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 1 Tue Jun 3 18:30:51 2008 MODEL 1 PARENT 3bs1_A REMARK 7 REMARK 7 ALLPARENTS 3bs1_A ATOM 1 N GLY 1 36.024 24.290 31.143 1.00 0.00 ATOM 2 CA GLY 1 36.819 23.434 32.022 1.00 0.00 ATOM 3 O GLY 1 36.763 22.301 34.143 1.00 0.00 ATOM 4 C GLY 1 36.121 22.951 33.279 1.00 0.00 ATOM 5 N LYS 2 34.795 23.064 33.359 1.00 0.00 ATOM 6 CA LYS 2 34.083 22.689 34.573 1.00 0.00 ATOM 7 CB LYS 2 33.548 23.974 35.287 1.00 0.00 ATOM 8 CG LYS 2 34.513 25.157 35.318 1.00 0.00 ATOM 9 CD LYS 2 35.771 24.865 36.119 1.00 0.00 ATOM 10 CE LYS 2 36.499 26.159 36.457 1.00 0.00 ATOM 11 NZ LYS 2 37.844 25.886 37.071 1.00 0.00 ATOM 12 O LYS 2 32.185 21.569 33.532 1.00 0.00 ATOM 13 C LYS 2 33.083 21.536 34.364 1.00 0.00 ATOM 14 N SER 3 33.397 20.424 35.018 1.00 0.00 ATOM 15 CA SER 3 32.587 19.183 34.900 1.00 0.00 ATOM 16 CB SER 3 33.364 17.950 35.142 1.00 0.00 ATOM 17 OG SER 3 33.995 17.935 36.407 1.00 0.00 ATOM 18 O SER 3 30.408 18.531 35.644 1.00 0.00 ATOM 19 C SER 3 31.427 19.171 35.884 1.00 0.00 ATOM 20 N VAL 4 31.550 19.996 36.919 1.00 0.00 ATOM 21 CA VAL 4 30.528 20.119 37.971 1.00 0.00 ATOM 22 CB VAL 4 30.948 19.392 39.259 1.00 0.00 ATOM 23 CG1 VAL 4 31.081 17.891 39.019 1.00 0.00 ATOM 24 CG2 VAL 4 32.271 19.928 39.810 1.00 0.00 ATOM 25 O VAL 4 31.017 22.486 37.946 1.00 0.00 ATOM 26 C VAL 4 30.212 21.596 38.236 1.00 0.00 ATOM 27 N VAL 5 29.018 21.774 38.771 1.00 0.00 ATOM 28 CA VAL 5 28.484 23.102 39.108 1.00 0.00 ATOM 29 CB VAL 5 27.081 23.267 38.538 1.00 0.00 ATOM 30 CG1 VAL 5 26.395 24.445 39.214 1.00 0.00 ATOM 31 CG2 VAL 5 27.194 23.506 37.032 1.00 0.00 ATOM 32 O VAL 5 27.907 22.050 41.156 1.00 0.00 ATOM 33 C VAL 5 28.188 23.075 40.606 1.00 0.00 ATOM 34 N THR 6 28.588 24.132 41.244 1.00 0.00 ATOM 35 CA THR 6 28.234 24.275 42.682 1.00 0.00 ATOM 36 CB THR 6 29.465 24.631 43.570 1.00 0.00 ATOM 37 CG2 THR 6 30.593 23.557 43.427 1.00 0.00 ATOM 38 OG1 THR 6 29.958 25.937 43.204 1.00 0.00 ATOM 39 O THR 6 27.004 26.328 42.227 1.00 0.00 ATOM 40 C THR 6 27.069 25.247 42.803 1.00 0.00 ATOM 41 N LEU 7 25.996 24.689 43.308 1.00 0.00 ATOM 42 CA LEU 7 24.763 25.438 43.529 1.00 0.00 ATOM 43 CB LEU 7 23.603 24.712 42.840 1.00 0.00 ATOM 44 CG LEU 7 23.809 24.360 41.366 1.00 0.00 ATOM 45 CD1 LEU 7 22.747 23.373 40.913 1.00 0.00 ATOM 46 CD2 LEU 7 23.769 25.631 40.534 1.00 0.00 ATOM 47 O LEU 7 24.643 24.758 45.833 1.00 0.00 ATOM 48 C LEU 7 24.679 25.692 45.041 1.00 0.00 ATOM 49 N LYS 8 24.570 26.966 45.382 1.00 0.00 ATOM 50 CA LYS 8 24.655 27.402 46.795 1.00 0.00 ATOM 51 CB LYS 8 25.700 28.515 46.854 1.00 0.00 ATOM 52 CG LYS 8 25.814 29.206 48.222 1.00 0.00 ATOM 53 CD LYS 8 26.541 30.555 48.146 1.00 0.00 ATOM 54 CE LYS 8 25.849 31.523 47.191 1.00 0.00 ATOM 55 NZ LYS 8 25.896 32.896 47.708 1.00 0.00 ATOM 56 O LYS 8 22.829 28.972 46.954 1.00 0.00 ATOM 57 C LYS 8 23.331 27.922 47.375 1.00 0.00 ATOM 58 N THR 9 23.059 27.438 48.577 1.00 0.00 ATOM 59 CA THR 9 21.904 27.932 49.361 1.00 0.00 ATOM 60 CB THR 9 20.855 26.830 49.588 1.00 0.00 ATOM 61 CG2 THR 9 19.619 27.373 50.315 1.00 0.00 ATOM 62 OG1 THR 9 20.412 26.382 48.318 1.00 0.00 ATOM 63 O THR 9 22.730 27.467 51.497 1.00 0.00 ATOM 64 C THR 9 22.426 28.345 50.715 1.00 0.00 ATOM 65 N THR 10 22.565 29.663 50.892 1.00 0.00 ATOM 66 CA THR 10 23.204 30.234 52.103 1.00 0.00 ATOM 67 CB THR 10 22.439 29.913 53.409 1.00 0.00 ATOM 68 CG2 THR 10 20.994 30.299 53.202 1.00 0.00 ATOM 69 OG1 THR 10 22.430 28.532 53.751 1.00 0.00 ATOM 70 O THR 10 25.357 29.875 51.140 1.00 0.00 ATOM 71 C THR 10 24.654 29.751 52.145 1.00 0.00 ATOM 72 N ASP 11 25.073 29.195 53.263 1.00 0.00 ATOM 73 CA ASP 11 26.389 28.568 53.421 1.00 0.00 ATOM 74 CB ASP 11 26.772 28.673 54.887 1.00 0.00 ATOM 75 CG ASP 11 25.874 27.899 55.861 1.00 0.00 ATOM 76 OD1 ASP 11 24.843 27.335 55.437 1.00 0.00 ATOM 77 OD2 ASP 11 26.150 28.092 57.054 1.00 0.00 ATOM 78 O ASP 11 27.515 26.491 52.937 1.00 0.00 ATOM 79 C ASP 11 26.433 27.103 52.955 1.00 0.00 ATOM 80 N GLY 12 25.279 26.554 52.570 1.00 0.00 ATOM 81 CA GLY 12 25.137 25.195 52.021 1.00 0.00 ATOM 82 O GLY 12 25.151 26.084 49.794 1.00 0.00 ATOM 83 C GLY 12 25.500 25.171 50.552 1.00 0.00 ATOM 84 N TRP 13 26.190 24.107 50.174 1.00 0.00 ATOM 85 CA TRP 13 26.512 23.854 48.756 1.00 0.00 ATOM 86 CB TRP 13 28.031 23.832 48.610 1.00 0.00 ATOM 87 CG TRP 13 28.646 25.165 48.816 1.00 0.00 ATOM 88 CD1 TRP 13 29.189 25.649 49.974 1.00 0.00 ATOM 89 CD2 TRP 13 28.723 26.225 47.863 1.00 0.00 ATOM 90 CE2 TRP 13 29.340 27.314 48.495 1.00 0.00 ATOM 91 CE3 TRP 13 28.351 26.353 46.522 1.00 0.00 ATOM 92 NE1 TRP 13 29.610 26.938 49.785 1.00 0.00 ATOM 93 CZ2 TRP 13 29.586 28.509 47.851 1.00 0.00 ATOM 94 CZ3 TRP 13 28.588 27.548 45.873 1.00 0.00 ATOM 95 CH2 TRP 13 29.216 28.616 46.535 1.00 0.00 ATOM 96 O TRP 13 26.221 21.498 49.059 1.00 0.00 ATOM 97 C TRP 13 26.055 22.465 48.318 1.00 0.00 ATOM 98 N ILE 14 25.555 22.402 47.095 1.00 0.00 ATOM 99 CA ILE 14 25.298 21.114 46.433 1.00 0.00 ATOM 100 CB ILE 14 23.771 20.694 46.695 1.00 0.00 ATOM 101 CG1 ILE 14 22.812 21.672 45.998 1.00 0.00 ATOM 102 CG2 ILE 14 23.468 20.573 48.204 1.00 0.00 ATOM 103 CD1 ILE 14 21.331 21.345 46.240 1.00 0.00 ATOM 104 O ILE 14 25.802 21.965 44.253 1.00 0.00 ATOM 105 C ILE 14 26.001 21.082 45.075 1.00 0.00 ATOM 106 N PRO 15 26.942 20.148 44.931 1.00 0.00 ATOM 107 CA PRO 15 27.603 19.938 43.637 1.00 0.00 ATOM 108 CB PRO 15 28.815 19.062 44.000 1.00 0.00 ATOM 109 CG PRO 15 28.902 19.049 45.488 1.00 0.00 ATOM 110 CD PRO 15 27.548 19.347 46.006 1.00 0.00 ATOM 111 O PRO 15 26.179 18.045 43.169 1.00 0.00 ATOM 112 C PRO 15 26.703 19.084 42.778 1.00 