PFRMAT TS TARGET T0364 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 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 Aside from a couple of C-terminal helices we had excellent hits to 1s5uA. METHOD METHOD We did some optimization in a monomeric context, then dimerized by METHOD superimposingon 1s5u[AB] and did further optimization in the dimeric METHOD context. Very little movement of the backbone occured during the METHOD minimization. METHOD METHOD The models we are submitting are METHOD METHOD Model 1 is dimer/T0364.try12-opt2.unpack chain A, which is the dimeric METHOD model that scored best with the unconstrained costfcn. METHOD dimer/try12-opt2 < dimer/try7-opt2 < dimer/try5-opt2 < monomer try6-opt2 METHOD METHOD Model 2 is dimer/T0364.try14-opt2.unpack.gromacs0.repack-nonPC chain A METHOD which is the dimeric model that Rosetta liked best of all the METHOD ones that it repacked sidechains for. METHOD dimer/try14-opt2 METHOD < dimer/try10-opt2.unpack.gromacs0.repack-nonPC METHOD < dimer/try5-opt2 < monomer try6-opt2 METHOD METHOD Model 3 is dimer/T0364.try4-opt2.unpack chain A, which is Crissan's METHOD favorite of the dimeric models. It was optimized from the METHOD monomeric try5-opt2. METHOD METHOD Model 4 is T0364.try6-opt2, the monomer used for building a couple of METHOD the dimers above. METHOD try6-opt2 < try4-opt2 < alignments (mainly 1s5uA) METHOD METHOD Model 5 is T0364.try7-opt2, a monomer that has not been polished much, METHOD but which was chosen for its somewhat different placement of the METHOD C-terminal helices. METHOD try7-opt2 < alignments (mainly 1s5uA) METHOD METHOD METHOD REMARK 6 REMARK 6 T0364 model 3 Wed Jul 26 20:10:59 2006 MODEL 3 PARENT 1s5u_A 1z54_A 2cye_A 2ali_A 2gf6_A REMARK 7 REMARK 7 ALLPARENTS 1s5u_A 1z54_A 2cye_A 2ali_A 2gf6_A 1lo7_A 2ess_A REMARK 7 ALLPARENTS 1njk_A 2av9_A 1yli_A 1vpm_A 2h4u_A 1bvq_A 2gvh_A REMARK 7 ALLPARENTS 2fs2_A 1wlu_A 1j1y_A 1ixl_A 1zki_A 2cwz_A 1q4u_A ATOM 1 N MET 1 14.144 13.112 7.963 1.00 0.00 ATOM 2 CA MET 1 14.641 14.456 7.550 1.00 0.00 ATOM 3 CB MET 1 15.154 14.370 6.071 1.00 0.00 ATOM 4 CG MET 1 14.010 14.349 5.074 1.00 0.00 ATOM 5 SD MET 1 14.556 14.425 3.355 1.00 0.00 ATOM 6 CE MET 1 14.229 16.147 2.986 1.00 0.00 ATOM 7 O MET 1 12.530 15.584 7.619 1.00 0.00 ATOM 8 C MET 1 13.724 15.616 7.911 1.00 0.00 ATOM 9 N PRO 2 14.289 16.718 8.408 1.00 0.00 ATOM 10 CA PRO 2 13.490 17.895 8.771 1.00 0.00 ATOM 11 CB PRO 2 14.101 18.188 10.224 1.00 0.00 ATOM 12 CG PRO 2 15.506 17.686 10.091 1.00 0.00 ATOM 13 CD PRO 2 15.325 16.395 9.344 1.00 0.00 ATOM 14 O PRO 2 12.682 19.999 7.944 1.00 0.00 ATOM 15 C PRO 2 13.062 18.832 7.686 1.00 0.00 ATOM 16 N ALA 3 13.115 18.507 6.243 1.00 0.00 ATOM 17 CA ALA 3 12.640 19.414 5.203 1.00 0.00 ATOM 18 CB ALA 3 13.697 19.974 4.280 1.00 0.00 ATOM 19 O ALA 3 11.601 17.413 4.355 1.00 0.00 ATOM 20 C ALA 3 11.611 18.651 4.368 1.00 0.00 ATOM 21 N LEU 4 10.755 19.388 3.702 1.00 0.00 ATOM 22 CA LEU 4 9.582 18.850 3.013 1.00 0.00 ATOM 23 CB LEU 4 8.316 19.621 3.391 1.00 0.00 ATOM 24 CG LEU 4 7.027 19.196 2.688 1.00 0.00 ATOM 25 CD1 LEU 4 6.648 17.775 3.073 1.00 0.00 ATOM 26 CD2 LEU 4 5.878 20.115 3.071 1.00 0.00 ATOM 27 O LEU 4 10.094 19.983 0.993 1.00 0.00 ATOM 28 C LEU 4 9.803 18.929 1.504 1.00 0.00 ATOM 29 N ILE 5 9.681 17.782 0.834 1.00 0.00 ATOM 30 CA ILE 5 9.868 17.726 -0.616 1.00 0.00 ATOM 31 CB ILE 