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 3 Tue Jun 3 18:30:51 2008 MODEL 3 PARENT 3bs1_A REMARK 7 REMARK 7 ALLPARENTS 3bs1_A ATOM 1 N GLY 1 35.686 24.432 31.110 1.00 0.00 ATOM 2 CA GLY 1 36.619 23.508 31.828 1.00 0.00 ATOM 3 O GLY 1 36.679 22.509 34.017 1.00 0.00 ATOM 4 C GLY 1 35.988 23.060 33.149 1.00 0.00 ATOM 5 N LYS 2 34.671 23.152 33.255 1.00 0.00 ATOM 6 CA LYS 2 33.972 22.769 34.475 1.00 0.00 ATOM 7 CB LYS 2 33.324 24.010 35.081 1.00 0.00 ATOM 8 CG LYS 2 34.313 25.136 35.409 1.00 0.00 ATOM 9 CD LYS 2 35.361 24.793 36.455 1.00 0.00 ATOM 10 CE LYS 2 36.092 26.056 36.867 1.00 0.00 ATOM 11 NZ LYS 2 36.744 25.856 38.151 1.00 0.00 ATOM 12 O LYS 2 32.024 21.659 33.519 1.00 0.00 ATOM 13 C LYS 2 32.968 21.614 34.299 1.00 0.00 ATOM 14 N SER 3 33.324 20.492 34.911 1.00 0.00 ATOM 15 CA SER 3 32.515 19.249 34.814 1.00 0.00 ATOM 16 CB SER 3 33.303 17.952 35.020 1.00 0.00 ATOM 17 OG SER 3 34.332 17.810 34.042 1.00 0.00 ATOM 18 O SER 3 30.328 18.612 35.549 1.00 0.00 ATOM 19 C SER 3 31.350 19.245 35.792 1.00 0.00 ATOM 20 N VAL 4 31.492 20.038 36.849 1.00 0.00 ATOM 21 CA VAL 4 30.470 20.164 37.899 1.00 0.00 ATOM 22 CB VAL 4 30.906 19.442 39.185 1.00 0.00 ATOM 23 CG1 VAL 4 31.052 17.943 38.944 1.00 0.00 ATOM 24 CG2 VAL 4 32.228 19.992 39.725 1.00 0.00 ATOM 25 O VAL 4 30.932 22.537 37.870 1.00 0.00 ATOM 26 C VAL 4 30.140 21.637 38.167 1.00 0.00 ATOM 27 N VAL 5 28.948 21.803 38.709 1.00 0.00 ATOM 28 CA VAL 5 28.402 23.126 39.050 1.00 0.00 ATOM 29 CB VAL 5 27.098 23.413 38.303 1.00 0.00 ATOM 30 CG1 VAL 5 26.538 24.774 38.708 1.00 0.00 ATOM 31 CG2 VAL 5 27.339 23.443 36.801 1.00 0.00 ATOM 32 O VAL 5 27.845 22.071 41.101 1.00 0.00 ATOM 33 C VAL 5 28.115 23.097 40.550 1.00 0.00 ATOM 34 N THR 6 28.511 24.156 41.185 1.00 0.00 ATOM 35 CA THR 6 28.166 24.297 42.625 1.00 0.00 ATOM 36 CB THR 6 29.399 24.667 43.504 1.00 0.00 ATOM 37 CG2 THR 6 30.538 23.604 43.353 1.00 0.00 ATOM 38 OG1 THR 6 29.875 25.978 43.135 1.00 0.00 ATOM 39 O THR 6 26.920 26.347 42.199 1.00 0.00 ATOM 40 C THR 6 26.994 25.260 42.763 1.00 0.00 ATOM 41 N LEU 7 25.927 24.687 43.263 1.00 0.00 ATOM 42 CA LEU 7 24.689 25.425 43.497 1.00 0.00 ATOM 43 CB LEU 7 23.483 24.644 42.900 1.00 0.00 ATOM 44 CG LEU 7 23.595 24.285 41.420 1.00 0.00 ATOM 45 CD1 LEU 7 22.477 23.282 41.033 1.00 0.00 ATOM 46 CD2 LEU 7 23.571 25.610 40.578 1.00 0.00 ATOM 47 O LEU 7 24.587 24.745 45.801 1.00 0.00 ATOM 48 C LEU 7 24.600 25.678 45.009 1.00 0.00 ATOM 49 N LYS 8 24.501 26.953 45.350 1.00 0.00 ATOM 50 CA LYS 8 24.584 27.388 46.763 1.00 0.00 ATOM 51 CB LYS 8 25.617 28.513 46.814 1.00 0.00 ATOM 52 CG LYS 8 25.734 29.205 48.182 1.00 0.00 ATOM 53 CD LYS 8 26.446 30.561 48.099 1.00 0.00 ATOM 54 CE LYS 8 25.737 31.523 47.149 1.00 0.00 ATOM 55 NZ LYS 8 25.774 32.896 47.666 1.00 0.00 ATOM 56 O LYS 8 22.630 28.801 46.840 1.00 0.00 ATOM 57 C LYS 8 23.230 27.837 47.332 1.00 0.00 ATOM 58 N THR 9 23.026 27.437 48.578 1.00 0.00 ATOM 59 CA THR 9 21.846 27.891 49.349 1.00 0.00 ATOM 60 CB THR 9 20.810 26.778 49.583 1.00 0.00 ATOM 61 CG2 THR 9 19.574 27.309 50.319 1.00 0.00 ATOM 62 OG1 THR 9 20.362 26.325 48.316 1.00 0.00 ATOM 63 O THR 9 22.692 27.435 51.479 1.00 0.00 ATOM 64 C THR 9 22.373 28.310 50.699 1.00 0.00 ATOM 65 N THR 10 22.500 29.630 50.874 1.00 0.00 ATOM 66 CA THR 10 23.141 30.208 52.080 1.00 0.00 ATOM 67 CB THR 10 22.390 29.879 53.391 1.00 0.00 ATOM 68 CG2 THR 10 20.940 30.251 53.195 1.00 0.00 ATOM 69 OG1 THR 10 22.397 28.498 53.735 1.00 0.00 ATOM 70 O THR 10 25.270 29.815 51.081 1.00 0.00 ATOM 71 C THR 10 24.594 29.731 52.109 1.00 0.00 ATOM 72 N ASP 11 25.033 29.194 53.229 1.00 0.00 ATOM 73 CA ASP 11 26.353 28.575 53.375 1.00 0.00 ATOM 74 CB ASP 11 26.746 28.686 54.839 1.00 0.00 ATOM 75 CG ASP 11 25.863 27.902 55.820 1.00 0.00 ATOM 76 OD1 ASP 11 24.834 27.327 55.403 1.00 0.00 ATOM 77 OD2 ASP 11 26.146 28.098 57.011 1.00 0.00 ATOM 78 O ASP 11 27.505 26.525 52.843 1.00 0.00 ATOM 79 C ASP 11 26.413 27.116 52.894 1.00 0.00 ATOM 80 N GLY 12 25.258 26.546 52.543 1.00 0.00 ATOM 81 CA GLY 12 25.126 25.189 51.986 1.00 0.00 ATOM 82 O GLY 12 25.115 26.077 49.759 1.00 0.00 ATOM 83 C GLY 12 25.479 25.168 50.515 1.00 0.00 ATOM 84 N TRP 13 26.177 24.111 50.132 1.00 0.00 ATOM 85 CA TRP 13 26.492 23.861 48.711 1.00 0.00 ATOM 86 CB TRP 13 28.010 23.855 48.555 1.00 0.00 ATOM 87 CG TRP 13 28.612 25.195 48.756 1.00 0.00 ATOM 88 CD1 TRP 13 29.158 25.685 49.909 1.00 0.00 ATOM 89 CD2 TRP 13 28.671 26.255 47.802 1.00 0.00 ATOM 90 CE2 TRP 13 29.282 27.350 48.430 1.00 0.00 ATOM 91 CE3 TRP 13 28.288 26.379 46.464 1.00 0.00 ATOM 92 NE1 TRP 13 29.565 26.978 49.718 1.00 0.00 ATOM 93 CZ2 TRP 13 29.511 28.547 47.783 1.00 0.00 ATOM 94 CZ3 TRP 13 28.507 27.576 45.813 1.00 0.00 ATOM 95 CH2 TRP 13 29.130 28.650 46.470 1.00 0.00 ATOM 96 O TRP 13 26.158 21.513 49.040 1.00 0.00 ATOM 97 C TRP 13 26.033 22.471 48.280 1.00 0.00 ATOM 98 N ILE 14 25.546 22.400 47.053 1.00 0.00 ATOM 99 CA ILE 14 25.289 21.108 46.399 1.00 0.00 ATOM 100 CB ILE 14 23.756 20.676 46.507 1.00 0.00 ATOM 101 CG1 ILE 14 22.901 21.730 45.804 1.00 0.00 ATOM 102 CG2 ILE 14 23.321 20.475 47.951 1.00 0.00 ATOM 103 CD1 ILE 14 21.453 21.296 45.646 1.00 0.00 ATOM 104 O ILE 14 25.714 21.921 44.186 1.00 0.00 ATOM 105 C ILE 14 25.984 21.082 45.036 1.00 0.00 ATOM 106 N PRO 15 26.933 20.159 44.884 1.00 0.00 ATOM 107 CA PRO 15 27.587 19.956 43.587 1.00 0.00 ATOM 108 CB PRO 15 28.810 19.092 43.941 1.00 0.00 ATOM 109 CG PRO 15 28.908 19.080 45.428 1.00 0.00 ATOM 110 CD PRO 15 27.554 19.364 45.955 1.00 0.00 ATOM 111 O PRO 15 26.180 18.047 43.128 1.00 0.00 ATOM 112 C PRO 15 26.691 19.091 42.733 1.00 