0.00 ATOM 113 N VAL 16 26.545 19.558 41.566 1.00 0.00 ATOM 114 CA VAL 16 25.711 18.832 40.615 1.00 0.00 ATOM 115 CB VAL 16 24.291 19.507 40.507 1.00 0.00 ATOM 116 CG1 VAL 16 23.636 19.635 41.871 1.00 0.00 ATOM 117 CG2 VAL 16 24.468 20.875 39.871 1.00 0.00 ATOM 118 O VAL 16 27.236 19.517 38.915 1.00 0.00 ATOM 119 C VAL 16 26.548 18.599 39.363 1.00 0.00 ATOM 120 N PRO 17 26.520 17.367 38.870 1.00 0.00 ATOM 121 CA PRO 17 27.216 17.071 37.616 1.00 0.00 ATOM 122 CB PRO 17 26.958 15.582 37.443 1.00 0.00 ATOM 123 CG PRO 17 26.705 15.029 38.840 1.00 0.00 ATOM 124 CD PRO 17 25.933 16.165 39.492 1.00 0.00 ATOM 125 O PRO 17 25.378 18.271 36.643 1.00 0.00 ATOM 126 C PRO 17 26.557 17.919 36.512 1.00 0.00 ATOM 127 N PHE 18 27.368 18.377 35.570 1.00 0.00 ATOM 128 CA PHE 18 26.915 19.320 34.512 1.00 0.00 ATOM 129 CB PHE 18 28.039 19.626 33.516 1.00 0.00 ATOM 130 CG PHE 18 28.728 20.978 33.720 1.00 0.00 ATOM 131 CD1 PHE 18 29.239 21.365 34.943 1.00 0.00 ATOM 132 CD2 PHE 18 28.849 21.864 32.659 1.00 0.00 ATOM 133 CE1 PHE 18 29.839 22.600 35.091 1.00 0.00 ATOM 134 CE2 PHE 18 29.354 23.140 32.843 1.00 0.00 ATOM 135 CZ PHE 18 29.856 23.488 34.059 1.00 0.00 ATOM 136 O PHE 18 24.671 19.412 33.668 1.00 0.00 ATOM 137 C PHE 18 25.711 18.758 33.766 1.00 0.00 ATOM 138 N SER 19 25.851 17.545 33.240 1.00 0.00 ATOM 139 CA SER 19 24.761 16.907 32.506 1.00 0.00 ATOM 140 CB SER 19 25.339 15.673 31.775 1.00 0.00 ATOM 141 OG SER 19 25.753 14.672 32.671 1.00 0.00 ATOM 142 O SER 19 22.494 16.267 32.702 1.00 0.00 ATOM 143 C SER 19 23.502 16.612 33.318 1.00 0.00 ATOM 144 N LYS 20 23.584 16.587 34.643 1.00 0.00 ATOM 145 CA LYS 20 22.420 16.311 35.485 1.00 0.00 ATOM 146 CB LYS 20 22.906 15.261 36.578 1.00 0.00 ATOM 147 CG LYS 20 21.876 14.946 37.664 1.00 0.00 ATOM 148 CD LYS 20 21.505 13.462 37.750 1.00 0.00 ATOM 149 CE LYS 20 20.444 13.053 36.731 1.00 0.00 ATOM 150 NZ LYS 20 20.893 13.206 35.316 1.00 0.00 ATOM 151 O LYS 20 20.364 17.458 35.881 1.00 0.00 ATOM 152 C LYS 20 21.537 17.584 35.558 1.00 0.00 ATOM 153 N VAL 21 21.949 18.613 34.809 1.00 0.00 ATOM 154 CA VAL 21 21.182 19.862 34.660 1.00 0.00 ATOM 155 CB VAL 21 22.017 21.058 35.151 1.00 0.00 ATOM 156 CG1 VAL 21 21.224 22.361 35.202 1.00 0.00 ATOM 157 CG2 VAL 21 22.637 20.797 36.539 1.00 0.00 ATOM 158 O VAL 21 21.364 20.372 32.358 1.00 0.00 ATOM 159 C VAL 21 20.603 20.003 33.256 1.00 0.00 ATOM 160 N MET 22 19.295 20.223 33.262 1.00 0.00 ATOM 161 CA MET 22 18.548 20.514 32.030 1.00 0.00 ATOM 162 CB MET 22 17.057 20.234 32.212 1.00 0.00 ATOM 163 CG MET 22 16.784 18.759 32.537 1.00 0.00 ATOM 164 SD MET 22 17.202 17.646 31.140 1.00 0.00 ATOM 165 CE MET 22 17.051 16.088 31.988 1.00 0.00 ATOM 166 O MET 22 19.200 22.340 30.618 1.00 0.00 ATOM 167 C MET 22 18.716 21.992 31.696 1.00 0.00 ATOM 168 N TYR 23 18.399 22.858 32.653 1.00 0.00 ATOM 169 CA TYR 23 18.520 24.310 32.446 1.00 0.00 ATOM 170 CB TYR 23 17.399 24.870 31.556 1.00 0.00 ATOM 171 CG TYR 23 16.017 24.719 32.185 1.00 0.00 ATOM 172 CD1 TYR 23 15.508 25.743 32.972 1.00 0.00 ATOM 173 CD2 TYR 23 15.282 23.560 31.966 1.00 0.00 ATOM 174 CE1 TYR 23 14.256 25.621 33.535 1.00 0.00 ATOM 175 CE2 TYR 23 14.023 23.432 32.519 1.00 0.00 ATOM 176 CZ TYR 23 13.530 24.473 33.298 1.00 0.00 ATOM 177 OH TYR 23 12.337 24.362 33.897 1.00 0.00 ATOM 178 O TYR 23 18.480 24.351 34.855 1.00 0.00 ATOM 179 C TYR 23 18.531 25.009 33.813 1.00 0.00 ATOM 180 N LEU 24 18.910 26.280 33.768 1.00 0.00 ATOM 181 CA LEU 24 18.807 27.189 34.918 1.00 0.00 ATOM 182 CB LEU 24 20.187 27.790 35.245 1.00 0.00 ATOM 183 CG LEU 24 20.122 28.885 36.324 1.00 0.00 ATOM 184 CD1 LEU 24 19.587 28.300 37.626 1.00 0.00 ATOM 185 CD2 LEU 24 21.502 29.507 36.540 1.00 0.00 ATOM 186 O LEU 24 17.921 28.880 33.473 1.00 0.00 ATOM 187 C LEU 24 17.883 28.349 34.584 1.00 0.00 ATOM 188 N GLU 25 16.990 28.682 35.511 1.00 0.00 ATOM 189 CA GLU 25 16.055 29.781 35.298 1.00 0.00 ATOM 190 CB GLU 25 14.614 29.309 35.137 1.00 0.00 ATOM 191 CG GLU 25 14.027 28.596 36.375 1.00 0.00 ATOM 192 CD GLU 25 12.598 28.083 36.158 1.00 0.00 ATOM 193 OE1 GLU 25 12.079 28.209 35.036 1.00 0.00 ATOM 194 OE2 GLU 25 12.013 27.590 37.151 1.00 0.00 ATOM 195 O GLU 25 16.475 30.312 37.617 1.00 0.00 ATOM 196 C GLU 25 16.138 30.728 36.508 1.00 0.00 ATOM 197 N ALA 26 15.879 32.000 36.239 1.00 0.00 ATOM 198 CA ALA 26 15.718 32.969 37.328 1.00 0.00 ATOM 199 CB ALA 26 15.961 34.395 36.834 1.00 0.00 ATOM 200 O ALA 26 13.317 32.728 37.218 1.00 0.00 ATOM 201 C ALA 26 14.317 32.859 37.922 1.00 0.00 ATOM 202 N LYS 27 14.278 32.950 39.239 1.00 0.00 ATOM 203 CA LYS 27 13.016 33.053 39.969 1.00 0.00 ATOM 204 CB LYS 27 12.109 31.828 40.000 1.00 0.00 ATOM 205 CG LYS 27 10.983 32.094 38.988 1.00 0.00 ATOM 206 CD LYS 27 10.289 33.446 39.248 1.00 0.00 ATOM 207 CE LYS 27 9.076 33.707 38.375 1.00 0.00 ATOM 208 NZ LYS 27 8.163 32.564 38.335 1.00 0.00 ATOM 209 O LYS 27 13.892 33.462 42.158 1.00 0.00 ATOM 210 C LYS 27 13.213 33.891 41.224 1.00 0.00 ATOM 211 N ASP 28 12.422 34.933 41.269 1.00 0.00 ATOM 212 CA ASP 28 12.496 35.802 42.440 1.00 0.00 ATOM 213 CB ASP 28 11.280 35.782 43.284 1.00 0.00 ATOM 214 CG ASP 28 10.150 36.529 42.598 1.00 0.00 ATOM 215 OD1 ASP 28 10.475 37.392 41.758 1.00 0.00 ATOM 216 OD2 ASP 28 8.974 36.228 42.887 1.00 0.00 ATOM 217 O ASP 28 14.399 36.054 43.869 1.00 0.00 ATOM 218 C ASP 28 13.941 36.170 42.727 1.00 0.00 ATOM 219 N LYS 29 14.706 36.513 41.654 1.00 0.00 ATOM 220 CA LYS 29 16.098 36.923 41.753 1.00 0.00 ATOM 221 CB LYS 29 16.216 37.966 42.832 1.00 0.00 ATOM 222 CG LYS 29 15.399 39.194 42.448 1.00 0.00 ATOM 223 CD LYS 29 15.145 40.130 43.594 1.00 0.00 ATOM 