.00 ATOM 842 CG ARG 104 18.620 27.974 14.467 1.00 0.00 ATOM 843 CD ARG 104 17.847 28.720 13.403 1.00 0.00 ATOM 844 NE ARG 104 16.402 28.609 13.612 1.00 0.00 ATOM 845 CZ ARG 104 15.483 28.945 12.708 1.00 0.00 ATOM 846 NH1 ARG 104 15.848 29.408 11.511 1.00 0.00 ATOM 847 NH2 ARG 104 14.191 28.876 13.024 1.00 0.00 ATOM 848 O ARG 104 22.565 25.962 14.191 1.00 0.00 ATOM 849 C ARG 104 22.258 27.067 14.641 1.00 0.00 ATOM 850 N LYS 105 23.087 28.107 14.626 1.00 0.00 ATOM 851 CA LYS 105 24.418 28.004 14.039 1.00 0.00 ATOM 852 CB LYS 105 25.089 29.309 13.958 1.00 0.00 ATOM 853 CG LYS 105 26.379 29.268 13.270 1.00 0.00 ATOM 854 CD LYS 105 27.074 30.633 13.067 1.00 0.00 ATOM 855 CE LYS 105 28.404 30.444 12.334 1.00 0.00 ATOM 856 NZ LYS 105 29.468 29.690 13.061 1.00 0.00 ATOM 857 O LYS 105 25.998 26.248 14.166 1.00 0.00 ATOM 858 C LYS 105 25.302 27.023 14.784 1.00 0.00 ATOM 859 N LEU 106 25.269 27.009 16.133 1.00 0.00 ATOM 860 CA LEU 106 26.111 26.089 16.907 1.00 0.00 ATOM 861 CB LEU 106 25.943 26.379 18.414 1.00 0.00 ATOM 862 CG LEU 106 26.674 25.461 19.379 1.00 0.00 ATOM 863 CD1 LEU 106 28.177 25.471 19.144 1.00 0.00 ATOM 864 CD2 LEU 106 26.316 25.877 20.810 1.00 0.00 ATOM 865 O LEU 106 26.708 23.800 16.524 1.00 0.00 ATOM 866 C LEU 106 25.800 24.619 16.670 1.00 0.00 ATOM 867 N LEU 107 24.515 24.283 16.633 1.00 0.00 ATOM 868 CA LEU 107 24.100 22.902 16.413 1.00 0.00 ATOM 869 CB LEU 107 23.207 22.540 17.749 1.00 0.00 ATOM 870 CG LEU 107 22.910 21.056 17.932 1.00 0.00 ATOM 871 CD1 LEU 107 24.191 20.215 18.047 1.00 0.00 ATOM 872 CD2 LEU 107 22.083 20.857 19.156 1.00 0.00 ATOM 873 O LEU 107 23.370 21.406 14.686 1.00 0.00 ATOM 874 C LEU 107 23.758 22.538 14.972 1.00 0.00 ATOM 875 N GLY 108 23.902 23.501 14.066 1.00 0.00 ATOM 876 CA GLY 108 23.607 23.263 12.663 1.00 0.00 ATOM 877 O GLY 108 21.836 21.912 11.749 1.00 0.00 ATOM 878 C GLY 108 22.139 22.835 12.506 1.00 0.00 ATOM 879 N PHE 109 21.242 23.506 13.220 1.00 0.00 ATOM 880 CA PHE 109 19.821 23.183 13.144 1.00 0.00 ATOM 881 CB PHE 109 19.197 23.140 14.530 1.00 0.00 ATOM 882 CG PHE 109 19.528 21.902 15.338 1.00 0.00 ATOM 883 CD1 PHE 109 20.256 20.846 14.813 1.00 0.00 ATOM 884 CD2 PHE 109 19.053 21.804 16.614 1.00 0.00 ATOM 885 CE1 PHE 109 20.554 19.723 15.566 1.00 0.00 ATOM 886 CE2 PHE 109 19.303 20.669 17.404 1.00 0.00 ATOM 887 CZ PHE 109 20.059 19.623 16.880 1.00 0.00 ATOM 888 O PHE 109 19.454 25.480 12.520 1.00 0.00 ATOM 889 C PHE 109 19.059 24.314 12.458 1.00 0.00 TER END