0.00 ATOM 113 N VAL 16 26.518 19.564 41.524 1.00 0.00 ATOM 114 CA VAL 16 25.685 18.828 40.578 1.00 0.00 ATOM 115 CB VAL 16 24.257 19.488 40.480 1.00 0.00 ATOM 116 CG1 VAL 16 23.611 19.609 41.849 1.00 0.00 ATOM 117 CG2 VAL 16 24.416 20.857 39.843 1.00 0.00 ATOM 118 O VAL 16 27.191 19.529 38.867 1.00 0.00 ATOM 119 C VAL 16 26.516 18.604 39.320 1.00 0.00 ATOM 120 N PRO 17 26.497 17.371 38.829 1.00 0.00 ATOM 121 CA PRO 17 27.187 17.081 37.569 1.00 0.00 ATOM 122 CB PRO 17 26.944 15.590 37.398 1.00 0.00 ATOM 123 CG PRO 17 26.707 15.035 38.797 1.00 0.00 ATOM 124 CD PRO 17 25.928 16.163 39.454 1.00 0.00 ATOM 125 O PRO 17 25.329 18.262 36.609 1.00 0.00 ATOM 126 C PRO 17 26.511 17.923 36.470 1.00 0.00 ATOM 127 N PHE 18 27.310 18.388 35.521 1.00 0.00 ATOM 128 CA PHE 18 26.840 19.327 34.467 1.00 0.00 ATOM 129 CB PHE 18 27.953 19.644 33.462 1.00 0.00 ATOM 130 CG PHE 18 28.630 21.003 33.661 1.00 0.00 ATOM 131 CD1 PHE 18 29.145 21.395 34.881 1.00 0.00 ATOM 132 CD2 PHE 18 28.734 21.889 32.598 1.00 0.00 ATOM 133 CE1 PHE 18 29.733 22.637 35.024 1.00 0.00 ATOM 134 CE2 PHE 18 29.227 23.171 32.778 1.00 0.00 ATOM 135 CZ PHE 18 29.733 23.525 33.991 1.00 0.00 ATOM 136 O PHE 18 24.600 19.386 33.561 1.00 0.00 ATOM 137 C PHE 18 25.656 18.723 33.704 1.00 0.00 ATOM 138 N SER 19 25.800 17.498 33.209 1.00 0.00 ATOM 139 CA SER 19 24.695 16.894 32.472 1.00 0.00 ATOM 140 CB SER 19 25.259 15.641 31.776 1.00 0.00 ATOM 141 OG SER 19 25.658 14.656 32.696 1.00 0.00 ATOM 142 O SER 19 22.415 16.303 32.681 1.00 0.00 ATOM 143 C SER 19 23.444 16.591 33.292 1.00 0.00 ATOM 144 N LYS 20 23.535 16.559 34.617 1.00 0.00 ATOM 145 CA LYS 20 22.377 16.282 35.466 1.00 0.00 ATOM 146 CB LYS 20 22.874 15.233 36.555 1.00 0.00 ATOM 147 CG LYS 20 21.852 14.915 37.647 1.00 0.00 ATOM 148 CD LYS 20 21.487 13.428 37.735 1.00 0.00 ATOM 149 CE LYS 20 20.420 13.017 36.722 1.00 0.00 ATOM 150 NZ LYS 20 20.860 13.172 35.305 1.00 0.00 ATOM 151 O LYS 20 20.417 17.523 36.106 1.00 0.00 ATOM 152 C LYS 20 21.516 17.567 35.572 1.00 0.00 ATOM 153 N VAL 21 21.881 18.572 34.768 1.00 0.00 ATOM 154 CA VAL 21 21.117 19.826 34.644 1.00 0.00 ATOM 155 CB VAL 21 21.953 21.027 35.122 1.00 0.00 ATOM 156 CG1 VAL 21 21.157 22.326 35.179 1.00 0.00 ATOM 157 CG2 VAL 21 22.590 20.772 36.504 1.00 0.00 ATOM 158 O VAL 21 21.271 20.346 32.346 1.00 0.00 ATOM 159 C VAL 21 20.521 19.961 33.247 1.00 0.00 ATOM 160 N MET 22 19.213 20.176 33.268 1.00 0.00 ATOM 161 CA MET 22 18.451 20.461 32.043 1.00 0.00 ATOM 162 CB MET 22 16.962 20.179 32.244 1.00 0.00 ATOM 163 CG MET 22 16.695 18.705 32.578 1.00 0.00 ATOM 164 SD MET 22 17.099 17.587 31.181 1.00 0.00 ATOM 165 CE MET 22 16.961 16.032 32.037 1.00 0.00 ATOM 166 O MET 22 19.098 22.268 30.555 1.00 0.00 ATOM 167 C MET 22 18.634 21.942 31.644 1.00 0.00 ATOM 168 N TYR 23 18.310 22.804 32.604 1.00 0.00 ATOM 169 CA TYR 23 18.411 24.260 32.430 1.00 0.00 ATOM 170 CB TYR 23 17.264 24.807 31.564 1.00 0.00 ATOM 171 CG TYR 23 15.900 24.654 32.229 1.00 0.00 ATOM 172 CD1 TYR 23 15.405 25.681 33.022 1.00 0.00 ATOM 173 CD2 TYR 23 15.165 23.490 32.038 1.00 0.00 ATOM 174 CE1 TYR 23 14.169 25.558 33.617 1.00 0.00 ATOM 175 CE2 TYR 23 13.922 23.359 32.623 1.00 0.00 ATOM 176 CZ TYR 23 13.442 24.404 33.407 1.00 0.00 ATOM 177 OH TYR 23 12.266 24.291 34.037 1.00 0.00 ATOM 178 O TYR 23 18.315 24.334 34.838 1.00 0.00 ATOM 179 C TYR 23 18.440 24.971 33.791 1.00 0.00 ATOM 180 N LEU 24 18.830 26.238 33.731 1.00 0.00 ATOM 181 CA LEU 24 18.745 27.159 34.873 1.00 0.00 ATOM 182 CB LEU 24 20.129 27.769 35.160 1.00 0.00 ATOM 183 CG LEU 24 20.086 28.872 36.232 1.00 0.00 ATOM 184 CD1 LEU 24 19.587 28.294 37.551 1.00 0.00 ATOM 185 CD2 LEU 24 21.468 29.502 36.409 1.00 0.00 ATOM 186 O LEU 24 17.852 28.914 33.486 1.00 0.00 ATOM 187 C LEU 24 17.811 28.332 34.575 1.00 0.00 ATOM 188 N GLU 25 16.905 28.604 35.481 1.00 0.00 ATOM 189 CA GLU 25 15.990 29.739 35.303 1.00 0.00 ATOM 190 CB GLU 25 14.547 29.267 35.158 1.00 0.00 ATOM 191 CG GLU 25 13.973 28.558 36.405 1.00 0.00 ATOM 192 CD GLU 25 12.542 28.045 36.204 1.00 0.00 ATOM 193 OE1 GLU 25 12.010 28.167 35.088 1.00 0.00 ATOM 194 OE2 GLU 25 11.966 27.555 37.205 1.00 0.00 ATOM 195 O GLU 25 16.434 30.279 37.615 1.00 0.00 ATOM 196 C GLU 25 16.085 30.692 36.509 1.00 0.00 ATOM 197 N ALA 26 15.824 31.962 36.238 1.00 0.00 ATOM 198 CA ALA 26 15.675 32.934 37.325 1.00 0.00 ATOM 199 CB ALA 26 15.912 34.359 36.824 1.00 0.00 ATOM 200 O ALA 26 13.273 32.694 37.240 1.00 0.00 ATOM 201 C ALA 26 14.280 32.827 37.933 1.00 0.00 ATOM 202 N LYS 27 14.254 32.922 39.251 1.00 0.00 ATOM 203 CA LYS 27 12.999 33.029 39.993 1.00 0.00 ATOM 204 CB LYS 27 12.093 31.803 40.038 1.00 0.00 ATOM 205 CG LYS 27 10.957 32.067 39.037 1.00 0.00 ATOM 206 CD LYS 27 10.265 33.420 39.299 1.00 0.00 ATOM 207 CE LYS 27 9.044 33.678 38.437 1.00 0.00 ATOM 208 NZ LYS 27 8.130 32.535 38.412 1.00 0.00 ATOM 209 O LYS 27 13.898 33.444 42.172 1.00 0.00 ATOM 210 C LYS 27 13.210 33.870 41.243 1.00 0.00 ATOM 211 N ASP 28 12.419 34.913 41.293 1.00 0.00 ATOM 212 CA ASP 28 12.506 35.786 42.460 1.00 0.00 ATOM 213 CB ASP 28 11.298 35.769 43.316 1.00 0.00 ATOM 214 CG ASP 28 10.161 36.514 42.640 1.00 0.00 ATOM 215 OD1 ASP 28 10.477 37.375 41.793 1.00 0.00 ATOM 216 OD2 ASP 28 8.988 36.215 42.942 1.00 0.00 ATOM 217 O ASP 28 14.412 36.083 43.876 1.00 0.00 ATOM 218 C ASP 28 13.949 36.168 42.732 1.00 0.00 ATOM 219 N LYS 29 14.709 36.487 41.648 1.00 0.00 ATOM 220 CA LYS 29 16.100 36.904 41.732 1.00 0.00 ATOM 221 CB LYS 29 16.230 37.951 42.806 1.00 0.00 ATOM 222 CG LYS 29 15.408 39.178 42.426 1.00 0.00 ATOM 223 CD LYS 29 15.167 40.119 43.572 1.00 0.00 ATOM 224 