224 CE LYS 29 14.320 41.312 43.050 1.00 0.00 ATOM 225 NZ LYS 29 13.753 42.101 44.138 1.00 0.00 ATOM 226 O LYS 29 18.249 35.951 42.157 1.00 0.00 ATOM 227 C LYS 29 17.032 35.831 42.281 1.00 0.00 ATOM 228 N LYS 30 16.521 34.719 42.769 1.00 0.00 ATOM 229 CA LYS 30 17.315 33.532 43.067 1.00 0.00 ATOM 230 CB LYS 30 16.734 32.798 44.280 1.00 0.00 ATOM 231 CG LYS 30 16.838 33.646 45.536 1.00 0.00 ATOM 232 CD LYS 30 16.013 33.052 46.668 1.00 0.00 ATOM 233 CE LYS 30 16.323 33.738 47.985 1.00 0.00 ATOM 234 NZ LYS 30 17.639 33.270 48.420 1.00 0.00 ATOM 235 O LYS 30 16.587 33.200 40.822 1.00 0.00 ATOM 236 C LYS 30 17.128 32.695 41.803 1.00 0.00 ATOM 237 N THR 31 17.915 31.638 41.662 1.00 0.00 ATOM 238 CA THR 31 17.802 30.799 40.469 1.00 0.00 ATOM 239 CB THR 31 19.103 30.737 39.651 1.00 0.00 ATOM 240 CG2 THR 31 19.649 32.118 39.302 1.00 0.00 ATOM 241 OG1 THR 31 20.090 29.996 40.355 1.00 0.00 ATOM 242 O THR 31 18.034 28.778 41.703 1.00 0.00 ATOM 243 C THR 31 17.384 29.375 40.839 1.00 0.00 ATOM 244 N TYR 32 16.645 28.761 39.935 1.00 0.00 ATOM 245 CA TYR 32 16.261 27.360 40.087 1.00 0.00 ATOM 246 CB TYR 32 14.738 27.199 40.092 1.00 0.00 ATOM 247 CG TYR 32 13.971 27.687 41.335 1.00 0.00 ATOM 248 CD1 TYR 32 13.822 29.050 41.607 1.00 0.00 ATOM 249 CD2 TYR 32 13.230 26.793 42.095 1.00 0.00 ATOM 250 CE1 TYR 32 12.985 29.497 42.621 1.00 0.00 ATOM 251 CE2 TYR 32 12.374 27.229 43.099 1.00 0.00 ATOM 252 CZ TYR 32 12.256 28.590 43.364 1.00 0.00 ATOM 253 OH TYR 32 11.440 29.020 44.361 1.00 0.00 ATOM 254 O TYR 32 16.894 26.890 37.779 1.00 0.00 ATOM 255 C TYR 32 16.955 26.557 38.967 1.00 0.00 ATOM 256 N VAL 33 17.723 25.574 39.409 1.00 0.00 ATOM 257 CA VAL 33 18.315 24.591 38.493 1.00 0.00 ATOM 258 CB VAL 33 19.650 24.055 39.012 1.00 0.00 ATOM 259 CG1 VAL 33 20.229 22.960 38.117 1.00 0.00 ATOM 260 CG2 VAL 33 20.642 25.202 39.008 1.00 0.00 ATOM 261 O VAL 33 16.989 22.775 39.327 1.00 0.00 ATOM 262 C VAL 33 17.330 23.438 38.345 1.00 0.00 ATOM 263 N ASN 34 16.953 23.223 37.100 1.00 0.00 ATOM 264 CA ASN 34 16.078 22.111 36.731 1.00 0.00 ATOM 265 CB ASN 34 15.204 22.503 35.549 1.00 0.00 ATOM 266 CG ASN 34 14.238 21.374 35.187 1.00 0.00 ATOM 267 ND2 ASN 34 13.020 21.722 34.924 1.00 0.00 ATOM 268 OD1 ASN 34 14.545 20.198 35.156 1.00 0.00 ATOM 269 O ASN 34 17.660 20.958 35.343 1.00 0.00 ATOM 270 C ASN 34 16.948 20.918 36.344 1.00 0.00 ATOM 271 N ALA 35 16.956 19.928 37.226 1.00 0.00 ATOM 272 CA ALA 35 17.681 18.671 36.981 1.00 0.00 ATOM 273 CB ALA 35 18.277 18.183 38.311 1.00 0.00 ATOM 274 O ALA 35 15.533 17.903 36.202 1.00 0.00 ATOM 275 C ALA 35 16.720 17.637 36.385 1.00 0.00 ATOM 276 N GLU 36 17.232 16.429 36.124 1.00 0.00 ATOM 277 CA GLU 36 16.430 15.311 35.573 1.00 0.00 ATOM 278 CB GLU 36 17.156 13.970 35.758 1.00 0.00 ATOM 279 CG GLU 36 16.478 12.757 35.114 1.00 0.00 ATOM 280 CD GLU 36 17.325 11.479 35.233 1.00 0.00 ATOM 281 OE1 GLU 36 18.398 11.507 35.857 1.00 0.00 ATOM 282 OE2 GLU 36 16.881 10.471 34.642 1.00 0.00 ATOM 283 O GLU 36 14.042 15.473 35.702 1.00 0.00 ATOM 284 C GLU 36 15.088 15.192 36.288 1.00 0.00 ATOM 285 N GLU 37 15.132 14.935 37.592 1.00 0.00 ATOM 286 CA GLU 37 13.899 14.799 38.388 1.00 0.00 ATOM 287 CB GLU 37 13.864 13.306 38.710 1.00 0.00 ATOM 288 CG GLU 37 13.616 12.393 37.510 1.00 0.00 ATOM 289 CD GLU 37 13.589 10.909 37.896 1.00 0.00 ATOM 290 OE1 GLU 37 13.812 10.561 39.076 1.00 0.00 ATOM 291 OE2 GLU 37 13.427 10.112 36.953 1.00 0.00 ATOM 292 O GLU 37 12.966 15.521 40.514 1.00 0.00 ATOM 293 C GLU 37 13.865 15.620 39.685 1.00 0.00 ATOM 294 N LEU 38 14.687 16.656 39.751 1.00 0.00 ATOM 295 CA LEU 38 14.784 17.497 40.954 1.00 0.00 ATOM 296 CB LEU 38 15.953 17.019 41.831 1.00 0.00 ATOM 297 CG LEU 38 15.770 15.643 42.449 1.00 0.00 ATOM 298 CD1 LEU 38 17.098 15.218 43.060 1.00 0.00 ATOM 299 CD2 LEU 38 14.716 15.692 43.558 1.00 0.00 ATOM 300 O LEU 38 15.801 19.213 39.656 1.00 0.00 ATOM 301 C LEU 38 15.040 18.943 40.585 1.00 0.00 ATOM 302 N THR 39 14.595 19.828 41.461 1.00 0.00 ATOM 303 CA THR 39 14.841 21.265 41.280 1.00 0.00 ATOM 304 CB THR 39 13.538 22.008 40.953 1.00 0.00 ATOM 305 CG2 THR 39 12.483 21.877 42.054 1.00 0.00 ATOM 306 OG1 THR 39 13.856 23.374 40.739 1.00 0.00 ATOM 307 O THR 39 15.153 21.522 43.644 1.00 0.00 ATOM 308 C THR 39 15.541 21.824 42.515 1.00 0.00 ATOM 309 N GLY 40 16.636 22.547 42.302 1.00 0.00 ATOM 310 CA GLY 40 17.392 23.138 43.416 1.00 0.00 ATOM 311 O GLY 40 17.727 25.212 42.245 1.00 0.00 ATOM 312 C GLY 40 17.411 24.667 43.304 1.00 0.00 ATOM 313 N THR 41 17.022 25.349 44.377 1.00 0.00 ATOM 314 CA THR 41 17.004 26.808 44.381 1.00 0.00 ATOM 315 CB THR 41 15.831 27.247 45.244 1.00 0.00 ATOM 316 CG2 THR 41 15.607 28.760 45.182 1.00 0.00 ATOM 317 OG1 THR 41 14.655 26.511 44.873 1.00 0.00 ATOM 318 O THR 41 18.445 27.260 46.208 1.00 0.00 ATOM 319 C THR 41 18.329 27.285 44.984 1.00 0.00 ATOM 320 N HIS 42 19.035 28.149 44.260 1.00 0.00 ATOM 321 CA HIS 42 20.311 28.669 44.738 1.00 0.00 ATOM 322 CB HIS 42 21.372 27.745 44.132 1.00 0.00 ATOM 323 CG HIS 42 21.197 26.305 44.624 1.00 0.00 ATOM 324 CD2 HIS 42 20.630 25.294 43.982 1.00 0.00 ATOM 325 ND1 HIS 42 21.644 25.835 45.781 1.00 0.00 ATOM 326 CE1 HIS 42 21.375 24.533 45.845 1.00 0.00 ATOM 327 NE2 HIS 42 20.782 24.191 44.711 1.00 0.00 ATOM 328 O HIS 42 19.783 30.790 43.702 1.00 0.00 ATOM 329 C HIS 42 20.584 30.132 44.362 1.00 0.00 ATOM 330 N LYS 43 21.536 30.726 45.072 1.00 0.00 ATOM 331 CA LYS 43 21.957 32.113 44.788 1.00 0.00 ATOM 332 CB LYS 43 22.231 32.832 46.148 1.00 0.00 ATOM 333 CG LYS 43 22.430 34.324 46.034 1.00 0.00 ATOM 334 CD LYS 43 22.804 34.923 47.434 1.00 0.00 ATOM 335 CE