PFRMAT TS TARGET T0307 AUTHOR 5370-1100-4902 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 8 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 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 METHOD Model 1 is try24-opt2, optimized from a 4-helix bundle hand-built by ProteinShop. METHOD Model 2 is try26-opt2, edited then ptimized from a model built from METHOD alignments (probably mainly 1afvA). METHOD Model 3 is try3-opt2, built from alignments (probably mainly 1ireA) METHOD Model 4 is try1-opt2, the fully automatic model (probably mainly from METHOD an alignment to 1yqyA). METHOD Model 5 is try25-opt2, optimized from ROBETTA_TS4, the best-scoring METHOD server model with our cost functions. METHOD REMARK 6 REMARK 6 T0307 model 1 Tue Jul 11 08:18:12 2006 MODEL 1 PARENT 2aao_A 1a2x_A 1uhn_A 2mys_B 2aao_A REMARK 7 REMARK 7 ALLPARENTS 2aao_A 1a2x_A 1uhn_A 2mys_B 2aao_A 1a2x_A 1uhn_A REMARK 7 ALLPARENTS 2mys_B 1tn4 1ncx 1top 2ccm_A 1mvw_B 1pva_A REMARK 7 ALLPARENTS 1jk0_A 1afv_A 1jip_A 1go3_F 1osa 2scp_A 1aj4 REMARK 7 ALLPARENTS 1wdc_B 1eup_A 1yqy_A ATOM 1 N MET 1 17.914 -0.841 11.464 1.00 0.00 ATOM 2 CA MET 1 18.655 0.402 11.130 1.00 0.00 ATOM 3 CB MET 1 18.831 0.516 9.616 1.00 0.00 ATOM 4 CG MET 1 19.545 -0.665 8.996 1.00 0.00 ATOM 5 SD MET 1 19.671 -0.554 7.208 1.00 0.00 ATOM 6 CE MET 1 20.969 0.707 7.050 1.00 0.00 ATOM 7 O MET 1 16.716 1.498 11.861 1.00 0.00 ATOM 8 C MET 1 17.943 1.623 11.697 1.00 0.00 ATOM 9 N GLY 2 18.652 2.714 11.951 1.00 0.00 ATOM 10 CA GLY 2 17.981 3.916 12.488 1.00 0.00 ATOM 11 O GLY 2 17.500 4.374 10.181 1.00 0.00 ATOM 12 C GLY 2 17.291 4.676 11.355 1.00 0.00 ATOM 13 N LEU 3 16.498 5.647 11.740 1.00 0.00 ATOM 14 CA LEU 3 15.707 6.423 10.768 1.00 0.00 ATOM 15 CB LEU 3 14.851 7.455 11.523 1.00 0.00 ATOM 16 CG LEU 3 13.847 8.220 10.656 1.00 0.00 ATOM 17 CD1 LEU 3 12.786 7.259 10.127 1.00 0.00 ATOM 18 CD2 LEU 3 13.207 9.326 11.479 1.00 0.00 ATOM 19 O LEU 3 16.124 7.191 8.528 1.00 0.00 ATOM 20 C LEU 3 16.525 7.146 9.692 1.00 0.00 ATOM 21 N GLY 4 17.699 7.713 10.064 1.00 0.00 ATOM 22 CA GLY 4 18.610 8.358 9.132 1.00 0.00 ATOM 23 O GLY 4 19.150 7.732 6.896 1.00 0.00 ATOM 24 C GLY 4 19.118 7.375 8.068 1.00 0.00 ATOM 25 N ARG 5 19.489 6.175 8.494 1.00 0.00 ATOM 26 CA ARG 5 20.009 5.192 7.530 1.00 0.00 ATOM 27 CB ARG 5 20.602 4.001 8.276 1.00 0.00 ATOM 28 CG ARG 5 21.872 4.335 9.056 1.00 0.00 ATOM 29 CD ARG 5 23.084 4.541 8.166 1.00 0.00 ATOM 30 NE ARG 5 23.479 3.293 7.503 1.00 0.00 ATOM 31 CZ ARG 5 24.216 2.330 8.064 1.00 0.00 ATOM 32 NH1 ARG 5 24.655 2.455 9.314 1.00 0.00 ATOM 33 NH2 ARG 5 24.517 1.229 7.370 1.00 0.00 ATOM 34 O ARG 5 19.136 4.663 5.363 1.00 0.00 ATOM 35 C ARG 5 18.893 4.820 6.557 1.00 0.00 ATOM 36 N GLN 6 17.681 4.690 7.090 1.00 0.00 ATOM 37 CA GLN 6 16.522 4.334 6.274 1.00 0.00 ATOM 38 CB GLN 6 15.307 4.044 7.177 1.00 0.00 ATOM 39 CG GLN 6 15.390 2.723 7.922 1.00 0.00 ATOM 40 CD GLN 6 14.237 2.518 8.887 1.00 0.00 ATOM 41 OE1 GLN 6 13.762 3.469 9.513 1.00 0.00 ATOM 42 NE2 GLN 6 13.786 1.277 9.015 1.00 0.00 ATOM 43 O GLN 6 15.870 5.164 4.099 1.00 0.00 ATOM 44 C GLN 6 16.177 5.437 5.262 1.00 0.00 ATOM 45 N SER 7 16.201 6.710 5.693 1.00 0.00 ATOM 46 CA SER 7 16.012 7.852 4.793 1.00 0.00 ATOM 47 CB SER 7 16.098 9.184 5.544 1.00 0.00 ATOM 48 OG SER 7 15.082 9.281 6.526 1.00 0.00 ATOM 49 O SER 7 16.750 8.272 2.505 1.00 0.00 ATOM 50 C SER 7 17.053 7.877 3.660 1.00 0.00 ATOM 51 N LEU 8 18.354 7.472 3.943 1.00 0.00 ATOM 52 CA LEU 8 19.411 7.464 2.928 1.00 0.00 ATOM 53 CB LEU 8 20.803 7.262 3.530 1.00 0.00 ATOM 54 CG LEU 8 21.344 8.407 4.387 1.00 0.00 ATOM 55 CD1 LEU 8 22.644 8.005 5.067 1.00 0.00 ATOM 56 CD2 LEU 8 21.615 9.637 3.532 1.00 0.00 ATOM 57 O LEU 8 19.359 6.577 0.755 1.00 0.00 ATOM 58 C LEU 8 19.154 6.348 1.941 1.00 0.00 ATOM 59 N ASN 9 18.725 5.182 2.434 1.00 0.00 ATOM 60 CA ASN 9 18.445 4.083 1.495 1.00 0.00 ATOM 61 CB ASN 9 18.080 2.798 2.250 1.00 0.00 ATOM 62 CG ASN 9 19.306 2.012 2.688 1.00 0.00 ATOM 63 ND2 ASN 9 19.279 1.503 3.914 1.00 0.00 ATOM 64 OD1 ASN 9 20.260 1.846 1.924 1.00 0.00 ATOM 65 O ASN 9 17.314 4.111 -0.635 1.00 0.00 ATOM 66 C ASN 9 17.275 4.425 0.557 1.00 0.00 ATOM 67 N ILE 10 16.234 5.060 1.108 1.00 0.00 ATOM 68 CA ILE 10 15.091 5.445 0.273 1.00 0.00 ATOM 69 CB ILE 10 13.994 6.037 1.176 1.00 0.00 ATOM 70 CG1 ILE 10 13.388 4.905 2.020 1.00 0.00 ATOM 71 CG2 ILE 10 12.935 6.735 0.327 1.00 0.00 ATOM 72 CD1 ILE 10 12.420 5.421 3.099 1.00 0.00 ATOM 73 O ILE 10 15.210 6.391 -1.919 1.00 0.00 ATOM 74 C ILE 10 15.583 6.450 -0.759 1.00 0.00 ATOM 75 N MET 11 16.498 7.495 -0.303 1.00 0.00 ATOM 76 CA MET 11 17.057 8.506 -1.191 1.00 0.00 ATOM 77 CB MET 11 17.906 9.498 -0.425 1.00 0.00 ATOM 78 CG MET 11 17.027 10.408 0.456 1.00 0.00 ATOM 79 SD MET 11 17.800 11.766 1.279 1.00 0.00 ATOM 80 CE MET 11 18.963 10.961 1.781 1.00 0.00 ATOM 81 O MET 11 17.836 8.290 -3.443 1.00 0.00 ATOM 82 C MET 11 17.941 7.900 -2.272 1.00 0.00 ATOM 83 N THR 12 18.804 6.954 -1.904 1.00 0.00 ATOM 84 CA THR 12 19.673 6.327 -2.908 1.00 0.00 ATOM 85 CB THR 12 20.615 5.297 -2.372 1.00 0.00 ATOM 86 CG2 THR 12 21.381 4.665 -3.509 1.00 0.00 ATOM 87 OG1 THR 12 21.524 5.937 -1.477 1.00 0.00 ATOM 88 O THR 12 19.018 5.847 -5.172 1.00 0.00 ATOM 89 C THR 12 18.791 5.664 -3.974 1.00 0.00 ATOM 90 N PHE 13 17.796 4.967 -3.533 1.00 0.00 ATOM 91 CA PHE 13 16.868 4.340 -4.473 1.00 0.00 ATOM 92 CB PHE 13 15.842 3.487 -3.653 1.00 0.00 ATOM 93 CG PHE 13 14.732 2.912 -4.482 1.00 0.00 ATOM 94 CD1 PHE 13 14.980 1.889 -5.394 1.00 0.00 ATOM 95 CD2 PHE 13 13.435 3.403 -4.362 1.00 0.00 ATOM 96 CE1 PHE 13 13.950 1.358 -6.176 1.00 0.00 ATOM 97 CE2 PHE 13 12.397 2.881 -5.139 1.00 0.00 ATOM 98 CZ PHE 13 12.657 1.859 -6.044 1.00 0.00 ATOM 99 O PHE 13 16.021 5.163 -6.548 1.00 0.00 ATOM 100 C PHE 13 16.126 5.352 -5.342 1.00 0.00 ATOM 101 N SER 14 15.604 6.430 -4.762 1.00 0.00 ATOM 102 CA SER 14 14.889 7.391 -5.589 1.00 0.00 ATOM 103 CB SER 14 14.113 8.349 -4.832 1.00 0.00 ATOM 104 OG SER 14 14.917 9.051 -3.893 1.00 0.00 ATOM 105 O SER 14 15.405 8.444 -7.675 1.00 0.00 ATOM 106 C SER 14 15.807 8.161 -6.536 1.00 0.00 ATOM 107 N GLY 15 17.029 8.489 -6.094 1.00 0.00 ATOM 108 CA GLY 15 17.959 9.205 -6.949 1.00 0.00 ATOM 109 O GLY 15 17.991 10.963 -5.322 1.00 0.00 ATOM 110 C GLY 15 18.566 10.414 -6.264 1.00 0.00 ATOM 111 N GLN 16 19.740 10.825 -6.742 1.00 0.00 ATOM 112 CA GLN 16 20.428 11.980 -6.174 