CE LYS 29 14.337 41.298 43.031 1.00 0.00 ATOM 225 NZ LYS 29 13.780 42.091 44.123 1.00 0.00 ATOM 226 O LYS 29 18.252 35.920 42.080 1.00 0.00 ATOM 227 C LYS 29 17.039 35.814 42.255 1.00 0.00 ATOM 228 N LYS 30 16.534 34.703 42.752 1.00 0.00 ATOM 229 CA LYS 30 17.329 33.517 43.046 1.00 0.00 ATOM 230 CB LYS 30 16.761 32.788 44.266 1.00 0.00 ATOM 231 CG LYS 30 16.879 33.641 45.519 1.00 0.00 ATOM 232 CD LYS 30 16.065 33.050 46.662 1.00 0.00 ATOM 233 CE LYS 30 16.389 33.741 47.972 1.00 0.00 ATOM 234 NZ LYS 30 17.710 33.274 48.396 1.00 0.00 ATOM 235 O LYS 30 16.561 33.169 40.811 1.00 0.00 ATOM 236 C LYS 30 17.137 32.682 41.781 1.00 0.00 ATOM 237 N THR 31 17.909 31.613 41.645 1.00 0.00 ATOM 238 CA THR 31 17.790 30.775 40.452 1.00 0.00 ATOM 239 CB THR 31 19.082 30.710 39.620 1.00 0.00 ATOM 240 CG2 THR 31 19.626 32.091 39.261 1.00 0.00 ATOM 241 OG1 THR 31 20.076 29.972 40.317 1.00 0.00 ATOM 242 O THR 31 17.944 28.778 41.770 1.00 0.00 ATOM 243 C THR 31 17.390 29.347 40.824 1.00 0.00 ATOM 244 N TYR 32 16.619 28.739 39.945 1.00 0.00 ATOM 245 CA TYR 32 16.244 27.336 40.098 1.00 0.00 ATOM 246 CB TYR 32 14.722 27.175 40.119 1.00 0.00 ATOM 247 CG TYR 32 13.968 27.667 41.369 1.00 0.00 ATOM 248 CD1 TYR 32 13.821 29.031 41.637 1.00 0.00 ATOM 249 CD2 TYR 32 13.234 26.776 42.138 1.00 0.00 ATOM 250 CE1 TYR 32 12.995 29.482 42.658 1.00 0.00 ATOM 251 CE2 TYR 32 12.389 27.216 43.151 1.00 0.00 ATOM 252 CZ TYR 32 12.274 28.578 43.412 1.00 0.00 ATOM 253 OH TYR 32 11.468 29.011 44.415 1.00 0.00 ATOM 254 O TYR 32 16.826 26.838 37.782 1.00 0.00 ATOM 255 C TYR 32 16.918 26.523 38.973 1.00 0.00 ATOM 256 N VAL 33 17.704 25.552 39.409 1.00 0.00 ATOM 257 CA VAL 33 18.282 24.560 38.492 1.00 0.00 ATOM 258 CB VAL 33 19.622 24.027 39.000 1.00 0.00 ATOM 259 CG1 VAL 33 20.191 22.928 38.103 1.00 0.00 ATOM 260 CG2 VAL 33 20.614 25.173 38.981 1.00 0.00 ATOM 261 O VAL 33 16.808 22.878 39.361 1.00 0.00 ATOM 262 C VAL 33 17.250 23.447 38.360 1.00 0.00 ATOM 263 N ASN 34 16.935 23.167 37.111 1.00 0.00 ATOM 264 CA ASN 34 16.026 22.075 36.762 1.00 0.00 ATOM 265 CB ASN 34 15.140 22.463 35.588 1.00 0.00 ATOM 266 CG ASN 34 14.171 21.333 35.240 1.00 0.00 ATOM 267 ND2 ASN 34 12.950 21.680 34.987 1.00 0.00 ATOM 268 OD1 ASN 34 14.477 20.156 35.210 1.00 0.00 ATOM 269 O ASN 34 17.501 20.869 35.302 1.00 0.00 ATOM 270 C ASN 34 16.892 20.880 36.371 1.00 0.00 ATOM 271 N ALA 35 16.910 19.894 37.256 1.00 0.00 ATOM 272 CA ALA 35 17.631 18.635 37.007 1.00 0.00 ATOM 273 CB ALA 35 18.241 18.152 38.333 1.00 0.00 ATOM 274 O ALA 35 15.482 17.874 36.224 1.00 0.00 ATOM 275 C ALA 35 16.665 17.601 36.421 1.00 0.00 ATOM 276 N GLU 36 17.173 16.389 36.166 1.00 0.00 ATOM 277 CA GLU 36 16.365 15.271 35.625 1.00 0.00 ATOM 278 CB GLU 36 17.091 13.930 35.810 1.00 0.00 ATOM 279 CG GLU 36 16.407 12.714 35.177 1.00 0.00 ATOM 280 CD GLU 36 17.253 11.437 35.295 1.00 0.00 ATOM 281 OE1 GLU 36 18.332 11.466 35.909 1.00 0.00 ATOM 282 OE2 GLU 36 16.804 10.426 34.713 1.00 0.00 ATOM 283 O GLU 36 13.987 15.518 35.794 1.00 0.00 ATOM 284 C GLU 36 15.030 15.181 36.357 1.00 0.00 ATOM 285 N GLU 37 15.083 14.888 37.652 1.00 0.00 ATOM 286 CA GLU 37 13.858 14.777 38.464 1.00 0.00 ATOM 287 CB GLU 37 13.820 13.287 38.793 1.00 0.00 ATOM 288 CG GLU 37 13.558 12.369 37.601 1.00 0.00 ATOM 289 CD GLU 37 13.530 10.886 37.994 1.00 0.00 ATOM 290 OE1 GLU 37 13.763 10.544 39.173 1.00 0.00 ATOM 291 OE2 GLU 37 13.358 10.086 37.056 1.00 0.00 ATOM 292 O GLU 37 13.025 15.431 40.660 1.00 0.00 ATOM 293 C GLU 37 13.838 15.605 39.757 1.00 0.00 ATOM 294 N LEU 38 14.664 16.639 39.810 1.00 0.00 ATOM 295 CA LEU 38 14.776 17.485 41.008 1.00 0.00 ATOM 296 CB LEU 38 15.951 17.007 41.877 1.00 0.00 ATOM 297 CG LEU 38 15.768 15.635 42.503 1.00 0.00 ATOM 298 CD1 LEU 38 17.100 15.209 43.104 1.00 0.00 ATOM 299 CD2 LEU 38 14.725 15.693 43.622 1.00 0.00 ATOM 300 O LEU 38 15.808 19.187 39.712 1.00 0.00 ATOM 301 C LEU 38 15.027 18.929 40.628 1.00 0.00 ATOM 302 N THR 39 14.602 19.819 41.509 1.00 0.00 ATOM 303 CA THR 39 14.849 21.255 41.316 1.00 0.00 ATOM 304 CB THR 39 13.544 22.000 40.997 1.00 0.00 ATOM 305 CG2 THR 39 12.499 21.879 42.108 1.00 0.00 ATOM 306 OG1 THR 39 13.865 23.364 40.773 1.00 0.00 ATOM 307 O THR 39 15.195 21.569 43.670 1.00 0.00 ATOM 308 C THR 39 15.587 21.815 42.527 1.00 0.00 ATOM 309 N GLY 40 16.662 22.556 42.279 1.00 0.00 ATOM 310 CA GLY 40 17.454 23.146 43.368 1.00 0.00 ATOM 311 O GLY 40 17.925 25.235 42.271 1.00 0.00 ATOM 312 C GLY 40 17.512 24.677 43.288 1.00 0.00 ATOM 313 N THR 41 17.050 25.347 44.339 1.00 0.00 ATOM 314 CA THR 41 17.062 26.805 44.371 1.00 0.00 ATOM 315 CB THR 41 15.897 27.254 45.242 1.00 0.00 ATOM 316 CG2 THR 41 15.681 28.768 45.176 1.00 0.00 ATOM 317 OG1 THR 41 14.715 26.523 44.884 1.00 0.00 ATOM 318 O THR 41 18.705 26.973 46.109 1.00 0.00 ATOM 319 C THR 41 18.404 27.262 44.951 1.00 0.00 ATOM 320 N HIS 42 19.089 28.151 44.238 1.00 0.00 ATOM 321 CA HIS 42 20.377 28.656 44.698 1.00 0.00 ATOM 322 CB HIS 42 21.431 27.729 44.087 1.00 0.00 ATOM 323 CG HIS 42 21.256 26.290 44.584 1.00 0.00 ATOM 324 CD2 HIS 42 20.682 25.278 43.949 1.00 0.00 ATOM 325 ND1 HIS 42 21.711 25.822 45.738 1.00 0.00 ATOM 326 CE1 HIS 42 21.439 24.521 45.808 1.00 0.00 ATOM 327 NE2 HIS 42 20.838 24.178 44.679 1.00 0.00 ATOM 328 O HIS 42 19.973 30.721 43.490 1.00 0.00 ATOM 329 C HIS 42 20.665 30.111 44.301 1.00 0.00 ATOM 330 N LYS 43 21.601 30.716 45.024 1.00 0.00 ATOM 331 CA LYS 43 22.034 32.095 44.724 1.00 0.00 ATOM 332 CB LYS 43 22.324 32.817 46.079 1.00 0.00 ATOM 333 CG LYS 43 22.526 34.308 45.961 1.00 0.00 ATOM 334 CD LYS 43 22.915 34.909 47.356 1.00 0.00 ATOM 335 CE LYS 