LYS 43 21.558 35.338 48.169 1.00 0.00 ATOM 336 NZ LYS 43 21.865 35.711 49.578 1.00 0.00 ATOM 337 O LYS 43 24.202 31.792 44.040 1.00 0.00 ATOM 338 C LYS 43 23.041 32.057 43.726 1.00 0.00 ATOM 339 N TYR 44 22.723 32.536 42.527 1.00 0.00 ATOM 340 CA TYR 44 23.686 32.535 41.432 1.00 0.00 ATOM 341 CB TYR 44 23.700 31.078 40.956 1.00 0.00 ATOM 342 CG TYR 44 25.022 30.734 40.275 1.00 0.00 ATOM 343 CD1 TYR 44 26.093 30.318 41.050 1.00 0.00 ATOM 344 CD2 TYR 44 25.116 30.687 38.906 1.00 0.00 ATOM 345 CE1 TYR 44 27.244 29.855 40.441 1.00 0.00 ATOM 346 CE2 TYR 44 26.275 30.232 38.314 1.00 0.00 ATOM 347 CZ TYR 44 27.337 29.799 39.070 1.00 0.00 ATOM 348 OH TYR 44 28.383 29.178 38.488 1.00 0.00 ATOM 349 O TYR 44 22.215 34.150 40.428 1.00 0.00 ATOM 350 C TYR 44 23.178 33.405 40.287 1.00 0.00 ATOM 351 N SER 45 23.988 33.444 39.241 1.00 0.00 ATOM 352 CA SER 45 23.690 34.214 38.034 1.00 0.00 ATOM 353 CB SER 45 24.561 35.470 37.985 1.00 0.00 ATOM 354 OG SER 45 24.271 36.209 36.814 1.00 0.00 ATOM 355 O SER 45 24.851 32.614 36.621 1.00 0.00 ATOM 356 C SER 45 23.906 33.374 36.778 1.00 0.00 ATOM 357 N LEU 46 23.005 33.646 35.860 1.00 0.00 ATOM 358 CA LEU 46 22.855 32.943 34.578 1.00 0.00 ATOM 359 CB LEU 46 21.560 33.533 33.978 1.00 0.00 ATOM 360 CG LEU 46 20.495 34.108 34.954 1.00 0.00 ATOM 361 CD1 LEU 46 19.253 34.618 34.229 1.00 0.00 ATOM 362 CD2 LEU 46 20.011 33.089 35.982 1.00 0.00 ATOM 363 O LEU 46 24.550 32.187 33.022 1.00 0.00 ATOM 364 C LEU 46 24.106 33.126 33.667 1.00 0.00 ATOM 365 N GLN 47 24.817 34.231 33.905 1.00 0.00 ATOM 366 CA GLN 47 26.069 34.562 33.196 1.00 0.00 ATOM 367 CB GLN 47 26.524 35.986 33.496 1.00 0.00 ATOM 368 CG GLN 47 25.604 37.030 32.869 1.00 0.00 ATOM 369 CD GLN 47 26.056 38.426 33.277 1.00 0.00 ATOM 370 OE1 GLN 47 26.837 38.725 34.168 1.00 0.00 ATOM 371 NE2 GLN 47 25.411 39.382 32.677 1.00 0.00 ATOM 372 O GLN 47 27.891 33.068 32.787 1.00 0.00 ATOM 373 C GLN 47 27.198 33.633 33.623 1.00 0.00 ATOM 374 N GLU 48 27.388 33.474 34.935 1.00 0.00 ATOM 375 CA GLU 48 28.440 32.619 35.471 1.00 0.00 ATOM 376 CB GLU 48 28.413 32.645 36.986 1.00 0.00 ATOM 377 CG GLU 48 28.772 34.022 37.582 1.00 0.00 ATOM 378 CD GLU 48 28.690 33.981 39.111 1.00 0.00 ATOM 379 OE1 GLU 48 28.119 32.980 39.608 1.00 0.00 ATOM 380 OE2 GLU 48 29.025 34.999 39.767 1.00 0.00 ATOM 381 O GLU 48 29.272 30.510 34.625 1.00 0.00 ATOM 382 C GLU 48 28.303 31.162 35.001 1.00 0.00 ATOM 383 N PHE 49 27.061 30.679 34.988 1.00 0.00 ATOM 384 CA PHE 49 26.737 29.302 34.568 1.00 0.00 ATOM 385 CB PHE 49 25.243 29.042 34.803 1.00 0.00 ATOM 386 CG PHE 49 24.946 27.549 34.930 1.00 0.00 ATOM 387 CD1 PHE 49 25.122 26.880 36.143 1.00 0.00 ATOM 388 CD2 PHE 49 24.388 26.899 33.848 1.00 0.00 ATOM 389 CE1 PHE 49 24.737 25.548 36.233 1.00 0.00 ATOM 390 CE2 PHE 49 24.008 25.580 33.983 1.00 0.00 ATOM 391 CZ PHE 49 24.187 24.894 35.149 1.00 0.00 ATOM 392 O PHE 49 27.785 28.169 32.739 1.00 0.00 ATOM 393 C PHE 49 27.114 29.132 33.100 1.00 0.00 ATOM 394 N GLU 50 26.720 30.087 32.257 1.00 0.00 ATOM 395 CA GLU 50 27.047 30.001 30.837 1.00 0.00 ATOM 396 CB GLU 50 26.502 31.256 30.154 1.00 0.00 ATOM 397 CG GLU 50 26.920 31.439 28.694 1.00 0.00 ATOM 398 CD GLU 50 26.546 32.811 28.108 1.00 0.00 ATOM 399 OE1 GLU 50 26.558 33.856 28.838 1.00 0.00 ATOM 400 OE2 GLU 50 26.268 32.855 26.884 1.00 0.00 ATOM 401 O GLU 50 29.043 29.041 29.887 1.00 0.00 ATOM 402 C GLU 50 28.563 29.888 30.655 1.00 0.00 ATOM 403 N TYR 51 29.325 30.604 31.527 1.00 0.00 ATOM 404 CA TYR 51 30.783 30.678 31.381 1.00 0.00 ATOM 405 CB TYR 51 31.353 31.841 32.191 1.00 0.00 ATOM 406 CG TYR 51 30.891 33.202 31.670 1.00 0.00 ATOM 407 CD1 TYR 51 30.298 33.365 30.422 1.00 0.00 ATOM 408 CD2 TYR 51 31.069 34.301 32.501 1.00 0.00 ATOM 409 CE1 TYR 51 29.881 34.608 29.998 1.00 0.00 ATOM 410 CE2 TYR 51 30.653 35.544 32.077 1.00 0.00 ATOM 411 CZ TYR 51 30.078 35.699 30.833 1.00 0.00 ATOM 412 OH TYR 51 30.032 36.963 30.372 1.00 0.00 ATOM 413 O TYR 51 32.687 29.225 31.565 1.00 0.00 ATOM 414 C TYR 51 31.508 29.412 31.819 1.00 0.00 ATOM 415 N LEU 52 30.780 28.578 32.539 1.00 0.00 ATOM 416 CA LEU 52 31.351 27.357 33.121 1.00 0.00 ATOM 417 CB LEU 52 30.248 26.711 33.940 1.00 0.00 ATOM 418 CG LEU 52 29.988 27.326 35.295 1.00 0.00 ATOM 419 CD1 LEU 52 28.818 26.584 35.952 1.00 0.00 ATOM 420 CD2 LEU 52 31.268 27.181 36.123 1.00 0.00 ATOM 421 O LEU 52 32.943 25.886 32.099 1.00 0.00 ATOM 422 C LEU 52 31.815 26.366 32.054 1.00 0.00 ATOM 423 N LEU 53 30.969 26.103 31.100 1.00 0.00 ATOM 424 CA LEU 53 31.281 25.148 30.041 1.00 0.00 ATOM 425 CB LEU 53 30.014 24.863 29.264 1.00 0.00 ATOM 426 CG LEU 53 29.400 23.621 29.857 1.00 0.00 ATOM 427 CD1 LEU 53 28.106 23.397 29.174 1.00 0.00 ATOM 428 CD2 LEU 53 30.167 22.322 29.668 1.00 0.00 ATOM 429 O LEU 53 32.169 26.835 28.636 1.00 0.00 ATOM 430 C LEU 53 32.257 25.673 29.012 1.00 0.00 ATOM 431 N PRO 54 33.157 24.825 28.519 1.00 0.00 ATOM 432 CA PRO 54 34.010 25.220 27.397 1.00 0.00 ATOM 433 CB PRO 54 35.074 24.149 27.405 1.00 0.00 ATOM 434 CG PRO 54 34.310 22.872 27.724 1.00 0.00 ATOM 435 CD PRO 54 33.292 23.369 28.759 1.00 0.00 ATOM 436 O PRO 54 32.094 24.492 26.118 1.00 0.00 ATOM 437 C PRO 54 33.131 25.173 26.141 1.00 0.00 ATOM 438 N LYS 55 33.510 25.980 25.159 1.00 0.00 ATOM 439 CA LYS 55 32.815 26.017 23.851 1.00 0.00 ATOM 440 CB LYS 55 33.134 24.398 23.305 1.00 0.00 ATOM 441 CG LYS 55 33.676 24.049 21.922 1.00 0.00 ATOM 442 CD LYS 55 35.176 24.324 21.835 1.00 0.00 ATOM 443 CE LYS 55 35.764 23.854 20.509 1.00 0.00 ATOM 444 NZ LYS 55 37.235 24.094 20.440 1.00 0.00 ATOM 445 O LYS 55 30.737 26.450 22.837 1.00 0.00 ATOM 446 C LYS 