1.00 0.00 ATOM 113 CB GLN 16 21.717 12.285 -6.852 1.00 0.00 ATOM 114 CG GLN 16 22.804 11.281 -6.471 1.00 0.00 ATOM 115 CD GLN 16 24.187 11.670 -6.969 1.00 0.00 ATOM 116 OE1 GLN 16 25.198 11.312 -6.361 1.00 0.00 ATOM 117 NE2 GLN 16 24.239 12.393 -8.081 1.00 0.00 ATOM 118 O GLN 16 19.430 14.060 -5.479 1.00 0.00 ATOM 119 C GLN 16 19.586 13.227 -6.378 1.00 0.00 ATOM 120 N GLU 17 19.013 13.407 -7.599 1.00 0.00 ATOM 121 CA GLU 17 18.158 14.566 -7.877 1.00 0.00 ATOM 122 CB GLU 17 17.851 14.637 -9.388 1.00 0.00 ATOM 123 CG GLU 17 19.136 15.025 -10.165 1.00 0.00 ATOM 124 CD GLU 17 19.015 14.827 -11.670 1.00 0.00 ATOM 125 OE1 GLU 17 18.208 13.965 -12.090 1.00 0.00 ATOM 126 OE2 GLU 17 19.749 15.508 -12.414 1.00 0.00 ATOM 127 O GLU 17 16.393 15.561 -6.610 1.00 0.00 ATOM 128 C GLU 17 16.900 14.520 -7.022 1.00 0.00 ATOM 129 N LEU 18 16.394 13.319 -6.747 1.00 0.00 ATOM 130 CA LEU 18 15.222 13.210 -5.882 1.00 0.00 ATOM 131 CB LEU 18 14.755 11.785 -5.741 1.00 0.00 ATOM 132 CG LEU 18 13.525 11.567 -4.854 1.00 0.00 ATOM 133 CD1 LEU 18 12.287 12.229 -5.413 1.00 0.00 ATOM 134 CD2 LEU 18 13.261 10.091 -4.700 1.00 0.00 ATOM 135 O LEU 18 14.817 14.445 -3.882 1.00 0.00 ATOM 136 C LEU 18 15.582 13.715 -4.486 1.00 0.00 ATOM 137 N THR 19 16.761 13.360 -3.985 1.00 0.00 ATOM 138 CA THR 19 17.171 13.782 -2.646 1.00 0.00 ATOM 139 CB THR 19 18.543 13.139 -2.274 1.00 0.00 ATOM 140 CG2 THR 19 18.999 13.645 -0.926 1.00 0.00 ATOM 141 OG1 THR 19 18.381 11.722 -2.227 1.00 0.00 ATOM 142 O THR 19 16.813 15.880 -1.542 1.00 0.00 ATOM 143 C THR 19 17.243 15.313 -2.541 1.00 0.00 ATOM 144 N ALA 20 17.789 15.978 -3.562 1.00 0.00 ATOM 145 CA ALA 20 17.898 17.435 -3.543 1.00 0.00 ATOM 146 CB ALA 20 18.785 17.924 -4.687 1.00 0.00 ATOM 147 O ALA 20 16.257 19.099 -2.954 1.00 0.00 ATOM 148 C ALA 20 16.531 18.100 -3.641 1.00 0.00 ATOM 149 N ILE 21 15.683 17.558 -4.510 1.00 0.00 ATOM 150 CA ILE 21 14.337 18.087 -4.675 1.00 0.00 ATOM 151 CB ILE 21 13.577 17.326 -5.796 1.00 0.00 ATOM 152 CG1 ILE 21 14.196 17.680 -7.150 1.00 0.00 ATOM 153 CG2 ILE 21 12.083 17.691 -5.783 1.00 0.00 ATOM 154 CD1 ILE 21 13.684 16.852 -8.316 1.00 0.00 ATOM 155 O ILE 21 12.832 18.913 -2.992 1.00 0.00 ATOM 156 C ILE 21 13.582 18.006 -3.341 1.00 0.00 ATOM 157 N ILE 22 13.814 16.923 -2.605 1.00 0.00 ATOM 158 CA ILE 22 13.159 16.731 -1.283 1.00 0.00 ATOM 159 CB ILE 22 13.344 15.277 -0.826 1.00 0.00 ATOM 160 CG1 ILE 22 12.506 14.337 -1.694 1.00 0.00 ATOM 161 CG2 ILE 22 13.026 15.131 0.689 1.00 0.00 ATOM 162 CD1 ILE 22 12.908 12.836 -1.533 1.00 0.00 ATOM 163 O ILE 22 12.865 18.351 0.489 1.00 0.00 ATOM 164 C ILE 22 13.683 17.779 -0.300 1.00 0.00 ATOM 165 N LYS 23 14.965 18.090 -0.417 1.00 0.00 ATOM 166 CA LYS 23 15.586 19.120 0.441 1.00 0.00 ATOM 167 CB LYS 23 17.076 19.035 0.354 1.00 0.00 ATOM 168 CG LYS 23 17.784 19.605 1.554 1.00 0.00 ATOM 169 CD LYS 23 19.271 19.398 1.415 1.00 0.00 ATOM 170 CE LYS 23 20.025 19.984 2.582 1.00 0.00 ATOM 171 NZ LYS 23 21.481 19.749 2.417 1.00 0.00 ATOM 172 O LYS 23 14.624 21.269 1.072 1.00 0.00 ATOM 173 C LYS 23 14.933 20.480 0.149 1.00 0.00 ATOM 174 N MET 24 14.716 20.779 -1.135 1.00 0.00 ATOM 175 CA MET 24 14.070 22.064 -1.445 1.00 0.00 ATOM 176 CB MET 24 14.101 22.307 -2.948 1.00 0.00 ATOM 177 CG MET 24 15.493 22.477 -3.515 1.00 0.00 ATOM 178 SD MET 24 15.448 22.603 -5.319 1.00 0.00 ATOM 179 CE MET 24 14.336 23.929 -5.528 1.00 0.00 ATOM 180 O MET 24 12.191 23.102 -0.354 1.00 0.00 ATOM 181 C MET 24 12.622 22.117 -0.967 1.00 0.00 ATOM 182 N ALA 25 11.869 21.068 -1.264 1.00 0.00 ATOM 183 CA ALA 25 10.469 21.041 -0.868 1.00 0.00 ATOM 184 CB ALA 25 9.806 19.784 -1.442 1.00 0.00 ATOM 185 O ALA 25 9.430 21.716 1.191 1.00 0.00 ATOM 186 C ALA 25 10.320 21.057 0.650 1.00 0.00 ATOM 187 N LYS 26 11.214 20.347 1.327 1.00 0.00 ATOM 188 CA LYS 26 11.204 20.280 2.780 1.00 0.00 ATOM 189 CB LYS 26 12.327 19.359 3.267 1.00 0.00 ATOM 190 CG LYS 26 12.422 19.241 4.782 1.00 0.00 ATOM 191 CD LYS 26 13.698 18.515 5.209 1.00 0.00 ATOM 192 CE LYS 26 13.823 17.153 4.548 1.00 0.00 ATOM 193 NZ LYS 26 15.135 16.498 4.853 1.00 0.00 ATOM 194 O LYS 26 10.724 22.047 4.320 1.00 0.00 ATOM 195 C LYS 26 11.412 21.668 3.377 1.00 0.00 ATOM 196 N SER 27 12.338 22.435 2.801 1.00 0.00 ATOM 197 CA SER 27 12.615 23.778 3.304 1.00 0.00 ATOM 198 CB SER 27 13.795 24.421 2.555 1.00 0.00 ATOM 199 OG SER 27 13.473 24.735 1.212 1.00 0.00 ATOM 200 O SER 27 11.106 25.459 4.119 1.00 0.00 ATOM 201 C SER 27 11.375 24.670 3.215 1.00 0.00 ATOM 202 N MET 28 10.589 24.489 2.159 1.00 0.00 ATOM 203 CA MET 28 9.381 25.282 1.969 1.00 0.00 ATOM 204 CB MET 28 8.776 25.144 0.596 1.00 0.00 ATOM 205 CG MET 28 9.657 25.768 -0.441 1.00 0.00 ATOM 206 SD MET 28 10.182 27.529 -0.320 1.00 0.00 ATOM 207 CE MET 28 11.768 27.146 0.466 1.00 0.00 ATOM 208 O MET 28 7.608 25.735 3.507 1.00 0.00 ATOM 209 C MET 28 8.268 24.879 2.933 1.00 0.00 ATOM 210 N VAL 29 8.076 23.575 3.126 1.00 0.00 ATOM 211 CA VAL 29 7.034 23.106 4.041 1.00 0.00 ATOM 212 CB VAL 29 6.756 21.597 3.925 1.00 0.00 ATOM 213 CG1 VAL 29 6.220 21.297 2.528 1.00 0.00 ATOM 214 CG2 VAL 29 8.019 20.779 4.197 1.00 0.00 ATOM 215 O VAL 29 6.489 23.766 6.286 1.00 0.00 ATOM 216 C VAL 29 7.378 23.502 5.473 1.00 0.00 ATOM 217 N MET 30 8.674 23.555 5.769 1.00 0.00 ATOM 218 CA MET 30 9.137 23.956 7.090 1.00 0.00 ATOM 219 CB MET 30 10.632 23.738 7.226 1.00 0.00 ATOM 220 CG MET 30 11.019 22.268 7.241 1.00 0.00 ATOM 221 SD MET 30 12.793 22.038 7.285 1.00 0.00 ATOM 222 CE MET 30 12.908 20.315 7.817 1.00 0.00 ATOM 223 O MET 30 8.303 25.794 8.339 1.00 0.00 ATOM 224 C MET 30 8.793 25.423 7.290 1.00 0.00 ATOM 225 N ALA 31 9.051 26.269 6.293 1.00 0.00 ATOM 226 CA ALA 31 8.733 27.690 6.411 1.00 0.00 ATOM 227 CB ALA 31 9.295 28.459 5.217 1.00 0.00 ATOM 228 O ALA 31 6.844 28.839 7.336 1.00 0.00 ATOM 229 C ALA 31 7.242 27.919 6.621 1.00 0.00 ATOM 230 N ASP 32 6.423 27.080 5.947 1.00 0.00 ATOM 231 CA ASP 32 4.968 27.176 6.042 1.00 0.00 ATOM 232 CB ASP 32 4.232 26.405 5.026 1.00 0.00 ATOM 233 CG ASP 32 4.433 26.950 3.626 1.00 0.00 ATOM 234 OD1 ASP 32 4.977 28.076 3.495 1.00 0.00 ATOM 235 OD2 ASP 32 4.041 26.260 2.658 1.00 0.00 ATOM 236 O ASP 32 3.307 26.988 7.770 1.00 0.00 ATOM 237 C ASP 32 4.474 26.780 7.432 1.00 0.00 ATOM 238 N GLY 33 5.365 26.182 8.220 1.00 0.00 ATOM 239 CA GLY 33 5.024 25.756 9.566 1.00 0.00 ATOM 240 O GLY 33 3.645 24.137 10.674 1.00 0.00 ATOM 241 C GLY 33 4.223 