43 21.678 35.330 48.101 1.00 0.00 ATOM 336 NZ LYS 43 22.000 35.704 49.506 1.00 0.00 ATOM 337 O LYS 43 24.197 31.506 43.881 1.00 0.00 ATOM 338 C LYS 43 23.101 32.017 43.645 1.00 0.00 ATOM 339 N TYR 44 22.783 32.524 42.457 1.00 0.00 ATOM 340 CA TYR 44 23.731 32.505 41.350 1.00 0.00 ATOM 341 CB TYR 44 23.563 31.115 40.728 1.00 0.00 ATOM 342 CG TYR 44 24.830 30.682 39.995 1.00 0.00 ATOM 343 CD1 TYR 44 25.842 30.060 40.709 1.00 0.00 ATOM 344 CD2 TYR 44 24.916 30.764 38.628 1.00 0.00 ATOM 345 CE1 TYR 44 26.927 29.522 40.039 1.00 0.00 ATOM 346 CE2 TYR 44 26.007 30.232 37.977 1.00 0.00 ATOM 347 CZ TYR 44 27.009 29.597 38.669 1.00 0.00 ATOM 348 OH TYR 44 27.969 28.914 38.012 1.00 0.00 ATOM 349 O TYR 44 22.443 34.363 40.518 1.00 0.00 ATOM 350 C TYR 44 23.355 33.568 40.323 1.00 0.00 ATOM 351 N SER 45 24.128 33.576 39.249 1.00 0.00 ATOM 352 CA SER 45 23.825 34.371 38.059 1.00 0.00 ATOM 353 CB SER 45 24.689 35.632 38.014 1.00 0.00 ATOM 354 OG SER 45 24.386 36.379 36.851 1.00 0.00 ATOM 355 O SER 45 24.993 32.804 36.616 1.00 0.00 ATOM 356 C SER 45 24.029 33.533 36.799 1.00 0.00 ATOM 357 N LEU 46 23.131 33.821 35.884 1.00 0.00 ATOM 358 CA LEU 46 22.971 33.124 34.599 1.00 0.00 ATOM 359 CB LEU 46 21.668 33.713 34.014 1.00 0.00 ATOM 360 CG LEU 46 20.607 34.274 35.004 1.00 0.00 ATOM 361 CD1 LEU 46 19.356 34.782 34.293 1.00 0.00 ATOM 362 CD2 LEU 46 20.137 33.243 36.028 1.00 0.00 ATOM 363 O LEU 46 24.635 32.407 32.986 1.00 0.00 ATOM 364 C LEU 46 24.212 33.322 33.680 1.00 0.00 ATOM 365 N GLN 47 24.919 34.428 33.922 1.00 0.00 ATOM 366 CA GLN 47 26.164 34.772 33.206 1.00 0.00 ATOM 367 CB GLN 47 26.614 36.197 33.514 1.00 0.00 ATOM 368 CG GLN 47 25.683 37.241 32.903 1.00 0.00 ATOM 369 CD GLN 47 26.131 38.637 33.319 1.00 0.00 ATOM 370 OE1 GLN 47 26.916 38.932 34.206 1.00 0.00 ATOM 371 NE2 GLN 47 25.476 39.593 32.732 1.00 0.00 ATOM 372 O GLN 47 27.990 33.292 32.769 1.00 0.00 ATOM 373 C GLN 47 27.302 33.847 33.615 1.00 0.00 ATOM 374 N GLU 48 27.503 33.677 34.924 1.00 0.00 ATOM 375 CA GLU 48 28.563 32.824 35.445 1.00 0.00 ATOM 376 CB GLU 48 28.548 32.837 36.961 1.00 0.00 ATOM 377 CG GLU 48 28.905 34.210 37.564 1.00 0.00 ATOM 378 CD GLU 48 28.835 34.157 39.094 1.00 0.00 ATOM 379 OE1 GLU 48 28.275 33.149 39.587 1.00 0.00 ATOM 380 OE2 GLU 48 29.171 35.171 39.756 1.00 0.00 ATOM 381 O GLU 48 29.389 30.752 34.510 1.00 0.00 ATOM 382 C GLU 48 28.430 31.370 34.964 1.00 0.00 ATOM 383 N PHE 49 27.191 30.881 34.956 1.00 0.00 ATOM 384 CA PHE 49 26.872 29.505 34.527 1.00 0.00 ATOM 385 CB PHE 49 25.381 29.235 34.772 1.00 0.00 ATOM 386 CG PHE 49 25.093 27.740 34.889 1.00 0.00 ATOM 387 CD1 PHE 49 25.283 27.062 36.095 1.00 0.00 ATOM 388 CD2 PHE 49 24.530 27.096 33.807 1.00 0.00 ATOM 389 CE1 PHE 49 24.905 25.727 36.176 1.00 0.00 ATOM 390 CE2 PHE 49 24.158 25.773 33.932 1.00 0.00 ATOM 391 CZ PHE 49 24.351 25.079 35.091 1.00 0.00 ATOM 392 O PHE 49 27.895 28.317 32.719 1.00 0.00 ATOM 393 C PHE 49 27.211 29.280 33.043 1.00 0.00 ATOM 394 N GLU 50 26.831 30.238 32.207 1.00 0.00 ATOM 395 CA GLU 50 27.150 30.205 30.766 1.00 0.00 ATOM 396 CB GLU 50 26.594 31.451 30.076 1.00 0.00 ATOM 397 CG GLU 50 27.002 31.624 28.613 1.00 0.00 ATOM 398 CD GLU 50 26.616 32.990 28.018 1.00 0.00 ATOM 399 OE1 GLU 50 26.625 34.040 28.741 1.00 0.00 ATOM 400 OE2 GLU 50 26.331 33.021 26.795 1.00 0.00 ATOM 401 O GLU 50 29.150 29.219 29.849 1.00 0.00 ATOM 402 C GLU 50 28.667 30.085 30.593 1.00 0.00 ATOM 403 N TYR 51 29.426 30.843 31.432 1.00 0.00 ATOM 404 CA TYR 51 30.885 30.911 31.285 1.00 0.00 ATOM 405 CB TYR 51 31.451 32.085 32.083 1.00 0.00 ATOM 406 CG TYR 51 30.977 33.438 31.554 1.00 0.00 ATOM 407 CD1 TYR 51 30.376 33.588 30.308 1.00 0.00 ATOM 408 CD2 TYR 51 31.152 34.544 32.375 1.00 0.00 ATOM 409 CE1 TYR 51 29.948 34.824 29.877 1.00 0.00 ATOM 410 CE2 TYR 51 30.725 35.782 31.943 1.00 0.00 ATOM 411 CZ TYR 51 30.142 35.922 30.701 1.00 0.00 ATOM 412 OH TYR 51 30.085 37.183 30.230 1.00 0.00 ATOM 413 O TYR 51 32.793 29.461 31.452 1.00 0.00 ATOM 414 C TYR 51 31.618 29.649 31.724 1.00 0.00 ATOM 415 N LEU 52 30.902 28.824 32.464 1.00 0.00 ATOM 416 CA LEU 52 31.485 27.608 33.049 1.00 0.00 ATOM 417 CB LEU 52 30.390 26.962 33.879 1.00 0.00 ATOM 418 CG LEU 52 30.133 27.585 35.230 1.00 0.00 ATOM 419 CD1 LEU 52 28.972 26.841 35.899 1.00 0.00 ATOM 420 CD2 LEU 52 31.418 27.456 36.052 1.00 0.00 ATOM 421 O LEU 52 33.081 26.140 32.030 1.00 0.00 ATOM 422 C LEU 52 31.949 26.612 31.987 1.00 0.00 ATOM 423 N LEU 53 31.100 26.335 31.041 1.00 0.00 ATOM 424 CA LEU 53 31.413 25.374 29.987 1.00 0.00 ATOM 425 CB LEU 53 30.144 25.075 29.218 1.00 0.00 ATOM 426 CG LEU 53 29.541 23.832 29.825 1.00 0.00 ATOM 427 CD1 LEU 53 28.247 23.595 29.151 1.00 0.00 ATOM 428 CD2 LEU 53 30.317 22.538 29.642 1.00 0.00 ATOM 429 O LEU 53 32.225 27.030 28.510 1.00 0.00 ATOM 430 C LEU 53 32.380 25.898 28.949 1.00 0.00 ATOM 431 N PRO 54 33.283 25.052 28.458 1.00 0.00 ATOM 432 CA PRO 54 34.128 25.443 27.328 1.00 0.00 ATOM 433 CB PRO 54 35.200 24.380 27.340 1.00 0.00 ATOM 434 CG PRO 54 34.446 23.100 27.672 1.00 0.00 ATOM 435 CD PRO 54 33.430 23.599 28.709 1.00 0.00 ATOM 436 O PRO 54 32.263 24.620 26.031 1.00 0.00 ATOM 437 C PRO 54 33.249 25.372 26.074 1.00 0.00 ATOM 438 N LYS 55 33.607 26.186 25.089 1.00 0.00 ATOM 439 CA LYS 55 32.909 26.204 23.782 1.00 0.00 ATOM 440 CB LYS 55 33.213 24.833 23.105 1.00 0.00 ATOM 441 CG LYS 55 34.713 24.584 22.753 1.00 0.00 ATOM 442 CD LYS 55 35.177 25.506 21.587 1.00 0.00 ATOM 443 CE LYS 55 34.362 25.144 20.320 1.00 0.00 ATOM 444 NZ LYS 55 35.072 25.347 18.963 1.00 0.00 ATOM 445 O LYS 55 30.826 26.635 22.772 1.00 0.00 ATOM 446 C LYS 