55 31.378 26.480 23.912 1.00 0.00 ATOM 447 N ASP 56 30.768 26.686 25.047 1.00 0.00 ATOM 448 CA ASP 56 29.377 27.132 25.174 1.00 0.00 ATOM 449 CB ASP 56 28.982 28.243 24.166 1.00 0.00 ATOM 450 CG ASP 56 29.861 29.484 24.236 1.00 0.00 ATOM 451 OD1 ASP 56 30.063 30.028 25.338 1.00 0.00 ATOM 452 OD2 ASP 56 30.356 30.004 23.208 1.00 0.00 ATOM 453 O ASP 56 27.702 25.893 24.027 1.00 0.00 ATOM 454 C ASP 56 28.376 25.998 25.041 1.00 0.00 ATOM 455 N SER 57 28.107 25.256 26.188 1.00 0.00 ATOM 456 CA SER 57 27.097 24.189 26.197 1.00 0.00 ATOM 457 CB SER 57 26.954 22.672 26.477 1.00 0.00 ATOM 458 OG SER 57 27.890 21.895 25.756 1.00 0.00 ATOM 459 O SER 57 24.804 24.800 26.537 1.00 0.00 ATOM 460 C SER 57 25.952 24.856 26.977 1.00 0.00 ATOM 461 N PHE 58 26.301 25.686 27.949 1.00 0.00 ATOM 462 CA PHE 58 25.290 26.437 28.717 1.00 0.00 ATOM 463 CB PHE 58 25.618 26.415 30.215 1.00 0.00 ATOM 464 CG PHE 58 25.264 25.046 30.841 1.00 0.00 ATOM 465 CD1 PHE 58 26.215 24.183 31.322 1.00 0.00 ATOM 466 CD2 PHE 58 23.952 24.627 30.950 1.00 0.00 ATOM 467 CE1 PHE 58 25.851 22.945 31.831 1.00 0.00 ATOM 468 CE2 PHE 58 23.607 23.409 31.535 1.00 0.00 ATOM 469 CZ PHE 58 24.559 22.543 31.983 1.00 0.00 ATOM 470 O PHE 58 26.058 28.587 27.993 1.00 0.00 ATOM 471 C PHE 58 25.110 27.822 28.083 1.00 0.00 ATOM 472 N ILE 59 23.970 27.966 27.409 1.00 0.00 ATOM 473 CA ILE 59 23.672 29.127 26.542 1.00 0.00 ATOM 474 CB ILE 59 23.291 28.668 25.105 1.00 0.00 ATOM 475 CG1 ILE 59 24.340 27.697 24.549 1.00 0.00 ATOM 476 CG2 ILE 59 23.131 29.873 24.184 1.00 0.00 ATOM 477 CD1 ILE 59 25.745 28.272 24.483 1.00 0.00 ATOM 478 O ILE 59 21.486 29.440 27.503 1.00 0.00 ATOM 479 C ILE 59 22.546 29.962 27.143 1.00 0.00 ATOM 480 N ARG 60 22.741 31.269 27.044 1.00 0.00 ATOM 481 CA ARG 60 21.716 32.256 27.431 1.00 0.00 ATOM 482 CB ARG 60 22.498 33.486 28.074 1.00 0.00 ATOM 483 CG ARG 60 21.926 34.742 28.542 1.00 0.00 ATOM 484 CD ARG 60 22.871 35.872 28.631 1.00 0.00 ATOM 485 NE ARG 60 23.264 36.596 27.432 1.00 0.00 ATOM 486 CZ ARG 60 24.494 36.680 26.894 1.00 0.00 ATOM 487 NH1 ARG 60 25.562 36.127 27.403 1.00 0.00 ATOM 488 NH2 ARG 60 24.607 37.373 25.773 1.00 0.00 ATOM 489 O ARG 60 20.754 33.349 25.505 1.00 0.00 ATOM 490 C ARG 60 20.703 32.399 26.285 1.00 0.00 ATOM 491 N CYS 61 19.644 31.604 26.355 1.00 0.00 ATOM 492 CA CYS 61 18.593 31.641 25.312 1.00 0.00 ATOM 493 CB CYS 61 17.895 30.285 25.261 1.00 0.00 ATOM 494 SG CYS 61 16.935 29.973 26.784 1.00 0.00 ATOM 495 O CYS 61 16.936 33.248 24.596 1.00 0.00 ATOM 496 C CYS 61 17.639 32.832 25.505 1.00 0.00 ATOM 497 N HIS 62 17.506 33.242 26.764 1.00 0.00 ATOM 498 CA HIS 62 16.566 34.288 27.190 1.00 0.00 ATOM 499 CB HIS 62 15.221 33.665 27.588 1.00 0.00 ATOM 500 CG HIS 62 14.129 34.679 27.823 1.00 0.00 ATOM 501 CD2 HIS 62 13.270 35.272 26.953 1.00 0.00 ATOM 502 ND1 HIS 62 13.801 35.179 29.075 1.00 0.00 ATOM 503 CE1 HIS 62 12.817 36.047 28.956 1.00 0.00 ATOM 504 NE2 HIS 62 12.395 36.028 27.699 1.00 0.00 ATOM 505 O HIS 62 17.900 34.347 29.183 1.00 0.00 ATOM 506 C HIS 62 17.110 34.946 28.454 1.00 0.00 ATOM 507 N ARG 63 16.685 36.180 28.711 1.00 0.00 ATOM 508 CA ARG 63 17.140 36.906 29.895 1.00 0.00 ATOM 509 CB ARG 63 16.408 38.250 29.976 1.00 0.00 ATOM 510 CG ARG 63 16.883 39.191 28.858 1.00 0.00 ATOM 511 CD ARG 63 16.082 40.489 28.874 1.00 0.00 ATOM 512 NE ARG 63 14.766 40.295 28.239 1.00 0.00 ATOM 513 CZ ARG 63 13.792 41.205 28.244 1.00 0.00 ATOM 514 NH1 ARG 63 13.905 42.369 28.861 1.00 0.00 ATOM 515 NH2 ARG 63 12.685 40.995 27.574 1.00 0.00 ATOM 516 O ARG 63 17.759 36.135 32.080 1.00 0.00 ATOM 517 C ARG 63 16.925 36.095 31.173 1.00 0.00 ATOM 518 N SER 64 15.878 35.218 31.197 1.00 0.00 ATOM 519 CA SER 64 15.555 34.409 32.376 1.00 0.00 ATOM 520 CB SER 64 14.015 34.428 32.598 1.00 0.00 ATOM 521 OG SER 64 13.513 35.747 32.723 1.00 0.00 ATOM 522 O SER 64 15.760 32.214 33.310 1.00 0.00 ATOM 523 C SER 64 15.966 32.932 32.328 1.00 0.00 ATOM 524 N PHE 65 16.603 32.502 31.235 1.00 0.00 ATOM 525 CA PHE 65 16.953 31.077 31.033 1.00 0.00 ATOM 526 CB PHE 65 15.960 30.412 30.072 1.00 0.00 ATOM 527 CG PHE 65 14.524 30.447 30.568 1.00 0.00 ATOM 528 CD1 PHE 65 13.691 31.495 30.208 1.00 0.00 ATOM 529 CD2 PHE 65 14.049 29.445 31.401 1.00 0.00 ATOM 530 CE1 PHE 65 12.391 31.547 30.679 1.00 0.00 ATOM 531 CE2 PHE 65 12.739 29.482 31.858 1.00 0.00 ATOM 532 CZ PHE 65 11.908 30.540 31.499 1.00 0.00 ATOM 533 O PHE 65 18.551 31.250 29.284 1.00 0.00 ATOM 534 C PHE 65 18.333 30.832 30.425 1.00 0.00 ATOM 535 N ILE 66 19.021 29.865 31.019 1.00 0.00 ATOM 536 CA ILE 66 20.258 29.294 30.456 1.00 0.00 ATOM 537 CB ILE 66 21.450 29.461 31.421 1.00 0.00 ATOM 538 CG1 ILE 66 21.621 30.914 31.870 1.00 0.00 ATOM 539 CG2 ILE 66 22.760 28.919 30.828 1.00 0.00 ATOM 540 CD1 ILE 66 21.940 31.927 30.770 1.00 0.00 ATOM 541 O ILE 66 19.416 27.130 31.057 1.00 0.00 ATOM 542 C ILE 66 19.953 27.824 30.189 1.00 0.00 ATOM 543 N VAL 67 20.185 27.433 28.947 1.00 0.00 ATOM 544 CA VAL 67 19.884 26.066 28.481 1.00 0.00 ATOM 545 CB VAL 67 19.181 26.060 27.121 1.00 0.00 ATOM 546 CG1 VAL 67 17.797 26.692 27.257 1.00 0.00 ATOM 547 CG2 VAL 67 19.983 26.813 26.064 1.00 0.00 ATOM 548 O VAL 67 22.227 25.784 27.995 1.00 0.00 ATOM 549 C VAL 67 21.177 25.257 28.369 1.00 0.00 ATOM 550 N ASN 68 21.027 23.959 28.613 1.00 0.00 ATOM 551 CA ASN 68 22.103 23.010 28.337 1.00 0.00 ATOM 552 CB ASN 68 22.093 21.820 29.287 1.00 0.00 ATOM 553 CG ASN 68 23.356 20.962 29.102 1.00 0.00 ATOM 554 ND2 ASN 68 23.724 20.269 30.150 1.00 0.00 ATOM 555 OD1 ASN 68 24.015 20.905 28.072 1.00 0.00 ATOM 556 O ASN 68 21.012 21.594 26.737 1.00 0.00 ATOM 557 C ASN 