24.467 9.634 1.00 0.00 ATOM 242 N LYS 34 4.181 23.698 8.555 1.00 0.00 ATOM 243 CA LYS 34 3.435 22.449 8.534 1.00 0.00 ATOM 244 CB LYS 34 2.750 22.291 7.192 1.00 0.00 ATOM 245 CG LYS 34 1.656 23.373 7.029 1.00 0.00 ATOM 246 CD LYS 34 0.841 23.196 5.751 1.00 0.00 ATOM 247 CE LYS 34 -0.020 24.428 5.475 1.00 0.00 ATOM 248 NZ LYS 34 -0.868 24.815 6.665 1.00 0.00 ATOM 249 O LYS 34 3.887 20.128 8.925 1.00 0.00 ATOM 250 C LYS 34 4.350 21.234 8.654 1.00 0.00 ATOM 251 N ILE 35 5.604 21.420 8.440 1.00 0.00 ATOM 252 CA ILE 35 6.549 20.317 8.547 1.00 0.00 ATOM 253 CB ILE 35 7.088 19.903 7.136 1.00 0.00 ATOM 254 CG1 ILE 35 5.948 19.404 6.232 1.00 0.00 ATOM 255 CG2 ILE 35 8.181 18.819 7.266 1.00 0.00 ATOM 256 CD1 ILE 35 5.337 18.131 6.691 1.00 0.00 ATOM 257 O ILE 35 8.267 21.819 9.290 1.00 0.00 ATOM 258 C ILE 35 7.743 20.706 9.408 1.00 0.00 ATOM 259 N LYS 36 8.150 19.794 10.285 1.00 0.00 ATOM 260 CA LYS 36 9.277 20.020 11.188 1.00 0.00 ATOM 261 CB LYS 36 8.791 20.238 12.610 1.00 0.00 ATOM 262 CG LYS 36 7.844 21.414 12.738 1.00 0.00 ATOM 263 CD LYS 36 7.755 21.947 14.154 1.00 0.00 ATOM 264 CE LYS 36 7.121 20.963 15.100 1.00 0.00 ATOM 265 NZ LYS 36 6.942 21.603 16.438 1.00 0.00 ATOM 266 O LYS 36 9.702 17.688 10.818 1.00 0.00 ATOM 267 C LYS 36 10.138 18.763 11.231 1.00 0.00 ATOM 268 N PRO 37 11.347 18.903 11.766 1.00 0.00 ATOM 269 CA PRO 37 12.248 17.746 11.850 1.00 0.00 ATOM 270 CB PRO 37 13.490 18.321 12.535 1.00 0.00 ATOM 271 CG PRO 37 13.461 19.763 12.221 1.00 0.00 ATOM 272 CD PRO 37 12.027 20.155 12.147 1.00 0.00 ATOM 273 O PRO 37 11.750 15.435 12.244 1.00 0.00 ATOM 274 C PRO 37 11.645 16.589 12.655 1.00 0.00 ATOM 275 N ALA 38 11.017 16.886 13.785 1.00 0.00 ATOM 276 CA ALA 38 10.427 15.844 14.615 1.00 0.00 ATOM 277 CB ALA 38 9.987 16.411 15.952 1.00 0.00 ATOM 278 O ALA 38 9.120 13.953 13.922 1.00 0.00 ATOM 279 C ALA 38 9.258 15.168 13.906 1.00 0.00 ATOM 280 N GLU 39 8.394 15.968 13.285 1.00 0.00 ATOM 281 CA GLU 39 7.251 15.410 12.570 1.00 0.00 ATOM 282 CB GLU 39 6.389 16.545 12.011 1.00 0.00 ATOM 283 CG GLU 39 5.668 17.357 13.074 1.00 0.00 ATOM 284 CD GLU 39 4.924 18.545 12.495 1.00 0.00 ATOM 285 OE1 GLU 39 5.032 18.776 11.272 1.00 0.00 ATOM 286 OE2 GLU 39 4.234 19.247 13.265 1.00 0.00 ATOM 287 O GLU 39 7.181 13.456 11.167 1.00 0.00 ATOM 288 C GLU 39 7.731 14.539 11.403 1.00 0.00 ATOM 289 N ILE 40 8.755 15.010 10.710 1.00 0.00 ATOM 290 CA ILE 40 9.297 14.253 9.580 1.00 0.00 ATOM 291 CB ILE 40 10.429 15.038 8.887 1.00 0.00 ATOM 292 CG1 ILE 40 9.863 16.270 8.177 1.00 0.00 ATOM 293 CG2 ILE 40 11.129 14.168 7.858 1.00 0.00 ATOM 294 CD1 ILE 40 10.923 17.240 7.703 1.00 0.00 ATOM 295 O ILE 40 9.598 11.871 9.473 1.00 0.00 ATOM 296 C ILE 40 9.846 12.935 10.084 1.00 0.00 ATOM 297 N ALA 41 10.651 13.016 11.169 1.00 0.00 ATOM 298 CA ALA 41 11.256 11.809 11.739 1.00 0.00 ATOM 299 CB ALA 41 12.097 12.126 12.972 1.00 0.00 ATOM 300 O ALA 41 10.298 9.602 11.858 1.00 0.00 ATOM 301 C ALA 41 10.203 10.793 12.167 1.00 0.00 ATOM 302 N VAL 42 9.173 11.251 12.861 1.00 0.00 ATOM 303 CA VAL 42 8.081 10.375 13.291 1.00 0.00 ATOM 304 CB VAL 42 7.043 11.094 14.175 1.00 0.00 ATOM 305 CG1 VAL 42 5.844 10.194 14.428 1.00 0.00 ATOM 306 CG2 VAL 42 7.655 11.470 15.515 1.00 0.00 ATOM 307 O VAL 42 6.996 8.613 12.078 1.00 0.00 ATOM 308 C VAL 42 7.339 9.797 12.090 1.00 0.00 ATOM 309 N MET 43 7.106 10.629 11.081 1.00 0.00 ATOM 310 CA MET 43 6.405 10.195 9.876 1.00 0.00 ATOM 311 CB MET 43 6.203 11.374 8.921 1.00 0.00 ATOM 312 CG MET 43 5.489 11.010 7.629 1.00 0.00 ATOM 313 SD MET 43 5.332 12.410 6.503 1.00 0.00 ATOM 314 CE MET 43 7.024 12.587 5.946 1.00 0.00 ATOM 315 O MET 43 6.641 8.096 8.732 1.00 0.00 ATOM 316 C MET 43 7.199 9.114 9.146 1.00 0.00 ATOM 317 N THR 44 8.498 9.341 8.975 1.00 0.00 ATOM 318 CA THR 44 9.345 8.371 8.294 1.00 0.00 ATOM 319 CB THR 44 10.795 8.874 8.180 1.00 0.00 ATOM 320 CG2 THR 44 11.654 7.924 7.406 1.00 0.00 ATOM 321 OG1 THR 44 10.817 10.063 7.352 1.00 0.00 ATOM 322 O THR 44 9.261 5.972 8.512 1.00 0.00 ATOM 323 C THR 44 9.374 7.059 9.087 1.00 0.00 ATOM 324 N ARG 45 9.486 7.171 10.391 1.00 0.00 ATOM 325 CA ARG 45 9.495 5.981 11.239 1.00 0.00 ATOM 326 CB ARG 45 9.860 6.343 12.650 1.00 0.00 ATOM 327 CG ARG 45 11.277 6.838 12.798 1.00 0.00 ATOM 328 CD ARG 45 11.649 6.967 14.253 1.00 0.00 ATOM 329 NE ARG 45 13.060 7.227 14.496 1.00 0.00 ATOM 330 CZ ARG 45 13.657 8.411 14.599 1.00 0.00 ATOM 331 NH1 ARG 45 12.985 9.515 14.384 1.00 0.00 ATOM 332 NH2 ARG 45 14.947 8.447 14.887 1.00 0.00 ATOM 333 O ARG 45 8.131 4.021 11.204 1.00 0.00 ATOM 334 C ARG 45 8.162 5.242 11.178 1.00 0.00 ATOM 335 N GLU 46 7.062 5.983 11.083 1.00 0.00 ATOM 336 CA GLU 46 5.759 5.345 10.933 1.00 0.00 ATOM 337 CB GLU 46 4.674 6.331 10.873 1.00 0.00 ATOM 338 CG GLU 46 3.333 5.739 10.879 1.00 0.00 ATOM 339 CD GLU 46 2.213 6.740 11.032 1.00 0.00 ATOM 340 OE1 GLU 46 2.478 7.947 11.093 1.00 0.00 ATOM 341 OE2 GLU 46 1.063 6.281 11.133 1.00 0.00 ATOM 342 O GLU 46 5.219 3.405 9.614 1.00 0.00 ATOM 343 C GLU 46 5.689 4.547 9.633 1.00 0.00 ATOM 344 N PHE 47 6.163 5.160 8.534 1.00 0.00 ATOM 345 CA PHE 47 6.129 4.454 7.258 1.00 0.00 ATOM 346 CB PHE 47 6.553 5.430 6.127 1.00 0.00 ATOM 347 CG PHE 47 6.507 4.836 4.745 1.00 0.00 ATOM 348 CD1 PHE 47 5.305 4.680 4.080 1.00 0.00 ATOM 349 CD2 PHE 47 7.666 4.440 4.106 1.00 0.00 ATOM 350 CE1 PHE 47 5.262 4.132 2.798 1.00 0.00 ATOM 351 CE2 PHE 47 7.621 3.900 2.829 1.00 0.00 ATOM 352 CZ PHE 47 6.420 3.745 2.180 1.00 0.00 ATOM 353 O PHE 47 6.659 2.152 6.766 1.00 0.00 ATOM 354 C PHE 47 7.019 3.205 7.299 1.00 0.00 ATOM 355 N MET 48 8.204 3.285 7.941 1.00 0.00 ATOM 356 CA MET 48 9.075 2.148 8.036 1.00 0.00 ATOM 357 CB MET 48 10.384 2.500 8.702 1.00 0.00 ATOM 358 CG MET 48 11.293 3.386 7.836 1.00 0.00 ATOM 359 SD MET 48 11.424 2.860 6.137 1.00 0.00 ATOM 360 CE MET 48 12.056 1.197 6.332 1.00 0.00 ATOM 361 O MET 48 8.588 -0.149 8.501 1.00 0.00 ATOM 362 C MET 48 8.440 1.022 8.848 1.00 0.00 ATOM 363 N ARG 49 7.681 1.387 9.882 1.00 0.00 ATOM 364 CA ARG 49 6.995 0.386 10.703 1.00 0.00 ATOM 365 CB ARG 49 6.331 1.089 11.913 1.00 0.00 ATOM 366 CG ARG 49 5.827 0.073 12.968 1.00 0.00 ATOM 367 CD ARG 49 4.797 0.607 13.949 1.00 0.00 ATOM 368 NE ARG 49 5.140 1.933 14.429 1.00 0.00 ATOM 369 CZ ARG 49 4.439 3.050 14.190 1.00 0.00 ATOM 370 NH1 ARG 49 3.299 3.008 13.492 1.00 0.00 ATOM 371 NH2 ARG 49 4.881 4.210 14.666 1.00 0.00 ATOM 372 O ARG 49 5.802 -1.583 9.991 1.00 0.00 ATOM 373 C ARG 49 5.962 -0.345 9.861 1.00 0.00 ATOM 374 N PHE 50 5.234 0.373 8.990 1.00 0.00 ATOM 375 CA PHE 50 4.273 -0.305 8.139 1.00 0.00 ATOM 376 CB PHE 50 3.461 0.758 7.398 1.00 0.00 ATOM 377 CG PHE 50 2.529 1.537 8.282 1.00 0.00 ATOM 378 CD1 PHE 50 2.183 1.060 9.536 1.00 0.00 ATOM 379 CD2 PHE 50 2.000 2.745 7.862 1.00 0.00 ATOM 380 CE1 PHE 50 1.326 1.777 10.350 1.00 0.00 ATOM 381 CE2 PHE 50 1.142 3.461 8.678 1.00 0.00 ATOM 382 CZ PHE 50 0.805 2.980 9.917 1.00 0.00 ATOM 383 O PHE 50 4.614 -2.328 6.883 1.00 0.00 ATOM 384 C PHE 50 5.041 -1.217 7.182 1.00 0.00 ATOM 385 N GLY 51 6.195 -0.741 6.689 1.00 0.00 ATOM 386 CA GLY 51 6.984 -1.578 5.798 1.00 0.00 ATOM 387 O GLY 51 7.275 -3.953 5.898 1.00 0.00 ATOM 388 C GLY 51 7.384 -2.873 6.480 1.00 0.00 ATOM 389 N ILE 52 7.848 -2.771 7.723 1.00 0.00 ATOM 390 CA ILE 52 8.256 -3.939 8.495 1.00 0.00 ATOM 391 CB ILE 52 8.954 -3.472 9.831 1.00 0.00 ATOM 392 CG1 ILE 52 10.327 -2.896 9.518 1.00 0.00 ATOM 393 CG2 ILE 52 8.953 -4.547 10.878 1.00 0.00 ATOM 394 CD1 ILE 52 10.933 -2.235 10.753 1.00 0.00 ATOM 395 O ILE 52 7.260 -6.113 8.703 1.00 0.00 ATOM 396 C ILE 52 7.090 -4.895 8.723 1.00 0.00 ATOM 397 N LEU 53 5.905 -4.335 8.945 1.00 0.00 ATOM 398 CA LEU 53 4.703 -5.133 9.131 1.00 0.00 ATOM 399 CB LEU 53 3.499 -4.232 9.408 1.00 0.00 ATOM 400 CG LEU 53 3.480 -3.522 10.764 1.00 0.00 ATOM 401 CD1 LEU 53 2.332 -2.527 10.834 1.00 0.00 ATOM 402 CD2 LEU 53 3.309 -4.526 11.893 1.00 0.00 ATOM 403 O LEU 53 4.064 -7.134 7.969 1.00 0.00 ATOM 404 C LEU 53 4.408 -5.956 7.881 1.00 0.00 ATOM 405 N GLN 54 4.579 -5.337 6.718 1.00 0.00 ATOM 406 CA GLN 54 4.362 -6.018 5.448 1.00 0.00 ATOM 407 CB GLN 54 4.549 -5.047 4.281 1.00 0.00 ATOM 408 CG GLN 54 4.224 -5.642 2.922 1.00 0.00 ATOM 409 CD GLN 54 2.766 -6.037 2.792 1.00 0.00 ATOM 410 OE1 GLN 54 1.872 -5.275 3.158 1.00 0.00 ATOM 411 NE2 GLN 54 2.522 -7.232 2.267 1.00 0.00 ATOM 412 O GLN 54 4.976 -8.285 4.900 1.00 0.00 ATOM 413 C GLN 54 5.352 -7.177 5.308 1.00 0.00 ATOM 414 N ASP 55 6.609 -6.922 5.642 1.00 0.00 ATOM 415 CA ASP 55 7.617 -7.986 5.567 1.00 0.00 ATOM 416 CB ASP 55 8.984 -7.418 5.953 1.00 0.00 ATOM 417 CG ASP 55 9.561 -6.511 4.881 1.00 0.00 ATOM 418 OD1 ASP 55 9.024 -6.508 3.755 1.00 0.00 ATOM 419 OD2 ASP 55 10.549 -5.805 5.172 1.00 0.00 ATOM 420 O ASP 55 7.433 -10.285 6.211 1.00 0.00 ATOM 421 C ASP 55 7.287 -9.114 6.545 1.00 0.00 ATOM 422 N GLN 56 6.822 -8.769 7.738 1.00 0.00 ATOM 423 CA GLN 56 6.487 -9.811 8.708 1.00 0.00 ATOM 424 CB GLN 56 6.123 -9.197 10.038 1.00 0.00 ATOM 425 CG GLN 56 7.350 -8.544 10.677 1.00 0.00 ATOM 426 CD GLN 56 7.102 -7.856 11.980 1.00 0.00 ATOM 427 OE1 GLN 56 5.986 -7.380 12.281 1.00 0.00 ATOM 428 NE2 GLN 56 8.162 -7.717 12.778 1.00 0.00 ATOM 429 O GLN 56 5.362 -11.897 8.345 1.00 0.00 ATOM 430 C GLN 56 5.327 -10.671 8.230 1.00 0.00 ATOM 431 N VAL 57 4.289 -10.037 7.691 1.00 0.00 ATOM 432 CA VAL 57 3.132 -10.766 7.193 1.00 0.00 ATOM 433 CB VAL 57 1.884 -9.863 6.917 1.00 0.00 ATOM 434 CG1 VAL 57 1.427 -9.187 8.212 1.00 0.00 ATOM 435 CG2 VAL 57 2.132 -8.873 5.777 1.00 0.00 ATOM 436 O VAL 57 2.900 -12.739 5.844 1.00 0.00 ATOM 437 C VAL 57 3.430 -11.635 5.977 1.00 0.00 ATOM 438 N ASP 58 4.282 -11.123 5.088 1.00 0.00 ATOM 439 CA ASP 58 4.685 -11.880 3.914 1.00 0.00 ATOM 440 CB ASP 58 5.434 -10.984 2.928 1.00 0.00 ATOM 441 CG ASP 58 4.538 -9.926 2.318 1.00 0.00 ATOM 442 OD1 ASP 58 3.357 -10.238 2.055 1.00 0.00 ATOM 443 OD2 ASP 58 5.008 -8.792 2.094 1.00 0.00 ATOM 444 O ASP 58 5.436 -14.150 3.766 1.00 0.00 ATOM 445 C ASP 58 5.528 -13.070 4.348 1.00 0.00 ATOM 446 N LEU 59 6.353 -12.866 5.386 1.00 0.00 ATOM 447 CA LEU 59 7.186 -13.941 5.908 1.00 0.00 ATOM 448 CB LEU 59 8.172 -13.382 6.940 1.00 0.00 ATOM 449 CG LEU 59 9.245 -12.437 6.383 1.00 0.00 ATOM 450 CD1 LEU 59 10.000 -11.764 7.518 1.00 0.00 ATOM 451 CD2 LEU 59 10.199 -13.218 5.499 1.00 0.00 ATOM 452 O LEU 59 6.528 -16.220 6.289 1.00 0.00 ATOM 453 C LEU 59 6.300 -15.033 6.511 1.00 0.00 ATOM 454 N LEU 60 5.284 -14.627 7.269 1.00 0.00 ATOM 455 CA LEU 60 4.364 -15.584 7.878 1.00 0.00 ATOM 456 CB LEU 60 3.419 -14.792 8.788 1.00 0.00 ATOM 457 CG LEU 60 2.254 -15.554 9.381 1.00 0.00 ATOM 458 CD1 LEU 60 2.712 -16.763 10.269 1.00 0.00 ATOM 459 CD2 LEU 60 1.361 -14.563 10.146 1.00 0.00 ATOM 460 O LEU 60 3.449 -17.576 6.911 1.00 0.00 ATOM 461 C LEU 60 3.644 -16.370 6.792 1.00 0.00 ATOM 462 N LEU 61 3.255 -15.663 5.736 1.00 0.00 ATOM 463 CA LEU 61 2.557 -16.293 4.612 1.00 0.00 ATOM 464 CB LEU 61 2.018 -15.216 3.633 1.00 0.00 ATOM 465 CG LEU 61 1.332 -15.742 2.363 1.00 0.00 ATOM 466 CD1 LEU 61 0.143 -16.658 2.663 1.00 0.00 ATOM 467 CD2 LEU 61 0.915 -14.578 1.505 1.00 0.00 ATOM 468 O LEU 61 3.076 -18.425 3.611 1.00 0.00 ATOM 469 C LEU 61 3.490 -17.317 3.957 1.00 0.00 ATOM 470 N LYS 62 4.739 -16.951 3.760 1.00 0.00 ATOM 471 CA LYS 62 5.675 -17.884 3.155 1.00 0.00 ATOM 472 CB LYS 62 7.010 -17.195 2.812 1.00 0.00 ATOM 473 CG LYS 62 6.973 -16.437 1.523 1.00 0.00 ATOM 474 CD LYS 62 8.192 -15.541 1.308 1.00 0.00 ATOM 475 CE LYS 62 8.075 -14.611 0.107 1.00 0.00 ATOM 476 NZ LYS 62 9.266 -13.762 -0.058 1.00 0.00 ATOM 477 O LYS 62 6.095 -20.191 3.538 1.00 0.00 ATOM 478 C LYS 62 5.955 -19.081 4.035 1.00 0.00 ATOM 479 N ALA 63 6.029 -18.878 5.330 1.00 0.00 ATOM 480 CA ALA 63 6.358 -19.953 6.262 1.00 0.00 ATOM 481 CB ALA 63 7.007 -19.321 7.505 1.00 0.00 ATOM 482 O ALA 63 5.249 -21.756 7.389 1.00 0.00 ATOM 483 C ALA 63 5.131 -20.750 6.703 1.00 0.00 ATOM 484 N SER 64 3.967 -20.328 6.318 1.00 0.00 ATOM 485 CA SER 64 2.758 -21.021 6.715 1.00 0.00 ATOM 486 CB SER 64 1.983 -20.118 7.601 1.00 0.00 ATOM 487 OG SER 64 0.785 -20.732 8.011 1.00 0.00 ATOM 488 O SER 64 1.413 -20.354 4.855 1.00 0.00 ATOM 489 C SER 64 1.909 -21.288 5.479 1.00 0.00 ATOM 490 N ASP 65 1.743 -22.526 5.190 1.00 0.00 ATOM 491 CA ASP 65 0.887 -22.866 4.052 1.00 0.00 ATOM 492 CB ASP 65 1.179 -24.262 3.500 1.00 0.00 ATOM 493 CG ASP 65 1.044 -25.345 4.552 1.00 0.00 ATOM 494 OD1 ASP 65 0.736 -25.010 5.713 1.00 0.00 ATOM 495 OD2 ASP 65 1.249 -26.531 4.214 1.00 0.00 ATOM 496 O ASP 65 -1.406 -23.572 4.088 1.00 0.00 ATOM 497 C ASP 65 -0.539 -22.860 4.593 1.00 0.00 ATOM 498 N SER 66 -0.761 -21.962 5.633 1.00 0.00 ATOM 499 CA SER 66 -2.082 -21.857 6.241 1.00 0.00 ATOM 500 CB SER 66 -1.963 -21.522 7.729 1.00 0.00 ATOM 501 OG SER 66 -3.238 -21.312 8.309 1.00 0.00 ATOM 502 O SER 66 -2.465 -19.592 