55 31.467 26.649 23.847 1.00 0.00 ATOM 447 N ASP 56 30.866 26.876 24.983 1.00 0.00 ATOM 448 CA ASP 56 29.471 27.307 25.114 1.00 0.00 ATOM 449 CB ASP 56 29.127 28.303 24.065 1.00 0.00 ATOM 450 CG ASP 56 29.636 29.655 24.527 1.00 0.00 ATOM 451 OD1 ASP 56 29.508 29.954 25.732 1.00 0.00 ATOM 452 OD2 ASP 56 30.156 30.418 23.686 1.00 0.00 ATOM 453 O ASP 56 27.797 26.047 23.987 1.00 0.00 ATOM 454 C ASP 56 28.476 26.165 24.997 1.00 0.00 ATOM 455 N SER 57 28.182 25.415 26.150 1.00 0.00 ATOM 456 CA SER 57 27.184 24.337 26.176 1.00 0.00 ATOM 457 CB SER 57 27.059 22.822 26.471 1.00 0.00 ATOM 458 OG SER 57 27.997 22.048 25.749 1.00 0.00 ATOM 459 O SER 57 24.896 24.948 26.512 1.00 0.00 ATOM 460 C SER 57 26.039 24.992 26.967 1.00 0.00 ATOM 461 N PHE 58 26.386 25.846 27.917 1.00 0.00 ATOM 462 CA PHE 58 25.372 26.588 28.692 1.00 0.00 ATOM 463 CB PHE 58 25.713 26.581 30.186 1.00 0.00 ATOM 464 CG PHE 58 25.378 25.214 30.827 1.00 0.00 ATOM 465 CD1 PHE 58 26.342 24.367 31.308 1.00 0.00 ATOM 466 CD2 PHE 58 24.071 24.783 30.950 1.00 0.00 ATOM 467 CE1 PHE 58 25.995 23.129 31.830 1.00 0.00 ATOM 468 CE2 PHE 58 23.743 23.566 31.548 1.00 0.00 ATOM 469 CZ PHE 58 24.708 22.714 31.996 1.00 0.00 ATOM 470 O PHE 58 26.120 28.727 27.924 1.00 0.00 ATOM 471 C PHE 58 25.172 27.966 28.047 1.00 0.00 ATOM 472 N ILE 59 24.026 28.091 27.381 1.00 0.00 ATOM 473 CA ILE 59 23.709 29.241 26.506 1.00 0.00 ATOM 474 CB ILE 59 23.323 28.767 25.075 1.00 0.00 ATOM 475 CG1 ILE 59 24.378 27.802 24.520 1.00 0.00 ATOM 476 CG2 ILE 59 23.141 29.961 24.146 1.00 0.00 ATOM 477 CD1 ILE 59 25.775 28.391 24.439 1.00 0.00 ATOM 478 O ILE 59 21.541 29.540 27.523 1.00 0.00 ATOM 479 C ILE 59 22.577 30.069 27.106 1.00 0.00 ATOM 480 N ARG 60 22.760 31.378 26.999 1.00 0.00 ATOM 481 CA ARG 60 21.726 32.358 27.384 1.00 0.00 ATOM 482 CB ARG 60 22.501 33.601 28.010 1.00 0.00 ATOM 483 CG ARG 60 21.919 34.854 28.472 1.00 0.00 ATOM 484 CD ARG 60 22.852 35.995 28.544 1.00 0.00 ATOM 485 NE ARG 60 23.229 36.713 27.336 1.00 0.00 ATOM 486 CZ ARG 60 24.453 36.806 26.786 1.00 0.00 ATOM 487 NH1 ARG 60 25.531 36.268 27.292 1.00 0.00 ATOM 488 NH2 ARG 60 24.550 37.490 25.659 1.00 0.00 ATOM 489 O ARG 60 20.742 33.420 25.451 1.00 0.00 ATOM 490 C ARG 60 20.703 32.480 26.244 1.00 0.00 ATOM 491 N CYS 61 19.652 31.673 26.329 1.00 0.00 ATOM 492 CA CYS 61 18.594 31.691 25.295 1.00 0.00 ATOM 493 CB CYS 61 17.911 30.327 25.260 1.00 0.00 ATOM 494 SG CYS 61 16.966 30.018 26.793 1.00 0.00 ATOM 495 O CYS 61 16.925 33.292 24.571 1.00 0.00 ATOM 496 C CYS 61 17.601 32.849 25.488 1.00 0.00 ATOM 497 N HIS 62 17.515 33.308 26.734 1.00 0.00 ATOM 498 CA HIS 62 16.553 34.332 27.165 1.00 0.00 ATOM 499 CB HIS 62 15.254 33.611 27.555 1.00 0.00 ATOM 500 CG HIS 62 14.078 34.564 27.757 1.00 0.00 ATOM 501 CD2 HIS 62 13.549 34.961 28.906 1.00 0.00 ATOM 502 ND1 HIS 62 13.456 35.186 26.760 1.00 0.00 ATOM 503 CE1 HIS 62 12.528 35.946 27.299 1.00 0.00 ATOM 504 NE2 HIS 62 12.603 35.832 28.609 1.00 0.00 ATOM 505 O HIS 62 17.902 34.422 29.147 1.00 0.00 ATOM 506 C HIS 62 17.100 35.007 28.419 1.00 0.00 ATOM 507 N ARG 63 16.664 36.238 28.669 1.00 0.00 ATOM 508 CA ARG 63 17.119 36.979 29.844 1.00 0.00 ATOM 509 CB ARG 63 16.374 38.316 29.919 1.00 0.00 ATOM 510 CG ARG 63 16.832 39.252 28.790 1.00 0.00 ATOM 511 CD ARG 63 16.017 40.543 28.801 1.00 0.00 ATOM 512 NE ARG 63 14.699 40.330 28.176 1.00 0.00 ATOM 513 CZ ARG 63 13.716 41.229 28.180 1.00 0.00 ATOM 514 NH1 ARG 63 13.821 42.400 28.787 1.00 0.00 ATOM 515 NH2 ARG 63 12.607 41.002 27.519 1.00 0.00 ATOM 516 O ARG 63 17.733 36.269 32.053 1.00 0.00 ATOM 517 C ARG 63 16.921 36.176 31.130 1.00 0.00 ATOM 518 N SER 64 15.885 35.287 31.168 1.00 0.00 ATOM 519 CA SER 64 15.577 34.484 32.355 1.00 0.00 ATOM 520 CB SER 64 14.037 34.487 32.586 1.00 0.00 ATOM 521 OG SER 64 13.522 35.801 32.703 1.00 0.00 ATOM 522 O SER 64 15.856 32.312 33.322 1.00 0.00 ATOM 523 C SER 64 16.006 33.012 32.317 1.00 0.00 ATOM 524 N PHE 65 16.640 32.580 31.224 1.00 0.00 ATOM 525 CA PHE 65 17.005 31.158 31.032 1.00 0.00 ATOM 526 CB PHE 65 16.015 30.473 30.082 1.00 0.00 ATOM 527 CG PHE 65 14.582 30.495 30.586 1.00 0.00 ATOM 528 CD1 PHE 65 13.734 31.530 30.222 1.00 0.00 ATOM 529 CD2 PHE 65 14.122 29.495 31.430 1.00 0.00 ATOM 530 CE1 PHE 65 12.437 31.572 30.701 1.00 0.00 ATOM 531 CE2 PHE 65 12.815 29.521 31.894 1.00 0.00 ATOM 532 CZ PHE 65 11.970 30.566 31.531 1.00 0.00 ATOM 533 O PHE 65 18.591 31.334 29.272 1.00 0.00 ATOM 534 C PHE 65 18.385 30.923 30.418 1.00 0.00 ATOM 535 N ILE 66 19.087 29.970 31.016 1.00 0.00 ATOM 536 CA ILE 66 20.328 29.407 30.450 1.00 0.00 ATOM 537 CB ILE 66 21.523 29.597 31.406 1.00 0.00 ATOM 538 CG1 ILE 66 21.680 31.056 31.843 1.00 0.00 ATOM 539 CG2 ILE 66 22.836 29.065 30.810 1.00 0.00 ATOM 540 CD1 ILE 66 21.981 32.063 30.733 1.00 0.00 ATOM 541 O ILE 66 19.425 27.271 31.042 1.00 0.00 ATOM 542 C ILE 66 20.031 27.934 30.195 1.00 0.00 ATOM 543 N VAL 67 20.273 27.532 28.958 1.00 0.00 ATOM 544 CA VAL 67 19.980 26.159 28.503 1.00 0.00 ATOM 545 CB VAL 67 19.270 26.134 27.148 1.00 0.00 ATOM 546 CG1 VAL 67 17.878 26.751 27.287 1.00 0.00 ATOM 547 CG2 VAL 67 20.057 26.887 26.080 1.00 0.00 ATOM 548 O VAL 67 22.300 25.891 27.937 1.00 0.00 ATOM 549 C VAL 67 21.281 25.365 28.391 1.00 0.00 ATOM 550 N ASN 68 21.148 24.067 28.647 1.00 0.00 ATOM 551 CA ASN 68 22.233 23.128 28.372 1.00 0.00 ATOM 552 CB ASN 68 22.242 21.946 29.332 1.00 0.00 ATOM 553 CG ASN 68 23.514 21.101 29.147 1.00 0.00 ATOM 554 ND2 ASN 68 23.897 20.421 30.199 1.00 0.00 ATOM 555 OD1 ASN 68 24.168 21.043 28.114 1.00 0.00 ATOM 556 O ASN 68 21.131 21.682 26.792 1.00 0.00 ATOM 557 C ASN 68 