68 21.865 22.460 26.934 1.00 0.00 ATOM 558 N VAL 69 22.638 22.944 25.967 1.00 0.00 ATOM 559 CA VAL 69 22.498 22.489 24.590 1.00 0.00 ATOM 560 CB VAL 69 23.533 23.239 23.754 1.00 0.00 ATOM 561 CG1 VAL 69 23.610 22.794 22.287 1.00 0.00 ATOM 562 CG2 VAL 69 23.105 24.692 23.817 1.00 0.00 ATOM 563 O VAL 69 21.913 20.472 23.430 1.00 0.00 ATOM 564 C VAL 69 22.534 20.981 24.364 1.00 0.00 ATOM 565 N ASN 70 23.258 20.268 25.221 1.00 0.00 ATOM 566 CA ASN 70 23.361 18.812 25.103 1.00 0.00 ATOM 567 CB ASN 70 24.383 18.294 26.037 1.00 0.00 ATOM 568 CG ASN 70 25.775 18.580 25.514 1.00 0.00 ATOM 569 ND2 ASN 70 26.480 19.534 26.134 1.00 0.00 ATOM 570 OD1 ASN 70 26.208 17.946 24.545 1.00 0.00 ATOM 571 O ASN 70 21.970 16.865 25.151 1.00 0.00 ATOM 572 C ASN 70 22.065 18.067 25.398 1.00 0.00 ATOM 573 N HIS 71 21.138 18.732 26.080 1.00 0.00 ATOM 574 CA HIS 71 19.861 18.117 26.418 1.00 0.00 ATOM 575 CB HIS 71 19.796 18.041 27.950 1.00 0.00 ATOM 576 CG HIS 71 21.007 17.242 28.499 1.00 0.00 ATOM 577 CD2 HIS 71 21.711 17.517 29.590 1.00 0.00 ATOM 578 ND1 HIS 71 21.600 16.206 27.904 1.00 0.00 ATOM 579 CE1 HIS 71 22.659 15.833 28.599 1.00 0.00 ATOM 580 NE2 HIS 71 22.725 16.654 29.644 1.00 0.00 ATOM 581 O HIS 71 17.464 18.407 26.083 1.00 0.00 ATOM 582 C HIS 71 18.614 18.683 25.729 1.00 0.00 ATOM 583 N ILE 72 18.853 19.548 24.747 1.00 0.00 ATOM 584 CA ILE 72 17.779 20.035 23.878 1.00 0.00 ATOM 585 CB ILE 72 18.209 21.262 23.103 1.00 0.00 ATOM 586 CG1 ILE 72 18.785 22.232 24.151 1.00 0.00 ATOM 587 CG2 ILE 72 17.029 21.789 22.242 1.00 0.00 ATOM 588 CD1 ILE 72 17.683 22.936 24.941 1.00 0.00 ATOM 589 O ILE 72 18.180 18.652 22.018 1.00 0.00 ATOM 590 C ILE 72 17.392 18.919 22.919 1.00 0.00 ATOM 591 N LYS 73 16.090 18.744 22.850 1.00 0.00 ATOM 592 CA LYS 73 15.512 17.794 21.895 1.00 0.00 ATOM 593 CB LYS 73 14.282 17.106 22.502 1.00 0.00 ATOM 594 CG LYS 73 13.740 16.057 21.532 1.00 0.00 ATOM 595 CD LYS 73 12.600 15.300 22.200 1.00 0.00 ATOM 596 CE LYS 73 12.084 14.157 21.341 1.00 0.00 ATOM 597 NZ LYS 73 11.005 13.398 21.987 1.00 0.00 ATOM 598 O LYS 73 15.216 17.931 19.512 1.00 0.00 ATOM 599 C LYS 73 15.039 18.468 20.605 1.00 0.00 ATOM 600 N ALA 74 14.400 19.638 20.728 1.00 0.00 ATOM 601 CA ALA 74 13.906 20.374 19.575 1.00 0.00 ATOM 602 CB ALA 74 12.524 19.854 19.192 1.00 0.00 ATOM 603 O ALA 74 13.537 22.134 21.200 1.00 0.00 ATOM 604 C ALA 74 13.598 21.804 20.011 1.00 0.00 ATOM 605 N ILE 75 13.481 22.655 19.014 1.00 0.00 ATOM 606 CA ILE 75 13.058 24.043 19.224 1.00 0.00 ATOM 607 CB ILE 75 14.248 25.037 19.059 1.00 0.00 ATOM 608 CG1 ILE 75 14.937 24.830 17.699 1.00 0.00 ATOM 609 CG2 ILE 75 15.218 24.876 20.231 1.00 0.00 ATOM 610 CD1 ILE 75 16.020 25.941 17.414 1.00 0.00 ATOM 611 O ILE 75 11.905 24.052 17.106 1.00 0.00 ATOM 612 C ILE 75 11.917 24.440 18.277 1.00 0.00 ATOM 613 N TYR 76 10.902 25.063 18.901 1.00 0.00 ATOM 614 CA TYR 76 9.869 25.674 18.064 1.00 0.00 ATOM 615 CB TYR 76 8.482 25.052 18.525 1.00 0.00 ATOM 616 CG TYR 76 8.501 23.609 18.990 1.00 0.00 ATOM 617 CD1 TYR 76 8.973 23.269 20.258 1.00 0.00 ATOM 618 CD2 TYR 76 8.027 22.587 18.169 1.00 0.00 ATOM 619 CE1 TYR 76 8.972 21.947 20.696 1.00 0.00 ATOM 620 CE2 TYR 76 8.024 21.258 18.596 1.00 0.00 ATOM 621 CZ TYR 76 8.493 20.946 19.862 1.00 0.00 ATOM 622 OH TYR 76 8.469 19.639 20.294 1.00 0.00 ATOM 623 O TYR 76 10.105 27.904 18.731 1.00 0.00 ATOM 624 C TYR 76 10.471 27.091 17.893 1.00 0.00 ATOM 625 N PRO 77 11.530 27.319 17.065 1.00 0.00 ATOM 626 CA PRO 77 12.348 28.579 16.983 1.00 0.00 ATOM 627 CB PRO 77 13.115 28.468 15.670 1.00 0.00 ATOM 628 CG PRO 77 12.750 27.157 14.988 1.00 0.00 ATOM 629 CD PRO 77 11.641 26.508 15.802 1.00 0.00 ATOM 630 O PRO 77 10.324 29.572 16.553 1.00 0.00 ATOM 631 C PRO 77 11.486 29.795 16.699 1.00 0.00 ATOM 632 N ASP 78 11.853 31.042 16.871 1.00 0.00 ATOM 633 CA ASP 78 10.911 32.146 16.555 1.00 0.00 ATOM 634 CB ASP 78 11.525 33.495 16.902 1.00 0.00 ATOM 635 CG ASP 78 12.846 33.827 16.208 1.00 0.00 ATOM 636 OD1 ASP 78 13.585 32.926 15.741 1.00 0.00 ATOM 637 OD2 ASP 78 13.137 35.031 16.271 1.00 0.00 ATOM 638 O ASP 78 9.336 32.199 14.717 1.00 0.00 ATOM 639 C ASP 78 10.517 32.204 15.096 1.00 0.00 ATOM 640 N THR 79 11.477 32.271 14.182 1.00 0.00 ATOM 641 CA THR 79 11.167 32.321 12.759 1.00 0.00 ATOM 642 CB THR 79 12.503 32.846 11.979 1.00 0.00 ATOM 643 CG2 THR 79 12.819 34.297 12.304 1.00 0.00 ATOM 644 OG1 THR 79 13.611 32.015 12.352 1.00 0.00 ATOM 645 O THR 79 9.755 30.977 11.356 1.00 0.00 ATOM 646 C THR 79 10.621 31.000 12.246 1.00 0.00 ATOM 647 N HIS 80 11.008 29.972 12.865 1.00 0.00 ATOM 648 CA HIS 80 10.307 28.707 12.620 1.00 0.00 ATOM 649 CB HIS 80 11.488 27.788 12.119 1.00 0.00 ATOM 650 CG HIS 80 12.620 28.032 11.040 1.00 0.00 ATOM 651 CD2 HIS 80 13.619 28.939 10.960 1.00 0.00 ATOM 652 ND1 HIS 80 12.791 27.302 9.934 1.00 0.00 ATOM 653 CE1 HIS 80 13.805 27.759 9.199 1.00 0.00 ATOM 654 NE2 HIS 80 14.332 28.799 9.829 1.00 0.00 ATOM 655 O HIS 80 7.924 28.851 12.458 1.00 0.00 ATOM 656 C HIS 80 8.889 28.863 13.201 1.00 0.00 ATOM 657 N SER 81 8.918 29.310 14.496 1.00 0.00 ATOM 658 CA SER 81 7.723 29.788 15.189 1.00 0.00 ATOM 659 CB SER 81 6.364 28.964 14.803 1.00 0.00 ATOM 660 OG SER 81 6.167 27.929 15.747 1.00 0.00 ATOM 661 O SER 81 7.482 31.556 16.853 1.00 0.00 ATOM 662 C SER 81 7.336 30.357 16.613 1.00 0.00 ATOM 663 N THR 82 7.083 29.549 17.659 1.00 0.00 ATOM 664 CA THR 82 6.567 29.991 19.001 1.00 0.00 ATOM 665 CB THR 82 5.172 29.133 19.201 1.00 0.00 ATOM 666 CG2 THR 82 4.589 29.376 20.592 1.00 0.00 ATOM 667 OG1 THR 82 4.196 29.486 18.213 1.00 0.00 ATOM 668 O THR 82 7.435 30.846 21.102 1.00 