5.535 1.00 0.00 ATOM 503 C SER 66 -2.915 -20.740 5.629 1.00 0.00 ATOM 504 N ILE 67 -4.132 -21.105 5.181 1.00 0.00 ATOM 505 CA ILE 67 -5.037 -20.129 4.581 1.00 0.00 ATOM 506 CB ILE 67 -6.310 -20.812 4.049 1.00 0.00 ATOM 507 CG1 ILE 67 -5.972 -21.723 2.867 1.00 0.00 ATOM 508 CG2 ILE 67 -7.317 -19.772 3.583 1.00 0.00 ATOM 509 CD1 ILE 67 -7.111 -22.628 2.450 1.00 0.00 ATOM 510 O ILE 67 -5.595 -17.884 5.219 1.00 0.00 ATOM 511 C ILE 67 -5.441 -19.051 5.580 1.00 0.00 ATOM 512 N GLU 68 -5.613 -19.449 6.836 1.00 0.00 ATOM 513 CA GLU 68 -5.992 -18.517 7.892 1.00 0.00 ATOM 514 CB GLU 68 -6.185 -19.327 9.198 1.00 0.00 ATOM 515 CG GLU 68 -7.377 -20.268 9.188 1.00 0.00 ATOM 516 CD GLU 68 -7.065 -21.671 8.688 1.00 0.00 ATOM 517 OE1 GLU 68 -6.022 -21.929 8.081 1.00 0.00 ATOM 518 OE2 GLU 68 -7.925 -22.565 8.937 1.00 0.00 ATOM 519 O GLU 68 -5.240 -16.244 8.183 1.00 0.00 ATOM 520 C GLU 68 -4.927 -17.446 8.080 1.00 0.00 ATOM 521 N ALA 69 -3.682 -17.866 8.091 1.00 0.00 ATOM 522 CA ALA 69 -2.547 -16.946 8.256 1.00 0.00 ATOM 523 CB ALA 69 -1.258 -17.716 8.499 1.00 0.00 ATOM 524 O ALA 69 -2.169 -14.858 7.129 1.00 0.00 ATOM 525 C ALA 69 -2.332 -16.075 7.024 1.00 0.00 ATOM 526 N SER 70 -2.289 -16.710 5.858 1.00 0.00 ATOM 527 CA SER 70 -2.269 -15.985 4.592 1.00 0.00 ATOM 528 CB SER 70 -2.268 -16.966 3.418 1.00 0.00 ATOM 529 OG SER 70 -3.475 -17.709 3.374 1.00 0.00 ATOM 530 O SER 70 -3.439 -13.921 4.094 1.00 0.00 ATOM 531 C SER 70 -3.507 -15.062 4.552 1.00 0.00 ATOM 532 N GLN 71 -4.637 -15.543 5.051 1.00 0.00 ATOM 533 CA GLN 71 -5.839 -14.722 5.044 1.00 0.00 ATOM 534 CB GLN 71 -7.011 -15.397 5.646 1.00 0.00 ATOM 535 CG GLN 71 -7.876 -16.063 4.618 1.00 0.00 ATOM 536 CD GLN 71 -9.223 -16.405 5.207 1.00 0.00 ATOM 537 OE1 GLN 71 -9.314 -17.223 6.121 1.00 0.00 ATOM 538 NE2 GLN 71 -10.278 -15.754 4.711 1.00 0.00 ATOM 539 O GLN 71 -6.025 -12.415 5.654 1.00 0.00 ATOM 540 C GLN 71 -5.680 -13.543 5.998 1.00 0.00 ATOM 541 N ALA 72 -5.070 -13.784 7.128 1.00 0.00 ATOM 542 CA ALA 72 -4.867 -12.731 8.119 1.00 0.00 ATOM 543 CB ALA 72 -4.327 -13.339 9.405 1.00 0.00 ATOM 544 O ALA 72 -4.210 -10.463 7.719 1.00 0.00 ATOM 545 C ALA 72 -3.924 -11.666 7.600 1.00 0.00 ATOM 546 N VAL 73 -2.847 -12.119 7.032 1.00 0.00 ATOM 547 CA VAL 73 -1.865 -11.182 6.516 1.00 0.00 ATOM 548 CB VAL 73 -0.546 -11.841 6.068 1.00 0.00 ATOM 549 CG1 VAL 73 0.069 -12.630 7.213 1.00 0.00 ATOM 550 CG2 VAL 73 -0.794 -12.795 4.909 1.00 0.00 ATOM 551 O VAL 73 -2.003 -9.193 5.178 1.00 0.00 ATOM 552 C VAL 73 -2.370 -10.357 5.337 1.00 0.00 ATOM 553 N ALA 74 -3.178 -10.982 4.488 1.00 0.00 ATOM 554 CA ALA 74 -3.790 -10.290 3.360 1.00 0.00 ATOM 555 CB ALA 74 -4.725 -11.223 2.609 1.00 0.00 ATOM 556 O ALA 74 -4.643 -8.054 3.354 1.00 0.00 ATOM 557 C ALA 74 -4.614 -9.129 3.921 1.00 0.00 ATOM 558 N LEU 75 -5.231 -9.399 5.064 1.00 0.00 ATOM 559 CA LEU 75 -5.973 -8.327 5.713 1.00 0.00 ATOM 560 CB LEU 75 -6.771 -8.989 6.892 1.00 0.00 ATOM 561 CG LEU 75 -7.609 -7.983 7.711 1.00 0.00 ATOM 562 CD1 LEU 75 -8.724 -7.390 6.877 1.00 0.00 ATOM 563 CD2 LEU 75 -8.144 -8.651 8.957 1.00 0.00 ATOM 564 O LEU 75 -5.480 -6.049 5.982 1.00 0.00 ATOM 565 C LEU 75 -5.108 -7.227 6.174 1.00 0.00 ATOM 566 N ILE 76 -3.985 -7.529 6.774 1.00 0.00 ATOM 567 CA ILE 76 -3.061 -6.563 7.226 1.00 0.00 ATOM 568 CB ILE 76 -1.884 -7.255 7.911 1.00 0.00 ATOM 569 CG1 ILE 76 -2.420 -8.026 9.125 1.00 0.00 ATOM 570 CG2 ILE 76 -0.813 -6.213 8.306 1.00 0.00 ATOM 571 CD1 ILE 76 -1.396 -8.836 9.893 1.00 0.00 ATOM 572 O ILE 76 -2.454 -4.477 6.238 1.00 0.00 ATOM 573 C ILE 76 -2.575 -5.685 6.075 1.00 0.00 ATOM 574 N ALA 77 -2.276 -6.295 4.931 1.00 0.00 ATOM 575 CA ALA 77 -1.813 -5.532 3.770 1.00 0.00 ATOM 576 CB ALA 77 -1.423 -6.462 2.622 1.00 0.00 ATOM 577 O ALA 77 -2.520 -3.450 2.808 1.00 0.00 ATOM 578 C ALA 77 -2.859 -4.532 3.291 1.00 0.00 ATOM 579 N ARG 78 -4.134 -4.912 3.356 1.00 0.00 ATOM 580 CA ARG 78 -5.206 -3.987 2.991 1.00 0.00 ATOM 581 CB ARG 78 -6.572 -4.606 3.205 1.00 0.00 ATOM 582 CG ARG 78 -7.724 -3.673 2.847 1.00 0.00 ATOM 583 CD ARG 78 -9.036 -4.423 2.677 1.00 0.00 ATOM 584 NE ARG 78 -9.003 -5.301 1.508 1.00 0.00 ATOM 585 CZ ARG 78 -10.042 -5.996 1.064 1.00 0.00 ATOM 586 NH1 ARG 78 -9.913 -6.768 -0.010 1.00 0.00 ATOM 587 NH2 ARG 78 -11.213 -5.922 1.685 1.00 0.00 ATOM 588 O ARG 78 -5.171 -1.608 3.357 1.00 0.00 ATOM 589 C ARG 78 -5.145 -2.736 3.863 1.00 0.00 ATOM 590 N MET 79 -5.021 -2.914 5.169 1.00 0.00 ATOM 591 CA MET 79 -4.979 -1.779 6.084 1.00 0.00 ATOM 592 CB MET 79 -5.000 -2.290 7.506 1.00 0.00 ATOM 593 CG MET 79 -6.206 -3.046 7.869 1.00 0.00 ATOM 594 SD MET 79 -7.656 -2.028 8.026 1.00 0.00 ATOM 595 CE MET 79 -7.161 -0.698 8.203 1.00 0.00 ATOM 596 O MET 79 -3.713 0.250 6.077 1.00 0.00 ATOM 597 C MET 79 -3.698 -0.966 5.926 1.00 0.00 ATOM 598 N ASP 80 -2.667 -1.853 5.598 1.00 0.00 ATOM 599 CA ASP 80 -1.334 -1.299 5.384 1.00 0.00 ATOM 600 CB ASP 80 -0.331 -2.443 5.217 1.00 0.00 ATOM 601 CG ASP 80 -0.081 -3.193 6.512 1.00 0.00 ATOM 602 OD1 ASP 80 -0.487 -2.687 7.579 1.00 0.00 ATOM 603 OD2 ASP 80 0.519 -4.288 6.459 1.00 0.00 ATOM 604 O ASP 80 -0.597 0.678 4.246 1.00 0.00 ATOM 605 C ASP 80 -1.278 -0.348 4.200 1.00 0.00 ATOM 606 N GLU 81 -2.010 -0.704 3.143 1.00 0.00 ATOM 607 CA GLU 81 -2.056 0.106 1.923 1.00 0.00 ATOM 608 CB GLU 81 -2.897 -0.582 0.847 1.00 0.00 ATOM 609 CG GLU 81 -2.270 -1.848 0.284 1.00 0.00 ATOM 610 CD GLU 81 -3.172 -2.550 -0.711 1.00 0.00 ATOM 611 OE1 GLU 81 -4.313 -2.082 -0.915 1.00 0.00 ATOM 612 OE2 GLU 81 -2.738 -3.569 -1.289 1.00 0.00 ATOM 613 O GLU 81 -2.154 2.488 1.663 1.00 0.00 ATOM 614 C GLU 81 -2.647 1.494 2.185 1.00 0.00 ATOM 615 N GLU 82 -3.682 1.537 3.006 1.00 0.00 ATOM 616 CA GLU 82 -4.293 2.809 3.390 1.00 0.00 ATOM 617 CB GLU 82 -5.518 2.563 4.275 1.00 0.00 ATOM 618 CG GLU 82 -6.679 1.894 3.555 1.00 0.00 ATOM 619 CD GLU 82 -7.824 1.555 4.489 1.00 0.00 ATOM 620 OE1 GLU 82 -7.682 1.777 5.709 1.00 0.00 ATOM 621 OE2 GLU 82 -8.864 1.067 4.000 1.00 0.00 ATOM 622 O GLU 82 -3.321 4.942 3.910 1.00 0.00 ATOM 623 C GLU 82 -3.354 3.736 4.155 1.00 0.00 ATOM 624 N ARG 83 -2.577 3.161 5.068 1.00 0.00 ATOM 625 CA ARG 83 -1.642 3.936 5.874 1.00 0.00 ATOM 626 CB ARG 83 -0.948 3.054 6.891 1.00 0.00 ATOM 627 CG ARG 83 -1.877 2.556 7.926 1.00 0.00 ATOM 628 CD ARG 83 -1.274 1.338 8.562 1.00 0.00 ATOM 629 NE ARG 83 -2.144 0.790 9.595 1.00 0.00 ATOM 630 CZ ARG 83 -1.881 -0.333 10.251 1.00 0.00 ATOM 631 NH1 