21.978 22.559 26.979 1.00 0.00 ATOM 558 N VAL 69 22.799 23.008 26.050 1.00 0.00 ATOM 559 CA VAL 69 22.691 22.599 24.633 1.00 0.00 ATOM 560 CB VAL 69 23.744 23.342 23.814 1.00 0.00 ATOM 561 CG1 VAL 69 23.844 22.894 22.350 1.00 0.00 ATOM 562 CG2 VAL 69 23.323 24.797 23.868 1.00 0.00 ATOM 563 O VAL 69 22.049 20.557 23.539 1.00 0.00 ATOM 564 C VAL 69 22.700 21.079 24.445 1.00 0.00 ATOM 565 N ASN 70 23.401 20.373 25.327 1.00 0.00 ATOM 566 CA ASN 70 23.477 18.919 25.243 1.00 0.00 ATOM 567 CB ASN 70 24.500 18.428 26.190 1.00 0.00 ATOM 568 CG ASN 70 25.891 18.699 25.659 1.00 0.00 ATOM 569 ND2 ASN 70 26.596 19.671 26.251 1.00 0.00 ATOM 570 OD1 ASN 70 26.323 18.039 24.707 1.00 0.00 ATOM 571 O ASN 70 22.072 16.980 25.317 1.00 0.00 ATOM 572 C ASN 70 22.181 18.183 25.560 1.00 0.00 ATOM 573 N HIS 71 21.255 18.867 26.224 1.00 0.00 ATOM 574 CA HIS 71 19.977 18.262 26.579 1.00 0.00 ATOM 575 CB HIS 71 19.913 18.227 28.112 1.00 0.00 ATOM 576 CG HIS 71 21.123 17.443 28.683 1.00 0.00 ATOM 577 CD2 HIS 71 21.828 17.748 29.765 1.00 0.00 ATOM 578 ND1 HIS 71 21.716 16.392 28.116 1.00 0.00 ATOM 579 CE1 HIS 71 22.774 16.037 28.820 1.00 0.00 ATOM 580 NE2 HIS 71 22.841 16.886 29.842 1.00 0.00 ATOM 581 O HIS 71 17.580 18.519 26.219 1.00 0.00 ATOM 582 C HIS 71 18.729 18.809 25.874 1.00 0.00 ATOM 583 N ILE 72 18.969 19.646 24.868 1.00 0.00 ATOM 584 CA ILE 72 17.895 20.110 23.987 1.00 0.00 ATOM 585 CB ILE 72 18.325 21.314 23.176 1.00 0.00 ATOM 586 CG1 ILE 72 18.903 22.312 24.197 1.00 0.00 ATOM 587 CG2 ILE 72 17.146 21.817 22.303 1.00 0.00 ATOM 588 CD1 ILE 72 17.802 23.039 24.968 1.00 0.00 ATOM 589 O ILE 72 18.312 18.611 22.206 1.00 0.00 ATOM 590 C ILE 72 17.507 18.967 23.059 1.00 0.00 ATOM 591 N LYS 73 16.205 18.792 22.996 1.00 0.00 ATOM 592 CA LYS 73 15.625 17.816 22.069 1.00 0.00 ATOM 593 CB LYS 73 14.395 17.145 22.696 1.00 0.00 ATOM 594 CG LYS 73 13.851 16.070 21.756 1.00 0.00 ATOM 595 CD LYS 73 12.711 15.333 22.445 1.00 0.00 ATOM 596 CE LYS 73 12.194 14.167 21.620 1.00 0.00 ATOM 597 NZ LYS 73 11.115 13.428 22.288 1.00 0.00 ATOM 598 O LYS 73 15.340 17.899 19.682 1.00 0.00 ATOM 599 C LYS 73 15.155 18.458 20.763 1.00 0.00 ATOM 600 N ALA 74 14.511 19.622 20.850 1.00 0.00 ATOM 601 CA ALA 74 14.019 20.330 19.678 1.00 0.00 ATOM 602 CB ALA 74 12.641 19.793 19.308 1.00 0.00 ATOM 603 O ALA 74 13.641 22.100 21.290 1.00 0.00 ATOM 604 C ALA 74 13.699 21.761 20.104 1.00 0.00 ATOM 605 N ILE 75 13.567 22.602 19.100 1.00 0.00 ATOM 606 CA ILE 75 13.131 23.987 19.301 1.00 0.00 ATOM 607 CB ILE 75 14.415 24.878 19.198 1.00 0.00 ATOM 608 CG1 ILE 75 14.097 26.342 19.480 1.00 0.00 ATOM 609 CG2 ILE 75 15.028 24.709 17.802 1.00 0.00 ATOM 610 CD1 ILE 75 15.340 27.214 19.607 1.00 0.00 ATOM 611 O ILE 75 11.950 23.939 17.200 1.00 0.00 ATOM 612 C ILE 75 11.962 24.335 18.369 1.00 0.00 ATOM 613 N TYR 76 10.975 25.007 18.985 1.00 0.00 ATOM 614 CA TYR 76 9.918 25.574 18.146 1.00 0.00 ATOM 615 CB TYR 76 8.541 24.942 18.619 1.00 0.00 ATOM 616 CG TYR 76 8.578 23.504 19.096 1.00 0.00 ATOM 617 CD1 TYR 76 9.061 23.179 20.365 1.00 0.00 ATOM 618 CD2 TYR 76 8.110 22.469 18.287 1.00 0.00 ATOM 619 CE1 TYR 76 9.076 21.860 20.814 1.00 0.00 ATOM 620 CE2 TYR 76 8.123 21.144 18.725 1.00 0.00 ATOM 621 CZ TYR 76 8.602 20.848 19.991 1.00 0.00 ATOM 622 OH TYR 76 8.595 19.545 20.434 1.00 0.00 ATOM 623 O TYR 76 10.009 27.860 18.640 1.00 0.00 ATOM 624 C TYR 76 10.475 27.000 17.905 1.00 0.00 ATOM 625 N PRO 77 11.590 27.210 17.148 1.00 0.00 ATOM 626 CA PRO 77 12.360 28.497 17.026 1.00 0.00 ATOM 627 CB PRO 77 13.142 28.372 15.725 1.00 0.00 ATOM 628 CG PRO 77 12.796 27.049 15.057 1.00 0.00 ATOM 629 CD PRO 77 11.679 26.403 15.866 1.00 0.00 ATOM 630 O PRO 77 10.328 29.466 16.601 1.00 0.00 ATOM 631 C PRO 77 11.489 29.704 16.737 1.00 0.00 ATOM 632 N ASP 78 11.831 30.954 16.941 1.00 0.00 ATOM 633 CA ASP 78 10.887 32.049 16.602 1.00 0.00 ATOM 634 CB ASP 78 11.492 33.404 16.938 1.00 0.00 ATOM 635 CG ASP 78 12.807 33.744 16.237 1.00 0.00 ATOM 636 OD1 ASP 78 13.551 32.846 15.771 1.00 0.00 ATOM 637 OD2 ASP 78 13.089 34.949 16.292 1.00 0.00 ATOM 638 O ASP 78 9.307 32.012 14.767 1.00 0.00 ATOM 639 C ASP 78 10.488 32.071 15.142 1.00 0.00 ATOM 640 N THR 79 11.440 32.186 14.225 1.00 0.00 ATOM 641 CA THR 79 11.126 32.206 12.802 1.00 0.00 ATOM 642 CB THR 79 12.454 32.738 12.015 1.00 0.00 ATOM 643 CG2 THR 79 12.760 34.193 12.331 1.00 0.00 ATOM 644 OG1 THR 79 13.571 31.918 12.387 1.00 0.00 ATOM 645 O THR 79 9.664 30.847 11.448 1.00 0.00 ATOM 646 C THR 79 10.537 30.889 12.330 1.00 0.00 ATOM 647 N HIS 80 11.006 29.853 12.874 1.00 0.00 ATOM 648 CA HIS 80 10.294 28.585 12.686 1.00 0.00 ATOM 649 CB HIS 80 11.482 27.672 12.185 1.00 0.00 ATOM 650 CG HIS 80 12.606 27.920 11.100 1.00 0.00 ATOM 651 CD2 HIS 80 13.598 28.835 11.011 1.00 0.00 ATOM 652 ND1 HIS 80 12.779 27.186 9.997 1.00 0.00 ATOM 653 CE1 HIS 80 13.786 27.647 9.255 1.00 0.00 ATOM 654 NE2 HIS 80 14.307 28.694 9.877 1.00 0.00 ATOM 655 O HIS 80 7.893 28.621 12.565 1.00 0.00 ATOM 656 C HIS 80 8.878 28.732 13.273 1.00 0.00 ATOM 657 N SER 81 8.909 29.186 14.565 1.00 0.00 ATOM 658 CA SER 81 7.713 29.658 15.261 1.00 0.00 ATOM 659 CB SER 81 6.359 28.821 14.885 1.00 0.00 ATOM 660 OG SER 81 6.174 27.789 15.835 1.00 0.00 ATOM 661 O SER 81 7.552 31.417 16.944 1.00 0.00 ATOM 662 C SER 81 7.358 30.229 16.693 1.00 0.00 ATOM 663 N THR 82 7.062 29.421 17.729 1.00 0.00 ATOM 664 CA THR 82 6.571 29.871 19.076 1.00 0.00 ATOM 665 CB THR 82 5.184 29.004 19.287 1.00 0.00 ATOM 666 CG2 THR 82 4.605 29.249 20.679 1.00 0.00 ATOM 667 OG1 THR 82 4.201 29.343 18.301 1.00 0.00 ATOM 668 O THR 82 7.442 30.745 21.169 1.00 0.00 