0.00 ATOM 669 C THR 82 7.682 30.388 19.987 1.00 0.00 ATOM 670 N PHE 83 8.905 30.059 19.581 1.00 0.00 ATOM 671 CA PHE 83 10.139 30.198 20.367 1.00 0.00 ATOM 672 CB PHE 83 10.666 31.647 20.335 1.00 0.00 ATOM 673 CG PHE 83 9.650 32.764 20.507 1.00 0.00 ATOM 674 CD1 PHE 83 9.250 33.176 21.759 1.00 0.00 ATOM 675 CD2 PHE 83 9.175 33.409 19.391 1.00 0.00 ATOM 676 CE1 PHE 83 8.350 34.226 21.885 1.00 0.00 ATOM 677 CE2 PHE 83 8.297 34.460 19.515 1.00 0.00 ATOM 678 CZ PHE 83 7.871 34.886 20.764 1.00 0.00 ATOM 679 O PHE 83 10.558 29.947 22.767 1.00 0.00 ATOM 680 C PHE 83 10.101 29.477 21.722 1.00 0.00 ATOM 681 N LEU 84 9.766 28.194 21.594 1.00 0.00 ATOM 682 CA LEU 84 9.732 27.253 22.739 1.00 0.00 ATOM 683 CB LEU 84 8.370 26.548 22.835 1.00 0.00 ATOM 684 CG LEU 84 7.186 27.488 23.066 1.00 0.00 ATOM 685 CD1 LEU 84 5.900 26.652 23.072 1.00 0.00 ATOM 686 CD2 LEU 84 7.291 28.257 24.389 1.00 0.00 ATOM 687 O LEU 84 10.874 25.429 21.681 1.00 0.00 ATOM 688 C LEU 84 10.810 26.178 22.655 1.00 0.00 ATOM 689 N LEU 85 11.615 26.061 23.707 1.00 0.00 ATOM 690 CA LEU 85 12.685 25.064 23.738 1.00 0.00 ATOM 691 CB LEU 85 13.868 25.602 24.531 1.00 0.00 ATOM 692 CG LEU 85 14.453 26.914 23.999 1.00 0.00 ATOM 693 CD1 LEU 85 15.577 27.389 24.904 1.00 0.00 ATOM 694 CD2 LEU 85 14.952 26.712 22.577 1.00 0.00 ATOM 695 O LEU 85 11.849 23.835 25.607 1.00 0.00 ATOM 696 C LEU 85 12.242 23.803 24.440 1.00 0.00 ATOM 697 N SER 86 12.338 22.675 23.744 1.00 0.00 ATOM 698 CA SER 86 11.942 21.395 24.320 1.00 0.00 ATOM 699 CB SER 86 10.803 20.810 23.427 1.00 0.00 ATOM 700 OG SER 86 11.393 20.256 22.258 1.00 0.00 ATOM 701 O SER 86 14.006 20.268 23.883 1.00 0.00 ATOM 702 C SER 86 13.152 20.569 24.718 1.00 0.00 ATOM 703 N MET 87 13.062 19.992 25.912 1.00 0.00 ATOM 704 CA MET 87 14.170 19.214 26.493 1.00 0.00 ATOM 705 CB MET 87 14.363 19.592 27.967 1.00 0.00 ATOM 706 CG MET 87 14.749 21.045 28.161 1.00 0.00 ATOM 707 SD MET 87 16.422 21.430 27.549 1.00 0.00 ATOM 708 CE MET 87 16.430 23.121 28.131 1.00 0.00 ATOM 709 O MET 87 12.821 17.243 26.229 1.00 0.00 ATOM 710 C MET 87 13.947 17.701 26.427 1.00 0.00 ATOM 711 N ASP 88 15.013 16.933 26.629 1.00 0.00 ATOM 712 CA ASP 88 14.914 15.480 26.591 1.00 0.00 ATOM 713 CB ASP 88 16.294 14.849 26.757 1.00 0.00 ATOM 714 CG ASP 88 17.179 15.044 25.525 1.00 0.00 ATOM 715 OD1 ASP 88 16.629 15.361 24.452 1.00 0.00 ATOM 716 OD2 ASP 88 18.377 14.736 25.679 1.00 0.00 ATOM 717 O ASP 88 13.185 14.049 27.355 1.00 0.00 ATOM 718 C ASP 88 13.933 14.976 27.629 1.00 0.00 ATOM 719 N ASN 89 13.832 15.641 28.811 1.00 0.00 ATOM 720 CA ASN 89 12.908 15.215 29.840 1.00 0.00 ATOM 721 CB ASN 89 13.465 15.683 31.176 1.00 0.00 ATOM 722 CG ASN 89 13.343 17.201 31.380 1.00 0.00 ATOM 723 ND2 ASN 89 13.557 17.617 32.599 1.00 0.00 ATOM 724 OD1 ASN 89 13.046 17.983 30.485 1.00 0.00 ATOM 725 O ASN 89 10.684 15.605 30.659 1.00 0.00 ATOM 726 C ASN 89 11.480 15.737 29.712 1.00 0.00 ATOM 727 N GLY 90 11.112 16.287 28.539 1.00 0.00 ATOM 728 CA GLY 90 9.761 16.762 28.255 1.00 0.00 ATOM 729 O GLY 90 8.301 18.629 28.524 1.00 0.00 ATOM 730 C GLY 90 9.370 18.124 28.851 1.00 0.00 ATOM 731 N GLU 91 10.315 18.768 29.542 1.00 0.00 ATOM 732 CA GLU 91 10.160 20.164 29.971 1.00 0.00 ATOM 733 CB GLU 91 11.177 20.512 31.053 1.00 0.00 ATOM 734 CG GLU 91 10.884 19.822 32.382 1.00 0.00 ATOM 735 CD GLU 91 9.565 20.255 33.025 1.00 0.00 ATOM 736 OE1 GLU 91 8.899 21.165 32.473 1.00 0.00 ATOM 737 OE2 GLU 91 9.231 19.644 34.045 1.00 0.00 ATOM 738 O GLU 91 10.876 20.739 27.754 1.00 0.00 ATOM 739 C GLU 91 10.362 21.126 28.805 1.00 0.00 ATOM 740 N ARG 92 9.977 22.383 28.998 1.00 0.00 ATOM 741 CA ARG 92 10.126 23.382 27.957 1.00 0.00 ATOM 742 CB ARG 92 8.922 23.698 27.079 1.00 0.00 ATOM 743 CG ARG 92 8.452 22.489 26.287 1.00 0.00 ATOM 744 CD ARG 92 7.340 22.981 25.396 1.00 0.00 ATOM 745 NE ARG 92 6.731 21.811 24.748 1.00 0.00 ATOM 746 CZ ARG 92 5.705 21.879 23.912 1.00 0.00 ATOM 747 NH1 ARG 92 5.171 23.035 23.526 1.00 0.00 ATOM 748 NH2 ARG 92 5.212 20.752 23.441 1.00 0.00 ATOM 749 O ARG 92 9.911 24.934 29.719 1.00 0.00 ATOM 750 C ARG 92 10.496 24.669 28.675 1.00 0.00 ATOM 751 N VAL 93 11.123 25.539 27.918 1.00 0.00 ATOM 752 CA VAL 93 11.392 26.917 28.340 1.00 0.00 ATOM 753 CB VAL 93 12.728 27.084 29.100 1.00 0.00 ATOM 754 CG1 VAL 93 12.755 26.290 30.399 1.00 0.00 ATOM 755 CG2 VAL 93 13.935 26.742 28.219 1.00 0.00 ATOM 756 O VAL 93 11.078 27.437 26.019 1.00 0.00 ATOM 757 C VAL 93 11.343 27.879 27.147 1.00 0.00 ATOM 758 N PRO 94 11.254 29.174 27.445 1.00 0.00 ATOM 759 CA PRO 94 11.258 30.211 26.403 1.00 0.00 ATOM 760 CB PRO 94 10.465 31.370 27.045 1.00 0.00 ATOM 761 CG PRO 94 9.681 30.723 28.141 1.00 0.00 ATOM 762 CD PRO 94 10.561 29.595 28.645 1.00 0.00 ATOM 763 O PRO 94 13.561 30.846 26.775 1.00 0.00 ATOM 764 C PRO 94 12.636 30.712 25.972 1.00 0.00 ATOM 765 N VAL 95 12.664 31.120 24.714 1.00 0.00 ATOM 766 CA VAL 95 13.803 31.855 24.131 1.00 0.00 ATOM 767 CB VAL 95 14.451 31.223 22.892 1.00 0.00 ATOM 768 CG1 VAL 95 15.210 30.001 23.315 1.00 0.00 ATOM 769 CG2 VAL 95 13.486 30.729 21.834 1.00 0.00 ATOM 770 O VAL 95 12.258 33.370 23.111 1.00 0.00 ATOM 771 C VAL 95 13.317 33.237 23.724 1.00 0.00 ATOM 772 N SER 96 14.237 34.173 23.826 1.00 0.00 ATOM 773 CA SER 96 13.942 35.553 23.416 1.00 0.00 ATOM 774 CB SER 96 14.807 36.534 24.218 1.00 0.00 ATOM 775 OG SER 96 16.176 36.471 23.861 1.00 0.00 ATOM 776 O SER 96 14.908 35.010 21.281 1.00 0.00 ATOM 777 C SER 96 14.210 35.799 21.920 1.00 0.00 ATOM 778 N GLN 97 13.516 36.771 21.339 1.00 0.00 ATOM 779 CA GLN 97 13.694 37.087 19.925 1.00 0.00 ATOM 780 CB GLN 97 12.900 38.368 19.663 