ARG 83 -2.766 -0.791 11.142 1.00 0.00 ATOM 632 NH2 ARG 83 -0.724 -0.972 10.034 1.00 0.00 ATOM 633 O ARG 83 -0.388 5.851 5.153 1.00 0.00 ATOM 634 C ARG 83 -0.630 4.654 4.989 1.00 0.00 ATOM 635 N LYS 84 -0.032 3.905 4.069 1.00 0.00 ATOM 636 CA LYS 84 0.942 4.472 3.148 1.00 0.00 ATOM 637 CB LYS 84 1.529 3.343 2.247 1.00 0.00 ATOM 638 CG LYS 84 2.261 2.237 3.027 1.00 0.00 ATOM 639 CD LYS 84 3.051 1.204 2.093 1.00 0.00 ATOM 640 CE LYS 84 3.894 0.227 3.015 1.00 0.00 ATOM 641 NZ LYS 84 4.301 -1.080 2.312 1.00 0.00 ATOM 642 O LYS 84 0.974 6.577 1.989 1.00 0.00 ATOM 643 C LYS 84 0.340 5.556 2.257 1.00 0.00 ATOM 644 N LYS 85 -0.903 5.344 1.842 1.00 0.00 ATOM 645 CA LYS 85 -1.573 6.278 0.944 1.00 0.00 ATOM 646 CB LYS 85 -2.959 5.754 0.564 1.00 0.00 ATOM 647 CG LYS 85 -3.715 6.648 -0.407 1.00 0.00 ATOM 648 CD LYS 85 -5.052 6.034 -0.794 1.00 0.00 ATOM 649 CE LYS 85 -5.829 6.948 -1.725 1.00 0.00 ATOM 650 NZ LYS 85 -7.150 6.372 -2.097 1.00 0.00 ATOM 651 O LYS 85 -1.470 8.667 1.013 1.00 0.00 ATOM 652 C LYS 85 -1.742 7.641 1.625 1.00 0.00 ATOM 653 N TYR 86 -2.186 7.625 2.856 1.00 0.00 ATOM 654 CA TYR 86 -2.384 8.876 3.593 1.00 0.00 ATOM 655 CB TYR 86 -2.986 8.586 4.969 1.00 0.00 ATOM 656 CG TYR 86 -3.225 9.823 5.806 1.00 0.00 ATOM 657 CD1 TYR 86 -4.322 10.641 5.570 1.00 0.00 ATOM 658 CD2 TYR 86 -2.351 10.167 6.830 1.00 0.00 ATOM 659 CE1 TYR 86 -4.547 11.773 6.331 1.00 0.00 ATOM 660 CE2 TYR 86 -2.562 11.295 7.601 1.00 0.00 ATOM 661 CZ TYR 86 -3.670 12.099 7.342 1.00 0.00 ATOM 662 OH TYR 86 -3.893 13.225 8.100 1.00 0.00 ATOM 663 O TYR 86 -1.035 10.832 3.504 1.00 0.00 ATOM 664 C TYR 86 -1.070 9.625 3.725 1.00 0.00 ATOM 665 N VAL 87 0.005 8.903 4.014 1.00 0.00 ATOM 666 CA VAL 87 1.323 9.529 4.204 1.00 0.00 ATOM 667 CB VAL 87 2.410 8.518 4.617 1.00 0.00 ATOM 668 CG1 VAL 87 3.780 9.176 4.609 1.00 0.00 ATOM 669 CG2 VAL 87 2.140 7.989 6.017 1.00 0.00 ATOM 670 O VAL 87 2.269 11.276 2.849 1.00 0.00 ATOM 671 C VAL 87 1.747 10.163 2.882 1.00 0.00 ATOM 672 N ALA 88 1.552 9.432 1.763 1.00 0.00 ATOM 673 CA ALA 88 1.919 9.938 0.445 1.00 0.00 ATOM 674 CB ALA 88 1.552 8.926 -0.631 1.00 0.00 ATOM 675 O ALA 88 1.713 12.165 -0.463 1.00 0.00 ATOM 676 C ALA 88 1.156 11.225 0.134 1.00 0.00 ATOM 677 N SER 89 -0.100 11.250 0.540 1.00 0.00 ATOM 678 CA SER 89 -0.942 12.413 0.299 1.00 0.00 ATOM 679 CB SER 89 -2.367 12.162 0.797 1.00 0.00 ATOM 680 OG SER 89 -3.011 11.169 0.018 1.00 0.00 ATOM 681 O SER 89 -0.377 14.679 0.583 1.00 0.00 ATOM 682 C SER 89 -0.390 13.567 1.047 1.00 0.00 ATOM 683 N TYR 90 0.082 13.290 2.229 1.00 0.00 ATOM 684 CA TYR 90 0.619 14.368 3.034 1.00 0.00 ATOM 685 CB TYR 90 0.954 13.804 4.420 1.00 0.00 ATOM 686 CG TYR 90 1.378 14.827 5.433 1.00 0.00 ATOM 687 CD1 TYR 90 0.427 15.515 6.190 1.00 0.00 ATOM 688 CD2 TYR 90 2.729 15.057 5.707 1.00 0.00 ATOM 689 CE1 TYR 90 0.809 16.389 7.203 1.00 0.00 ATOM 690 CE2 TYR 90 3.121 15.934 6.721 1.00 0.00 ATOM 691 CZ TYR 90 2.148 16.591 7.458 1.00 0.00 ATOM 692 OH TYR 90 2.503 17.455 8.455 1.00 0.00 ATOM 693 O TYR 90 1.980 16.231 2.375 1.00 0.00 ATOM 694 C TYR 90 1.850 15.002 2.412 1.00 0.00 ATOM 695 N LEU 91 2.735 14.175 1.945 1.00 0.00 ATOM 696 CA LEU 91 3.978 14.637 1.320 1.00 0.00 ATOM 697 CB LEU 91 4.907 13.446 1.062 1.00 0.00 ATOM 698 CG LEU 91 5.608 12.844 2.277 1.00 0.00 ATOM 699 CD1 LEU 91 6.351 11.588 1.853 1.00 0.00 ATOM 700 CD2 LEU 91 6.572 13.860 2.873 1.00 0.00 ATOM 701 O LEU 91 4.330 16.373 -0.293 1.00 0.00 ATOM 702 C LEU 91 3.682 15.375 0.019 1.00 0.00 ATOM 703 N GLY 92 2.720 14.882 -0.712 1.00 0.00 ATOM 704 CA GLY 92 2.361 15.528 -1.959 1.00 0.00 ATOM 705 O GLY 92 2.144 17.866 -2.431 1.00 0.00 ATOM 706 C GLY 92 1.779 16.910 -1.743 1.00 0.00 ATOM 707 N VAL 93 0.880 17.009 -0.793 1.00 0.00 ATOM 708 CA VAL 93 0.244 18.277 -0.470 1.00 0.00 ATOM 709 CB VAL 93 -0.864 18.144 0.592 1.00 0.00 ATOM 710 CG1 VAL 93 -1.374 19.517 1.003 1.00 0.00 ATOM 711 CG2 VAL 93 -2.034 17.343 0.042 1.00 0.00 ATOM 712 O VAL 93 1.277 20.446 -0.364 1.00 0.00 ATOM 713 C VAL 93 1.284 19.276 0.025 1.00 0.00 ATOM 714 N ILE 94 2.138 18.796 0.901 1.00 0.00 ATOM 715 CA ILE 94 3.188 19.633 1.463 1.00 0.00 ATOM 716 CB ILE 94 3.969 18.998 2.558 1.00 0.00 ATOM 717 CG1 ILE 94 4.422 17.556 2.270 1.00 0.00 ATOM 718 CG2 ILE 94 3.113 19.023 3.830 1.00 0.00 ATOM 719 CD1 ILE 94 5.563 17.085 3.190 1.00 0.00 ATOM 720 O ILE 94 4.539 21.237 0.295 1.00 0.00 ATOM 721 C ILE 94 4.199 20.060 0.394 1.00 0.00 ATOM 722 N MET 95 4.672 19.149 -0.433 1.00 0.00 ATOM 723 CA MET 95 5.593 19.521 -1.501 1.00 0.00 ATOM 724 CB MET 95 6.185 18.186 -2.080 1.00 0.00 ATOM 725 CG MET 95 7.123 17.467 -1.105 1.00 0.00 ATOM 726 SD MET 95 8.055 16.124 -1.868 1.00 0.00 ATOM 727 CE MET 95 6.759 14.936 -2.179 1.00 0.00 ATOM 728 O MET 95 5.635 21.253 -3.159 1.00 0.00 ATOM 729 C MET 95 4.944 20.491 -2.483 1.00 0.00 ATOM 730 N ALA 96 3.604 20.460 -2.556 1.00 0.00 ATOM 731 CA ALA 96 2.874 21.341 -3.465 1.00 0.00 ATOM 732 CB ALA 96 1.883 20.520 -4.273 1.00 0.00 ATOM 733 O ALA 96 1.579 23.353 -3.266 1.00 0.00 ATOM 734 C ALA 96 2.292 22.525 -2.699 1.00 0.00 ATOM 735 N SER 97 2.575 22.594 -1.406 1.00 0.00 ATOM 736 CA SER 97 2.060 23.651 -0.536 1.00 0.00 ATOM 737 CB SER 97 2.380 23.470 0.917 1.00 0.00 ATOM 738 OG SER 97 3.723 23.677 1.267 1.00 0.00 ATOM 739 O SER 97 1.837 26.037 -0.640 1.00 0.00 ATOM 740 C SER 97 2.506 25.049 -0.956 1.00 0.00 ATOM 741 N ASP 98 3.633 25.139 -1.659 1.00 0.00 ATOM 742 CA ASP 98 4.148 26.427 -2.104 1.00 0.00 ATOM 743 CB ASP 98 5.651 26.535 -1.823 1.00 0.00 ATOM 744 CG ASP 98 6.479 25.540 -2.614 1.00 0.00 ATOM 745 OD1 ASP 98 5.925 24.840 -3.486 1.00 0.00 ATOM 746 OD2 ASP 98 7.701 25.469 -2.359 1.00 0.00 ATOM 747 O ASP 98 4.366 27.690 -4.129 1.00 0.00 ATOM 748 C ASP 98 3.843 26.727 -3.568 1.00 0.00 ATOM 749 N GLY 99 3.008 25.897 -4.185 1.00 0.00 ATOM 750 CA GLY 99 2.650 26.118 -5.576 1.00 0.00 ATOM 751 O GLY 99 3.222 25.387 -7.760 1.00 0.00 ATOM 752 C GLY 99 3.571 25.468 -6.583 1.00 0.00 ATOM 753 N ASP 100 4.799 24.981 -6.149 1.00 0.00 ATOM 754 CA ASP 100 5.758 24.306 -7.030 1.00 0.00 ATOM 755 CB ASP 100 7.202 24.699 -6.565 1.00 0.00 ATOM 756 CG ASP 100 8.317 24.191 -7.455 1.00 0.00 ATOM 757 OD1 ASP 100 8.654 22.972 -7.356 1.00 0.00 ATOM 758 OD2 ASP 100 8.912 24.899 -8.304 1.00 0.00 ATOM 759 O ASP 100 5.675 22.079 -6.144 1.00 0.00 ATOM 760 C ASP 100 5.583 22.799 -7.143 1.00 0.00 ATOM 761 N ILE 101 5.313 22.334 -8.359 1.00 0.00 