ATOM 669 C THR 82 7.687 30.282 20.056 1.00 0.00 ATOM 670 N PHE 83 8.912 29.961 19.647 1.00 0.00 ATOM 671 CA PHE 83 10.147 30.115 20.427 1.00 0.00 ATOM 672 CB PHE 83 10.662 31.568 20.384 1.00 0.00 ATOM 673 CG PHE 83 9.638 32.678 20.555 1.00 0.00 ATOM 674 CD1 PHE 83 9.241 33.093 21.806 1.00 0.00 ATOM 675 CD2 PHE 83 9.153 33.312 19.438 1.00 0.00 ATOM 676 CE1 PHE 83 8.332 34.136 21.931 1.00 0.00 ATOM 677 CE2 PHE 83 8.268 34.357 19.560 1.00 0.00 ATOM 678 CZ PHE 83 7.843 34.786 20.809 1.00 0.00 ATOM 679 O PHE 83 10.544 29.890 22.835 1.00 0.00 ATOM 680 C PHE 83 10.121 29.400 21.785 1.00 0.00 ATOM 681 N LEU 84 9.796 28.113 21.665 1.00 0.00 ATOM 682 CA LEU 84 9.774 27.179 22.814 1.00 0.00 ATOM 683 CB LEU 84 8.420 26.460 22.917 1.00 0.00 ATOM 684 CG LEU 84 7.226 27.389 23.147 1.00 0.00 ATOM 685 CD1 LEU 84 5.950 26.539 23.161 1.00 0.00 ATOM 686 CD2 LEU 84 7.327 28.166 24.466 1.00 0.00 ATOM 687 O LEU 84 10.858 25.334 21.729 1.00 0.00 ATOM 688 C LEU 84 10.890 26.150 22.653 1.00 0.00 ATOM 689 N LEU 85 11.663 25.985 23.720 1.00 0.00 ATOM 690 CA LEU 85 12.758 25.003 23.752 1.00 0.00 ATOM 691 CB LEU 85 13.953 25.615 24.461 1.00 0.00 ATOM 692 CG LEU 85 14.515 26.905 23.847 1.00 0.00 ATOM 693 CD1 LEU 85 15.687 27.392 24.692 1.00 0.00 ATOM 694 CD2 LEU 85 14.961 26.658 22.411 1.00 0.00 ATOM 695 O LEU 85 11.945 23.852 25.679 1.00 0.00 ATOM 696 C LEU 85 12.288 23.771 24.504 1.00 0.00 ATOM 697 N SER 86 12.441 22.631 23.850 1.00 0.00 ATOM 698 CA SER 86 12.025 21.352 24.446 1.00 0.00 ATOM 699 CB SER 86 10.865 20.751 23.593 1.00 0.00 ATOM 700 OG SER 86 11.425 20.173 22.421 1.00 0.00 ATOM 701 O SER 86 14.095 20.239 23.988 1.00 0.00 ATOM 702 C SER 86 13.243 20.531 24.830 1.00 0.00 ATOM 703 N MET 87 13.185 19.982 26.038 1.00 0.00 ATOM 704 CA MET 87 14.305 19.212 26.606 1.00 0.00 ATOM 705 CB MET 87 14.535 19.619 28.067 1.00 0.00 ATOM 706 CG MET 87 14.926 21.077 28.223 1.00 0.00 ATOM 707 SD MET 87 16.583 21.448 27.562 1.00 0.00 ATOM 708 CE MET 87 16.607 23.149 28.109 1.00 0.00 ATOM 709 O MET 87 12.961 17.241 26.351 1.00 0.00 ATOM 710 C MET 87 14.080 17.704 26.569 1.00 0.00 ATOM 711 N ASP 88 15.150 16.939 26.771 1.00 0.00 ATOM 712 CA ASP 88 15.051 15.480 26.760 1.00 0.00 ATOM 713 CB ASP 88 16.436 14.862 26.930 1.00 0.00 ATOM 714 CG ASP 88 17.318 15.051 25.695 1.00 0.00 ATOM 715 OD1 ASP 88 16.765 15.355 24.620 1.00 0.00 ATOM 716 OD2 ASP 88 18.519 14.755 25.852 1.00 0.00 ATOM 717 O ASP 88 13.389 13.996 27.568 1.00 0.00 ATOM 718 C ASP 88 14.092 14.967 27.812 1.00 0.00 ATOM 719 N ASN 89 13.955 15.665 28.971 1.00 0.00 ATOM 720 CA ASN 89 13.050 15.230 30.012 1.00 0.00 ATOM 721 CB ASN 89 13.603 15.715 31.343 1.00 0.00 ATOM 722 CG ASN 89 13.472 17.234 31.534 1.00 0.00 ATOM 723 ND2 ASN 89 13.683 17.662 32.748 1.00 0.00 ATOM 724 OD1 ASN 89 13.167 18.005 30.632 1.00 0.00 ATOM 725 O ASN 89 10.823 15.611 30.829 1.00 0.00 ATOM 726 C ASN 89 11.617 15.741 29.881 1.00 0.00 ATOM 727 N GLY 90 11.245 16.278 28.703 1.00 0.00 ATOM 728 CA GLY 90 9.890 16.739 28.416 1.00 0.00 ATOM 729 O GLY 90 8.397 18.583 28.711 1.00 0.00 ATOM 730 C GLY 90 9.489 18.104 29.000 1.00 0.00 ATOM 731 N GLU 91 10.430 18.761 29.683 1.00 0.00 ATOM 732 CA GLU 91 10.265 20.160 30.101 1.00 0.00 ATOM 733 CB GLU 91 11.281 20.525 31.179 1.00 0.00 ATOM 734 CG GLU 91 10.993 19.844 32.514 1.00 0.00 ATOM 735 CD GLU 91 9.672 20.275 33.154 1.00 0.00 ATOM 736 OE1 GLU 91 8.998 21.174 32.595 1.00 0.00 ATOM 737 OE2 GLU 91 9.343 19.670 34.181 1.00 0.00 ATOM 738 O GLU 91 10.975 20.720 27.879 1.00 0.00 ATOM 739 C GLU 91 10.459 21.112 28.926 1.00 0.00 ATOM 740 N ARG 92 10.064 22.368 29.108 1.00 0.00 ATOM 741 CA ARG 92 10.205 23.359 28.057 1.00 0.00 ATOM 742 CB ARG 92 8.998 23.658 27.177 1.00 0.00 ATOM 743 CG ARG 92 8.537 22.438 26.397 1.00 0.00 ATOM 744 CD ARG 92 7.420 22.913 25.502 1.00 0.00 ATOM 745 NE ARG 92 6.820 21.734 24.867 1.00 0.00 ATOM 746 CZ ARG 92 5.792 21.787 24.030 1.00 0.00 ATOM 747 NH1 ARG 92 5.249 22.935 23.634 1.00 0.00 ATOM 748 NH2 ARG 92 5.307 20.652 23.570 1.00 0.00 ATOM 749 O ARG 92 10.035 24.910 29.838 1.00 0.00 ATOM 750 C ARG 92 10.566 24.656 28.764 1.00 0.00 ATOM 751 N VAL 93 11.185 25.523 27.998 1.00 0.00 ATOM 752 CA VAL 93 11.446 26.906 28.407 1.00 0.00 ATOM 753 CB VAL 93 12.781 27.090 29.164 1.00 0.00 ATOM 754 CG1 VAL 93 12.815 26.309 30.471 1.00 0.00 ATOM 755 CG2 VAL 93 13.990 26.749 28.286 1.00 0.00 ATOM 756 O VAL 93 11.251 27.401 26.060 1.00 0.00 ATOM 757 C VAL 93 11.382 27.858 27.205 1.00 0.00 ATOM 758 N PRO 94 11.293 29.155 27.492 1.00 0.00 ATOM 759 CA PRO 94 11.285 30.182 26.440 1.00 0.00 ATOM 760 CB PRO 94 10.506 31.336 27.097 1.00 0.00 ATOM 761 CG PRO 94 9.789 30.750 28.230 1.00 0.00 ATOM 762 CD PRO 94 10.697 29.682 28.719 1.00 0.00 ATOM 763 O PRO 94 13.587 30.830 26.803 1.00 0.00 ATOM 764 C PRO 94 12.660 30.689 26.004 1.00 0.00 ATOM 765 N VAL 95 12.684 31.085 24.742 1.00 0.00 ATOM 766 CA VAL 95 13.816 31.824 24.151 1.00 0.00 ATOM 767 CB VAL 95 14.468 31.185 22.917 1.00 0.00 ATOM 768 CG1 VAL 95 15.236 29.973 23.351 1.00 0.00 ATOM 769 CG2 VAL 95 13.506 30.675 21.865 1.00 0.00 ATOM 770 O VAL 95 12.259 33.318 23.119 1.00 0.00 ATOM 771 C VAL 95 13.320 33.199 23.732 1.00 0.00 ATOM 772 N SER 96 14.233 34.142 23.824 1.00 0.00 ATOM 773 CA SER 96 13.927 35.517 23.402 1.00 0.00 ATOM 774 CB SER 96 14.786 36.510 24.193 1.00 0.00 ATOM 775 OG SER 96 16.155 36.454 23.833 1.00 0.00 ATOM 776 O SER 96 14.895 34.962 21.272 1.00 0.00 ATOM 777 C SER 96 14.190 35.750 21.903 1.00 0.00 ATOM 778 N GLN 97 13.488 36.711 21.315 1.00 0.00 ATOM 779 CA GLN 97 13.662 37.017 19.899 1.00 0.00 ATOM 780 CB GLN 97 12.858 38.290 19.626 