1.00 0.00 ATOM 781 CG GLN 97 12.961 38.793 18.200 1.00 0.00 ATOM 782 CD GLN 97 12.240 40.120 17.971 1.00 0.00 ATOM 783 OE1 GLN 97 11.804 40.804 18.890 1.00 0.00 ATOM 784 NE2 GLN 97 12.118 40.472 16.723 1.00 0.00 ATOM 785 O GLN 97 15.673 36.734 18.602 1.00 0.00 ATOM 786 C GLN 97 15.175 37.300 19.561 1.00 0.00 ATOM 787 N SER 98 15.889 38.010 20.433 1.00 0.00 ATOM 788 CA SER 98 17.315 38.315 20.191 1.00 0.00 ATOM 789 CB SER 98 17.837 39.409 21.112 1.00 0.00 ATOM 790 OG SER 98 17.807 39.014 22.484 1.00 0.00 ATOM 791 O SER 98 19.330 37.107 19.672 1.00 0.00 ATOM 792 C SER 98 18.241 37.089 20.251 1.00 0.00 ATOM 793 N TYR 99 17.851 36.076 21.008 1.00 0.00 ATOM 794 CA TYR 99 18.727 34.924 21.311 1.00 0.00 ATOM 795 CB TYR 99 18.995 35.071 22.920 1.00 0.00 ATOM 796 CG TYR 99 20.034 36.092 23.259 1.00 0.00 ATOM 797 CD1 TYR 99 19.695 37.254 23.958 1.00 0.00 ATOM 798 CD2 TYR 99 21.363 35.927 22.803 1.00 0.00 ATOM 799 CE1 TYR 99 20.663 38.240 24.202 1.00 0.00 ATOM 800 CE2 TYR 99 22.314 36.904 23.032 1.00 0.00 ATOM 801 CZ TYR 99 21.965 38.045 23.728 1.00 0.00 ATOM 802 OH TYR 99 22.903 39.027 23.941 1.00 0.00 ATOM 803 O TYR 99 19.219 32.657 20.712 1.00 0.00 ATOM 804 C TYR 99 18.382 33.569 20.708 1.00 0.00 ATOM 805 N ALA 100 17.161 33.454 20.200 1.00 0.00 ATOM 806 CA ALA 100 16.607 32.155 19.738 1.00 0.00 ATOM 807 CB ALA 100 15.170 32.344 19.257 1.00 0.00 ATOM 808 O ALA 100 17.561 30.326 18.490 1.00 0.00 ATOM 809 C ALA 100 17.384 31.541 18.570 1.00 0.00 ATOM 810 N SER 101 17.888 32.402 17.694 1.00 0.00 ATOM 811 CA SER 101 18.553 31.952 16.456 1.00 0.00 ATOM 812 CB SER 101 18.851 33.115 15.528 1.00 0.00 ATOM 813 OG SER 101 19.705 34.061 16.151 1.00 0.00 ATOM 814 O SER 101 20.239 30.318 16.064 1.00 0.00 ATOM 815 C SER 101 19.912 31.311 16.709 1.00 0.00 ATOM 816 N TYR 102 20.765 31.945 17.505 1.00 0.00 ATOM 817 CA TYR 102 22.062 31.319 17.882 1.00 0.00 ATOM 818 CB TYR 102 22.739 32.220 18.943 1.00 0.00 ATOM 819 CG TYR 102 24.044 31.663 19.487 1.00 0.00 ATOM 820 CD1 TYR 102 25.253 31.854 18.808 1.00 0.00 ATOM 821 CD2 TYR 102 24.065 30.929 20.677 1.00 0.00 ATOM 822 CE1 TYR 102 26.452 31.326 19.305 1.00 0.00 ATOM 823 CE2 TYR 102 25.255 30.396 21.181 1.00 0.00 ATOM 824 CZ TYR 102 26.442 30.594 20.497 1.00 0.00 ATOM 825 OH TYR 102 27.611 30.055 20.998 1.00 0.00 ATOM 826 O TYR 102 22.609 28.997 18.170 1.00 0.00 ATOM 827 C TYR 102 21.825 29.910 18.435 1.00 0.00 ATOM 828 N PHE 103 20.824 29.768 19.299 1.00 0.00 ATOM 829 CA PHE 103 20.511 28.471 19.887 1.00 0.00 ATOM 830 CB PHE 103 19.284 28.652 20.771 1.00 0.00 ATOM 831 CG PHE 103 19.015 27.373 21.541 1.00 0.00 ATOM 832 CD1 PHE 103 19.784 27.013 22.644 1.00 0.00 ATOM 833 CD2 PHE 103 18.002 26.573 21.034 1.00 0.00 ATOM 834 CE1 PHE 103 19.521 25.821 23.259 1.00 0.00 ATOM 835 CE2 PHE 103 17.726 25.398 21.656 1.00 0.00 ATOM 836 CZ PHE 103 18.496 25.089 22.722 1.00 0.00 ATOM 837 O PHE 103 20.675 26.330 18.791 1.00 0.00 ATOM 838 C PHE 103 20.204 27.434 18.759 1.00 0.00 ATOM 839 N ARG 104 19.405 27.851 17.772 1.00 0.00 ATOM 840 CA ARG 104 19.055 27.020 16.632 1.00 0.00 ATOM 841 CB ARG 104 18.336 27.978 15.677 1.00 0.00 ATOM 842 CG ARG 104 17.768 27.372 14.402 1.00 0.00 ATOM 843 CD ARG 104 17.114 28.461 13.535 1.00 0.00 ATOM 844 NE ARG 104 17.981 28.936 12.432 1.00 0.00 ATOM 845 CZ ARG 104 18.449 28.215 11.415 1.00 0.00 ATOM 846 NH1 ARG 104 18.259 26.912 11.298 1.00 0.00 ATOM 847 NH2 ARG 104 19.136 28.789 10.447 1.00 0.00 ATOM 848 O ARG 104 20.459 25.350 15.569 1.00 0.00 ATOM 849 C ARG 104 20.318 26.522 15.914 1.00 0.00 ATOM 850 N LYS 105 21.210 27.480 15.719 1.00 0.00 ATOM 851 CA LYS 105 22.454 27.296 14.977 1.00 0.00 ATOM 852 CB LYS 105 23.156 28.654 14.785 1.00 0.00 ATOM 853 CG LYS 105 24.496 28.564 14.068 1.00 0.00 ATOM 854 CD LYS 105 25.210 29.908 14.054 1.00 0.00 ATOM 855 CE LYS 105 26.541 29.807 13.332 1.00 0.00 ATOM 856 NZ LYS 105 27.252 31.117 13.303 1.00 0.00 ATOM 857 O LYS 105 23.851 25.333 15.068 1.00 0.00 ATOM 858 C LYS 105 23.352 26.278 15.681 1.00 0.00 ATOM 859 N LEU 106 23.484 26.499 16.976 1.00 0.00 ATOM 860 CA LEU 106 24.286 25.614 17.811 1.00 0.00 ATOM 861 CB LEU 106 24.276 26.231 19.198 1.00 0.00 ATOM 862 CG LEU 106 25.002 25.398 20.241 1.00 0.00 ATOM 863 CD1 LEU 106 26.472 25.330 19.921 1.00 0.00 ATOM 864 CD2 LEU 106 24.861 26.071 21.588 1.00 0.00 ATOM 865 O LEU 106 24.553 23.265 17.444 1.00 0.00 ATOM 866 C LEU 106 23.776 24.179 17.705 1.00 0.00 ATOM 867 N LEU 107 22.450 24.002 17.746 1.00 0.00 ATOM 868 CA LEU 107 21.853 22.671 17.669 1.00 0.00 ATOM 869 CB LEU 107 20.430 22.736 18.174 1.00 0.00 ATOM 870 CG LEU 107 20.309 23.088 19.642 1.00 0.00 ATOM 871 CD1 LEU 107 18.822 23.107 19.880 1.00 0.00 ATOM 872 CD2 LEU 107 21.003 22.084 20.572 1.00 0.00 ATOM 873 O LEU 107 21.560 20.865 16.146 1.00 0.00 ATOM 874 C LEU 107 21.883 22.032 16.278 1.00 0.00 ATOM 875 N GLY 108 22.071 22.870 15.259 1.00 0.00 ATOM 876 CA GLY 108 22.039 22.436 13.858 1.00 0.00 ATOM 877 O GLY 108 20.366 21.180 12.919 1.00 0.00 ATOM 878 C GLY 108 20.619 22.236 13.449 1.00 0.00 ATOM 879 N PHE 109 19.642 23.061 13.842 1.00 0.00 ATOM 880 CA PHE 109 18.218 22.965 13.499 1.00 0.00 ATOM 881 CB PHE 109 17.502 23.597 14.694 1.00 0.00 ATOM 882 CG PHE 109 15.976 23.419 14.665 1.00 0.00 ATOM 883 CD1 PHE 109 15.333 22.379 15.326 1.00 0.00 ATOM 884 CD2 PHE 109 15.199 24.303 13.929 1.00 0.00 ATOM 885 CE1 PHE 109 13.968 22.215 15.258 1.00 0.00 ATOM 886 CE2 PHE 109 13.829 24.128 13.832 1.00 0.00 ATOM 887 CZ PHE 109 13.216 23.089 14.511 1.00 0.00 ATOM 888 O PHE 109 18.961 24.433 11.751 1.00 0.00 ATOM 889 C PHE 109 17.978 23.826 12.229 1.00 0.00 TER END