ATOM 762 CA ILE 101 5.121 20.909 -8.620 1.00 0.00 ATOM 763 CB ILE 101 3.752 20.644 -9.289 1.00 0.00 ATOM 764 CG1 ILE 101 2.625 21.298 -8.486 1.00 0.00 ATOM 765 CG2 ILE 101 3.516 19.145 -9.445 1.00 0.00 ATOM 766 CD1 ILE 101 1.308 21.366 -9.228 1.00 0.00 ATOM 767 O ILE 101 6.495 20.955 -10.575 1.00 0.00 ATOM 768 C ILE 101 6.296 20.446 -9.473 1.00 0.00 ATOM 769 N ASP 102 7.151 19.602 -8.899 1.00 0.00 ATOM 770 CA ASP 102 8.327 19.090 -9.598 1.00 0.00 ATOM 771 CB ASP 102 9.551 19.184 -8.663 1.00 0.00 ATOM 772 CG ASP 102 10.882 19.020 -9.375 1.00 0.00 ATOM 773 OD1 ASP 102 11.004 18.133 -10.244 1.00 0.00 ATOM 774 OD2 ASP 102 11.822 19.778 -9.053 1.00 0.00 ATOM 775 O ASP 102 7.858 16.735 -9.386 1.00 0.00 ATOM 776 C ASP 102 8.069 17.686 -10.143 1.00 0.00 ATOM 777 N ASP 103 8.053 17.591 -11.474 1.00 0.00 ATOM 778 CA ASP 103 7.799 16.309 -12.112 1.00 0.00 ATOM 779 CB ASP 103 7.906 16.438 -13.633 1.00 0.00 ATOM 780 CG ASP 103 6.738 17.191 -14.237 1.00 0.00 ATOM 781 OD1 ASP 103 5.735 17.404 -13.524 1.00 0.00 ATOM 782 OD2 ASP 103 6.824 17.569 -15.424 1.00 0.00 ATOM 783 O ASP 103 8.454 14.081 -11.546 1.00 0.00 ATOM 784 C ASP 103 8.812 15.245 -11.697 1.00 0.00 ATOM 785 N ASN 104 10.101 15.603 -11.619 1.00 0.00 ATOM 786 CA ASN 104 11.145 14.644 -11.296 1.00 0.00 ATOM 787 CB ASN 104 12.514 15.319 -11.392 1.00 0.00 ATOM 788 CG ASN 104 12.963 15.523 -12.826 1.00 0.00 ATOM 789 ND2 ASN 104 13.906 16.438 -13.025 1.00 0.00 ATOM 790 OD1 ASN 104 12.469 14.867 -13.741 1.00 0.00 ATOM 791 O ASN 104 11.063 12.903 -9.658 1.00 0.00 ATOM 792 C ASN 104 10.942 14.102 -9.888 1.00 0.00 ATOM 793 N GLU 105 10.627 14.987 -8.936 1.00 0.00 ATOM 794 CA GLU 105 10.406 14.577 -7.555 1.00 0.00 ATOM 795 CB GLU 105 9.923 16.116 -6.881 1.00 0.00 ATOM 796 CG GLU 105 8.424 16.144 -6.848 1.00 0.00 ATOM 797 CD GLU 105 7.906 17.455 -6.268 1.00 0.00 ATOM 798 OE1 GLU 105 6.675 17.647 -6.229 1.00 0.00 ATOM 799 OE2 GLU 105 8.733 18.294 -5.853 1.00 0.00 ATOM 800 O GLU 105 9.164 12.695 -6.706 1.00 0.00 ATOM 801 C GLU 105 9.186 13.655 -7.487 1.00 0.00 ATOM 802 N LEU 106 8.180 13.957 -8.308 1.00 0.00 ATOM 803 CA LEU 106 6.984 13.116 -8.334 1.00 0.00 ATOM 804 CB LEU 106 5.874 13.741 -9.165 1.00 0.00 ATOM 805 CG LEU 106 5.336 15.062 -8.621 1.00 0.00 ATOM 806 CD1 LEU 106 4.264 15.568 -9.580 1.00 0.00 ATOM 807 CD2 LEU 106 4.778 14.866 -7.211 1.00 0.00 ATOM 808 O LEU 106 6.825 10.717 -8.309 1.00 0.00 ATOM 809 C LEU 106 7.281 11.718 -8.870 1.00 0.00 ATOM 810 N ALA 107 8.103 11.653 -9.921 1.00 0.00 ATOM 811 CA ALA 107 8.455 10.355 -10.516 1.00 0.00 ATOM 812 CB ALA 107 9.284 10.597 -11.767 1.00 0.00 ATOM 813 O ALA 107 9.015 8.245 -9.434 1.00 0.00 ATOM 814 C ALA 107 9.258 9.464 -9.553 1.00 0.00 ATOM 815 N LEU 108 10.192 10.075 -8.843 1.00 0.00 ATOM 816 CA LEU 108 10.984 9.342 -7.855 1.00 0.00 ATOM 817 CB LEU 108 12.328 10.185 -7.643 1.00 0.00 ATOM 818 CG LEU 108 13.264 10.437 -8.831 1.00 0.00 ATOM 819 CD1 LEU 108 14.492 11.201 -8.343 1.00 0.00 ATOM 820 CD2 LEU 108 13.684 9.114 -9.461 1.00 0.00 ATOM 821 O LEU 108 10.391 7.831 -6.007 1.00 0.00 ATOM 822 C LEU 108 10.171 8.920 -6.610 1.00 0.00 ATOM 823 N TRP 109 9.211 9.737 -6.215 1.00 0.00 ATOM 824 CA TRP 109 8.283 9.328 -5.170 1.00 0.00 ATOM 825 CB TRP 109 7.287 10.464 -4.852 1.00 0.00 ATOM 826 CG TRP 109 6.182 9.982 -3.936 1.00 0.00 ATOM 827 CD1 TRP 109 4.912 9.685 -4.312 1.00 0.00 ATOM 828 CD2 TRP 109 6.295 9.574 -2.554 1.00 0.00 ATOM 829 CE2 TRP 109 5.022 9.033 -2.168 1.00 0.00 ATOM 830 CE3 TRP 109 7.328 9.618 -1.601 1.00 0.00 ATOM 831 NE1 TRP 109 4.194 9.104 -3.254 1.00 0.00 ATOM 832 CZ2 TRP 109 4.756 8.547 -0.889 1.00 0.00 ATOM 833 CZ3 TRP 109 7.063 9.129 -0.301 1.00 0.00 ATOM 834 CH2 TRP 109 5.788 8.597 0.047 1.00 0.00 ATOM 835 O TRP 109 7.375 7.116 -4.846 1.00 0.00 ATOM 836 C TRP 109 7.550 8.073 -5.621 1.00 0.00 ATOM 837 N THR 110 7.119 8.053 -6.889 1.00 0.00 ATOM 838 CA THR 110 6.392 6.856 -7.342 1.00 0.00 ATOM 839 CB THR 110 5.824 7.105 -8.783 1.00 0.00 ATOM 840 CG2 THR 110 5.121 5.878 -9.363 1.00 0.00 ATOM 841 OG1 THR 110 4.891 8.199 -8.780 1.00 0.00 ATOM 842 O THR 110 6.809 4.545 -6.968 1.00 0.00 ATOM 843 C THR 110 7.266 5.619 -7.324 1.00 0.00 ATOM 844 N LEU 111 8.503 5.802 -7.690 1.00 0.00 ATOM 845 CA LEU 111 9.441 4.704 -7.690 1.00 0.00 ATOM 846 CB LEU 111 10.801 5.101 -8.156 1.00 0.00 ATOM 847 CG LEU 111 11.831 3.974 -8.178 1.00 0.00 ATOM 848 CD1 LEU 111 11.465 2.859 -9.150 1.00 0.00 ATOM 849 CD2 LEU 111 13.204 4.531 -8.532 1.00 0.00 ATOM 850 O LEU 111 9.576 2.932 -6.067 1.00 0.00 ATOM 851 C LEU 111 9.632 4.147 -6.281 1.00 0.00 ATOM 852 N ILE 112 9.861 5.041 -5.339 1.00 0.00 ATOM 853 CA ILE 112 10.057 4.627 -3.964 1.00 0.00 ATOM 854 CB ILE 112 10.346 5.824 -3.058 1.00 0.00 ATOM 855 CG1 ILE 112 11.756 6.343 -3.367 1.00 0.00 ATOM 856 CG2 ILE 112 10.242 5.420 -1.591 1.00 0.00 ATOM 857 CD1 ILE 112 12.120 7.635 -2.632 1.00 0.00 ATOM 858 O ILE 112 8.901 2.921 -2.722 1.00 0.00 ATOM 859 C ILE 112 8.815 3.929 -3.425 1.00 0.00 ATOM 860 N SER 113 7.641 4.483 -3.750 1.00 0.00 ATOM 861 CA SER 113 6.394 3.908 -3.289 1.00 0.00 ATOM 862 CB SER 113 5.211 4.772 -3.727 1.00 0.00 ATOM 863 OG SER 113 5.242 6.040 -3.095 1.00 0.00 ATOM 864 O SER 113 5.650 1.642 -3.082 1.00 0.00 ATOM 865 C SER 113 6.166 2.491 -3.804 1.00 0.00 ATOM 866 N THR 114 6.534 2.268 -5.077 1.00 0.00 ATOM 867 CA THR 114 6.358 0.935 -5.649 1.00 0.00 ATOM 868 CB THR 114 6.807 1.034 -7.174 1.00 0.00 ATOM 869 CG2 THR 114 6.755 -0.338 -7.806 1.00 0.00 ATOM 870 OG1 THR 114 5.902 1.907 -7.846 1.00 0.00 ATOM 871 O THR 114 6.751 -1.243 -4.747 1.00 0.00 ATOM 872 C THR 114 7.187 -0.098 -4.874 1.00 0.00 ATOM 873 N LEU 115 8.355 0.321 -4.392 1.00 0.00 ATOM 874 CA LEU 115 9.168 -0.568 -3.559 1.00 0.00 ATOM 875 CB LEU 115 10.617 0.053 -3.613 1.00 0.00 ATOM 876 CG LEU 115 11.742 -0.717 -2.927 1.00 0.00 ATOM 877 CD1 LEU 115 11.964 -2.052 -3.615 1.00 0.00 ATOM 878 CD2 LEU 115 13.008 0.119 -2.972 1.00 0.00 ATOM 879 O LEU 115 8.850 -2.016 -1.686 1.00 0.00 ATOM 880 C LEU 115 8.474 -0.990 -2.269 1.00 0.00 ATOM 881 N CYS 116 7.452 -0.277 -1.800 1.00 0.00 ATOM 882 CA CYS 116 6.727 -0.582 -0.576 1.00 0.00 ATOM 883 CB CYS 116 6.500 0.699 0.198 1.00 0.00 ATOM 884 SG CYS 116 8.069 1.391 0.794 1.00 0.00 ATOM 885 O CYS 116 4.600 -1.488 0.028 1.00 0.00 ATOM 886 C CYS 116 5.444 -1.359 -0.856 1.00 0.00 ATOM 887 N GLY 117 5.209 -1.809 -2.059 1.00 0.00 ATOM 888 CA GLY 117 4.041 -2.594 -2.420 1.00 0.00 ATOM 889 O GLY 117 1.811 -2.302 -3.235 1.00 0.00 ATOM 890 C GLY 117 2.877 -1.763 -2.938 1.00 0.00 ATOM 891 N LEU 118 3.021 -0.420 -3.041 1.00 0.00 ATOM 892 CA LEU 118 1.933 0.397 -3.566 1.00 0.00 ATOM 893 CB LEU 118 2.132 1.839 -3.101 1.00 0.00 ATOM 894 CG LEU 118 2.356 2.075 -1.613 1.00 0.00 ATOM 895 CD1 LEU 118 2.476 3.577 -1.364 1.00 0.00 ATOM 896 CD2 LEU 118 1.239 1.436 -0.794 1.00 0.00 ATOM 897 O LEU 118 2.892 0.396 -5.763 1.00 0.00 ATOM 898 C LEU 118 1.860 0.237 -5.081 1.00 0.00 ATOM 899 N PRO 119 0.691 -0.094 -5.641 1.00 0.00 ATOM 900 CA PRO 119 0.590 -0.263 -7.085 1.00 0.00 ATOM 901 CB PRO 119 -0.885 -0.618 -7.307 1.00 0.00 ATOM 902 CG PRO 119 -1.391 -1.083 -5.987 1.00 0.00 ATOM 903 CD PRO 119 -0.585 -0.362 -4.952 1.00 0.00 ATOM 904 O PRO 119 0.809 2.128 -7.282 1.00 0.00 ATOM 905 C PRO 119 0.962 1.028 -7.808 1.00 0.00 ATOM 906 N THR 120 1.521 0.877 -9.004 1.00 0.00 ATOM 907 CA THR 120 1.934 2.050 -9.766 1.00 0.00 ATOM 908 CB THR 120 2.614 1.560 -11.064 1.00 0.00 ATOM 909 CG2 THR 120 3.135 2.681 -11.924 1.00 0.00 ATOM 910 OG1 THR 120 3.730 0.730 -10.716 1.00 0.00 ATOM 911 O THR 120 0.815 4.185 -9.918 1.00 0.00 ATOM 912 C THR 120 0.740 2.955 -10.041 1.00 0.00 ATOM 913 N MET 121 -0.407 2.381 -10.368 1.00 0.00 ATOM 914 CA MET 121 -1.581 3.180 -10.665 1.00 0.00 ATOM 915 CB MET 121 -2.724 2.230 -11.117 1.00 0.00 ATOM 916 CG MET 121 -2.457 1.504 -12.439 1.00 0.00 ATOM 917 SD MET 121 -3.727 0.268 -12.880 1.00 0.00 ATOM 918 CE MET 121 -5.076 1.310 -13.213 1.00 0.00 ATOM 919 O MET 121 -2.406 5.113 -9.491 1.00 0.00 ATOM 920 C MET 121 -2.095 3.924 -9.422 1.00 0.00 ATOM 921 N THR 122 -2.187 3.213 -8.301 1.00 0.00 ATOM 922 CA THR 122 -2.685 3.871 -7.072 1.00 0.00 ATOM 923 CB THR 122 -2.852 2.806 -5.994 1.00 0.00 ATOM 924 CG2 THR 122 -3.398 3.391 -4.694 1.00 0.00 ATOM 925 OG1 THR 122 -3.835 1.868 -6.475 1.00 0.00 ATOM 926 O THR 122 -2.163 5.996 -6.248 1.00 0.00 ATOM 927 C THR 122 -1.707 4.916 -6.580 1.00 0.00 ATOM 928 N VAL 123 -0.417 4.607 -6.652 1.00 0.00 ATOM 929 CA VAL 123 0.570 5.619 -6.258 1.00 0.00 ATOM 930 CB VAL 123 2.003 5.049 -6.267 1.00 0.00 ATOM 931 CG1 VAL 123 3.058 6.170 -6.196 1.00 0.00 ATOM 932 CG2 VAL 123 2.138 4.058 -5.116 1.00 0.00 ATOM 933 O VAL 123 0.565 7.964 -6.790 1.00 0.00 ATOM 934 C VAL 123 0.471 6.814 -7.192 1.00 0.00 ATOM 935 N MET 124 0.293 6.573 -8.508 1.00 0.00 ATOM 936 CA MET 124 0.178 7.677 -9.446 1.00 0.00 ATOM 937 CB MET 124 0.191 7.119 -10.895 1.00 0.00 ATOM 938 CG MET 124 1.544 6.597 -11.346 1.00 0.00 ATOM 939 SD MET 124 1.453 5.607 -12.847 1.00 0.00 ATOM 940 CE MET 124 0.846 6.786 -14.001 1.00 0.00 ATOM 941 O MET 124 -1.028 9.734 -9.209 1.00 0.00 ATOM 942 C MET 124 -1.069 8.505 -9.154 1.00 0.00 ATOM 943 N GLU 125 -2.177 7.835 -8.829 1.00 0.00 ATOM 944 CA GLU 125 -3.421 8.535 -8.530 1.00 0.00 ATOM 945 CB GLU 125 -4.544 7.550 -8.183 1.00 0.00 ATOM 946 CG GLU 125 -5.814 8.220 -7.678 1.00 0.00 ATOM 947 CD GLU 125 -6.838 7.228 -7.158 1.00 0.00 ATOM 948 OE1 GLU 125 -6.452 6.108 -6.759 1.00 0.00 ATOM 949 OE2 GLU 125 -8.035 7.575 -7.145 1.00 0.00 ATOM 950 O GLU 125 -3.693 10.611 -7.366 1.00 0.00 ATOM 951 C GLU 125 -3.240 9.470 -7.342 1.00 0.00 ATOM 952 N ALA 126 -2.555 8.998 -6.307 1.00 0.00 ATOM 953 CA ALA 126 -2.316 9.796 -5.111 1.00 0.00 ATOM 954 CB ALA 126 -1.709 8.918 -4.034 1.00 0.00 ATOM 955 O ALA 126 -1.602 12.072 -4.865 1.00 0.00 ATOM 956 C ALA 126 -1.392 10.979 -5.390 1.00 0.00 ATOM 957 N ILE 127 -0.393 10.769 -6.247 1.00 0.00 ATOM 958 CA ILE 127 0.541 11.830 -6.597 1.00 0.00 ATOM 959 CB ILE 127 1.679 11.313 -7.494 1.00 0.00 ATOM 960 CG1 ILE 127 2.577 10.375 -6.673 1.00 0.00 ATOM 961 CG2 ILE 127 2.473 12.464 -8.102 1.00 0.00 ATOM 962 CD1 ILE 127 3.599 9.619 -7.540 1.00 0.00 ATOM 963 O ILE 127 0.014 14.174 -7.029 1.00 0.00 ATOM 964 C ILE 127 -0.202 12.982 -7.279 1.00 0.00 ATOM 965 N ASN 128 -1.049 12.599 -8.206 1.00 0.00 ATOM 966 CA ASN 128 -1.712 13.592 -9.033 1.00 0.00 ATOM 967 CB ASN 128 -2.407 12.897 -10.202 1.00 0.00 ATOM 968 CG ASN 128 -1.410 12.336 -11.211 1.00 0.00 ATOM 969 ND2 ASN 128 -1.810 11.307 -11.943 1.00 0.00 ATOM 970 OD1 ASN 128 -0.297 12.842 -11.330 1.00 0.00 ATOM 971 O ASN 128 -2.830 15.607 -8.390 1.00 0.00 ATOM 972 C ASN 128 -2.697 14.397 -8.198 1.00 0.00 ATOM 973 N ASN 129 -3.390 13.739 -7.265 1.00 0.00 ATOM 974 CA ASN 129 -4.346 14.451 -6.431 1.00 0.00 ATOM 975 CB ASN 129 -5.171 13.612 -5.549 1.00 0.00 ATOM 976 CG ASN 129 -6.245 12.854 -6.301 1.00 0.00 ATOM 977 ND2 ASN 129 -6.444 13.203 -7.567 1.00 0.00 ATOM 978 OD1 ASN 129 -6.899 11.966 -5.742 1.00 0.00 ATOM 979 O ASN 129 -4.094 16.583 -5.378 1.00 0.00 ATOM 980 C ASN 129 -3.674 15.449 -5.506 1.00 0.00 ATOM 981 N MET 130 -2.556 15.058 -4.982 1.00 0.00 ATOM 982 CA MET 130 -1.796 15.895 -4.061 1.00 0.00 ATOM 983 CB MET 130 -0.733 15.100 -3.325 1.00 0.00 ATOM 984 CG MET 130 -1.268 14.012 -2.394 1.00 0.00 ATOM 985 SD MET 130 -2.378 14.623 -1.110 1.00 0.00 ATOM 986 CE MET 130 -3.952 14.210 -1.863 1.00 0.00 ATOM 987 O MET 130 -0.960 18.143 -4.134 1.00 0.00 ATOM 988 C MET 130 -1.121 17.079 -4.743 1.00 0.00 ATOM 989 N LYS 131 -0.658 16.907 -5.973 1.00 0.00 ATOM 990 CA LYS 131 -0.007 18.004 -6.663 1.00 0.00 ATOM 991 CB LYS 131 1.086 17.355 -7.585 1.00 0.00 ATOM 992 CG LYS 131 2.132 16.539 -6.818 1.00 0.00 ATOM 993 CD LYS 131 2.817 17.311 -5.716 1.00 0.00 ATOM 994 CE LYS 131 3.739 18.345 -6.315 1.00 0.00 ATOM 995 NZ LYS 131 4.422 19.116 -5.202 1.00 0.00 ATOM 996 O LYS 131 -0.654 19.695 -8.259 1.00 0.00 ATOM 997 C LYS 131 -1.011 18.782 -7.506 1.00 0.00 ATOM 998 N ASN 132 -2.298 18.427 -7.443 1.00 0.00 ATOM 999 CA ASN 132 -3.341 19.034 -8.265 1.00 0.00 ATOM 1000 CB ASN 132 -3.616 20.483 -7.858 1.00 0.00 ATOM 1001 CG ASN 132 -4.902 21.012 -8.444 1.00 0.00 ATOM 1002 ND2 ASN 132 -4.948 22.347 -8.649 1.00 0.00 ATOM 1003 OD1 ASN 132 -5.859 20.261 -8.699 1.00 0.00 ATOM 1004 O ASN 132 -3.068 19.981 -10.488 1.00 0.00 ATOM 1005 C ASN 132 -2.993 18.977 -9.763 1.00 0.00 ATOM 1006 N LEU 133 -2.563 17.802 -10.211 1.00 0.00 ATOM 1007 CA LEU 133 -2.122 17.623 -11.585 1.00 0.00 ATOM 1008 CB LEU 133 -0.743 16.959 -11.592 1.00 0.00 ATOM 1009 CG LEU 133 0.361 17.688 -10.825 1.00 0.00 ATOM 1010 CD1 LEU 133 1.644 16.870 -10.825 1.00 0.00 ATOM 1011 CD2 LEU 133 0.659 19.037 -11.460 1.00 0.00 ATOM 1012 O LEU 133 -3.819 15.931 -11.696 1.00 0.00 ATOM 1013 C LEU 133 -3.103 16.717 -12.319 1.00 0.00 TER END