1.00 0.00 ATOM 781 CG GLN 97 12.914 38.701 18.159 1.00 0.00 ATOM 782 CD GLN 97 12.183 40.021 17.920 1.00 0.00 ATOM 783 OE1 GLN 97 11.743 40.710 18.833 1.00 0.00 ATOM 784 NE2 GLN 97 12.056 40.361 16.668 1.00 0.00 ATOM 785 O GLN 97 15.656 36.614 18.616 1.00 0.00 ATOM 786 C GLN 97 15.140 37.237 19.530 1.00 0.00 ATOM 787 N SER 98 15.851 37.961 20.395 1.00 0.00 ATOM 788 CA SER 98 17.274 38.275 20.149 1.00 0.00 ATOM 789 CB SER 98 17.788 39.380 21.060 1.00 0.00 ATOM 790 OG SER 98 17.763 38.997 22.436 1.00 0.00 ATOM 791 O SER 98 19.297 37.077 19.638 1.00 0.00 ATOM 792 C SER 98 18.209 37.056 20.219 1.00 0.00 ATOM 793 N TYR 99 17.828 36.047 20.985 1.00 0.00 ATOM 794 CA TYR 99 18.714 34.905 21.296 1.00 0.00 ATOM 795 CB TYR 99 18.981 35.067 22.903 1.00 0.00 ATOM 796 CG TYR 99 20.013 36.099 23.233 1.00 0.00 ATOM 797 CD1 TYR 99 19.666 37.265 23.922 1.00 0.00 ATOM 798 CD2 TYR 99 21.343 35.941 22.776 1.00 0.00 ATOM 799 CE1 TYR 99 20.627 38.260 24.157 1.00 0.00 ATOM 800 CE2 TYR 99 22.287 36.927 22.996 1.00 0.00 ATOM 801 CZ TYR 99 21.930 38.070 23.683 1.00 0.00 ATOM 802 OH TYR 99 22.860 39.061 23.886 1.00 0.00 ATOM 803 O TYR 99 19.223 32.638 20.713 1.00 0.00 ATOM 804 C TYR 99 18.377 33.542 20.707 1.00 0.00 ATOM 805 N ALA 100 17.157 33.413 20.201 1.00 0.00 ATOM 806 CA ALA 100 16.612 32.105 19.750 1.00 0.00 ATOM 807 CB ALA 100 15.173 32.279 19.269 1.00 0.00 ATOM 808 O ALA 100 17.579 30.273 18.517 1.00 0.00 ATOM 809 C ALA 100 17.393 31.487 18.587 1.00 0.00 ATOM 810 N SER 101 17.890 32.344 17.703 1.00 0.00 ATOM 811 CA SER 101 18.556 31.889 16.468 1.00 0.00 ATOM 812 CB SER 101 18.844 33.045 15.530 1.00 0.00 ATOM 813 OG SER 101 19.691 34.004 16.143 1.00 0.00 ATOM 814 O SER 101 20.280 30.304 16.041 1.00 0.00 ATOM 815 C SER 101 19.939 31.290 16.690 1.00 0.00 ATOM 816 N TYR 102 20.753 31.893 17.548 1.00 0.00 ATOM 817 CA TYR 102 22.071 31.295 17.896 1.00 0.00 ATOM 818 CB TYR 102 22.740 32.207 18.951 1.00 0.00 ATOM 819 CG TYR 102 24.050 31.665 19.499 1.00 0.00 ATOM 820 CD1 TYR 102 25.257 31.862 18.819 1.00 0.00 ATOM 821 CD2 TYR 102 24.077 30.938 20.693 1.00 0.00 ATOM 822 CE1 TYR 102 26.460 31.348 19.319 1.00 0.00 ATOM 823 CE2 TYR 102 25.271 30.417 21.200 1.00 0.00 ATOM 824 CZ TYR 102 26.457 30.622 20.515 1.00 0.00 ATOM 825 OH TYR 102 27.630 30.095 21.019 1.00 0.00 ATOM 826 O TYR 102 22.597 28.962 18.143 1.00 0.00 ATOM 827 C TYR 102 21.850 29.889 18.461 1.00 0.00 ATOM 828 N PHE 103 20.843 29.741 19.317 1.00 0.00 ATOM 829 CA PHE 103 20.541 28.445 19.912 1.00 0.00 ATOM 830 CB PHE 103 19.313 28.619 20.795 1.00 0.00 ATOM 831 CG PHE 103 19.052 27.342 21.569 1.00 0.00 ATOM 832 CD1 PHE 103 19.823 26.989 22.674 1.00 0.00 ATOM 833 CD2 PHE 103 18.044 26.534 21.065 1.00 0.00 ATOM 834 CE1 PHE 103 19.569 25.798 23.291 1.00 0.00 ATOM 835 CE2 PHE 103 17.776 25.359 21.690 1.00 0.00 ATOM 836 CZ PHE 103 18.548 25.058 22.756 1.00 0.00 ATOM 837 O PHE 103 20.761 26.318 18.797 1.00 0.00 ATOM 838 C PHE 103 20.262 27.410 18.774 1.00 0.00 ATOM 839 N ARG 104 19.426 27.805 17.806 1.00 0.00 ATOM 840 CA ARG 104 19.094 26.975 16.661 1.00 0.00 ATOM 841 CB ARG 104 18.370 27.926 15.703 1.00 0.00 ATOM 842 CG ARG 104 17.804 27.313 14.430 1.00 0.00 ATOM 843 CD ARG 104 17.144 28.394 13.561 1.00 0.00 ATOM 844 NE ARG 104 18.007 28.872 12.456 1.00 0.00 ATOM 845 CZ ARG 104 18.480 28.151 11.441 1.00 0.00 ATOM 846 NH1 ARG 104 18.298 26.847 11.327 1.00 0.00 ATOM 847 NH2 ARG 104 19.163 28.727 10.471 1.00 0.00 ATOM 848 O ARG 104 20.512 25.310 15.611 1.00 0.00 ATOM 849 C ARG 104 20.366 26.481 15.957 1.00 0.00 ATOM 850 N LYS 105 21.243 27.448 15.741 1.00 0.00 ATOM 851 CA LYS 105 22.491 27.267 15.005 1.00 0.00 ATOM 852 CB LYS 105 23.185 28.629 14.810 1.00 0.00 ATOM 853 CG LYS 105 24.525 28.545 14.093 1.00 0.00 ATOM 854 CD LYS 105 25.230 29.893 14.074 1.00 0.00 ATOM 855 CE LYS 105 26.562 29.798 13.352 1.00 0.00 ATOM 856 NZ LYS 105 27.265 31.114 13.319 1.00 0.00 ATOM 857 O LYS 105 23.900 25.314 15.102 1.00 0.00 ATOM 858 C LYS 105 23.395 26.258 15.712 1.00 0.00 ATOM 859 N LEU 106 23.526 26.483 17.007 1.00 0.00 ATOM 860 CA LEU 106 24.335 25.605 17.844 1.00 0.00 ATOM 861 CB LEU 106 24.320 26.226 19.229 1.00 0.00 ATOM 862 CG LEU 106 25.051 25.400 20.274 1.00 0.00 ATOM 863 CD1 LEU 106 26.521 25.341 19.953 1.00 0.00 ATOM 864 CD2 LEU 106 24.906 26.077 21.619 1.00 0.00 ATOM 865 O LEU 106 24.611 23.228 17.545 1.00 0.00 ATOM 866 C LEU 106 23.823 24.154 17.742 1.00 0.00 ATOM 867 N LEU 107 22.510 23.973 17.841 1.00 0.00 ATOM 868 CA LEU 107 21.921 22.642 17.755 1.00 0.00 ATOM 869 CB LEU 107 20.498 22.700 18.260 1.00 0.00 ATOM 870 CG LEU 107 20.376 23.055 19.727 1.00 0.00 ATOM 871 CD1 LEU 107 18.888 23.066 19.965 1.00 0.00 ATOM 872 CD2 LEU 107 21.075 22.058 20.660 1.00 0.00 ATOM 873 O LEU 107 21.596 20.838 16.231 1.00 0.00 ATOM 874 C LEU 107 21.927 22.002 16.364 1.00 0.00 ATOM 875 N GLY 108 22.158 22.830 15.345 1.00 0.00 ATOM 876 CA GLY 108 22.108 22.398 13.944 1.00 0.00 ATOM 877 O GLY 108 20.446 21.136 12.998 1.00 0.00 ATOM 878 C GLY 108 20.692 22.195 13.527 1.00 0.00 ATOM 879 N PHE 109 19.714 23.010 13.941 1.00 0.00 ATOM 880 CA PHE 109 18.295 22.893 13.580 1.00 0.00 ATOM 881 CB PHE 109 17.557 23.465 14.792 1.00 0.00 ATOM 882 CG PHE 109 16.037 23.247 14.748 1.00 0.00 ATOM 883 CD1 PHE 109 15.419 22.169 15.372 1.00 0.00 ATOM 884 CD2 PHE 109 15.239 24.134 14.038 1.00 0.00 ATOM 885 CE1 PHE 109 14.060 21.971 15.290 1.00 0.00 ATOM 886 CE2 PHE 109 13.876 23.926 13.929 1.00 0.00 ATOM 887 CZ PHE 109 13.288 22.849 14.569 1.00 0.00 ATOM 888 O PHE 109 19.006 24.439 11.886 1.00 0.00 ATOM 889 C PHE 109 18.038 23.789 12.338 1.00 0.00 TER END