5 10.769 16.520 -0.980 1.00 0.00 ATOM 32 CG1 ILE 5 12.043 16.479 -0.137 1.00 0.00 ATOM 33 CG2 ILE 5 11.019 16.447 -2.478 1.00 0.00 ATOM 34 CD1 ILE 5 12.958 17.547 -0.391 1.00 0.00 ATOM 35 O ILE 5 7.640 16.863 -0.829 1.00 0.00 ATOM 36 C ILE 5 8.483 17.650 -1.255 1.00 0.00 ATOM 37 N THR 6 8.262 18.447 -2.292 1.00 0.00 ATOM 38 CA THR 6 6.970 18.466 -2.974 1.00 0.00 ATOM 39 CB THR 6 6.350 19.876 -2.966 1.00 0.00 ATOM 40 CG2 THR 6 6.175 20.371 -1.539 1.00 0.00 ATOM 41 OG1 THR 6 7.211 20.783 -3.669 1.00 0.00 ATOM 42 O THR 6 7.787 18.796 -5.189 1.00 0.00 ATOM 43 C THR 6 7.043 18.137 -4.452 1.00 0.00 ATOM 44 N TYR 7 6.245 17.040 -4.881 1.00 0.00 ATOM 45 CA TYR 7 6.197 16.617 -6.272 1.00 0.00 ATOM 46 CB TYR 7 6.947 15.265 -6.287 1.00 0.00 ATOM 47 CG TYR 7 6.824 14.526 -7.596 1.00 0.00 ATOM 48 CD1 TYR 7 7.670 14.918 -8.629 1.00 0.00 ATOM 49 CD2 TYR 7 5.925 13.490 -7.845 1.00 0.00 ATOM 50 CE1 TYR 7 7.613 14.294 -9.857 1.00 0.00 ATOM 51 CE2 TYR 7 5.863 12.848 -9.088 1.00 0.00 ATOM 52 CZ TYR 7 6.720 13.269 -10.089 1.00 0.00 ATOM 53 OH TYR 7 6.713 12.668 -11.354 1.00 0.00 ATOM 54 O TYR 7 3.854 16.116 -6.280 1.00 0.00 ATOM 55 C TYR 7 4.792 16.648 -6.864 1.00 0.00 ATOM 56 N ARG 8 4.618 17.320 -8.012 1.00 0.00 ATOM 57 CA ARG 8 3.301 17.398 -8.649 1.00 0.00 ATOM 58 CB ARG 8 3.195 18.657 -9.516 1.00 0.00 ATOM 59 CG ARG 8 1.780 18.869 -10.074 1.00 0.00 ATOM 60 CD ARG 8 1.647 20.295 -10.572 1.00 0.00 ATOM 61 NE ARG 8 0.400 20.448 -11.332 1.00 0.00 ATOM 62 CZ ARG 8 0.090 21.559 -11.990 1.00 0.00 ATOM 63 NH1 ARG 8 0.902 22.614 -11.993 1.00 0.00 ATOM 64 NH2 ARG 8 -1.048 21.612 -12.650 1.00 0.00 ATOM 65 O ARG 8 3.855 15.738 -10.289 1.00 0.00 ATOM 66 C ARG 8 2.991 16.201 -9.546 1.00 0.00 ATOM 67 N THR 9 1.747 15.734 -9.488 1.00 0.00 ATOM 68 CA THR 9 1.286 14.614 -10.307 1.00 0.00 ATOM 69 CB THR 9 1.211 13.338 -9.446 1.00 0.00 ATOM 70 CG2 THR 9 0.787 12.149 -10.295 1.00 0.00 ATOM 71 OG1 THR 9 2.496 13.068 -8.875 1.00 0.00 ATOM 72 O THR 9 -1.028 15.257 -10.152 1.00 0.00 ATOM 73 C THR 9 -0.106 14.904 -10.885 1.00 0.00 ATOM 74 N THR 10 -0.218 14.760 -12.191 1.00 0.00 ATOM 75 CA THR 10 -1.489 14.999 -12.877 1.00 0.00 ATOM 76 CB THR 10 -1.231 15.569 -14.220 1.00 0.00 ATOM 77 CG2 THR 10 -0.534 16.922 -14.049 1.00 0.00 ATOM 78 OG1 THR 10 -0.355 14.713 -14.934 1.00 0.00 ATOM 79 O THR 10 -1.539 12.695 -13.555 1.00 0.00 ATOM 80 C THR 10 -2.168 13.645 -13.074 1.00 0.00 ATOM 81 N VAL 11 -3.452 13.572 -12.730 1.00 0.00 ATOM 82 CA VAL 11 -4.221 12.333 -12.865 1.00 0.00 ATOM 83 CB VAL 11 -5.435 12.338 -11.918 1.00 0.00 ATOM 84 CG1 VAL 11 -6.235 11.054 -12.072 1.00 0.00 ATOM 85 CG2 VAL 11 -4.980 12.450 -10.469 1.00 0.00 ATOM 86 O VAL 11 -5.534 12.917 -14.783 1.00 0.00 ATOM 87 C VAL 11 -4.763 12.106 -14.272 1.00 0.00 ATOM 88 N GLN 12 -4.386 10.978 -14.870 1.00 0.00 ATOM 89 CA GLN 12 -4.824 10.612 -16.220 1.00 0.00 ATOM 90 CB GLN 12 -3.698 9.912 -16.954 1.00 0.00 ATOM 91 CG GLN 12 -2.390 10.649 -16.910 1.00 0.00 ATOM 92 CD GLN 12 -2.477 11.945 -17.675 1.00 0.00 ATOM 93 OE1 GLN 12 -2.746 11.984 -18.861 1.00 0.00 ATOM 94 NE2 GLN 12 -2.185 13.064 -17.010 1.00 0.00 ATOM 95 O GLN 12 -6.074 8.925 -15.077 1.00 0.00 ATOM 96 C GLN 12 -5.816 9.456 -16.154 1.00 0.00 ATOM 97 N GLU 13 -6.382 9.077 -17.298 1.00 0.00 ATOM 98 CA GLU 13 -7.345 7.977 -17.315 1.00 0.00 ATOM 99 CB GLU 13 -7.802 7.694 -18.748 1.00 0.00 ATOM 100 CG GLU 13 -8.822 6.572 -18.863 1.00 0.00 ATOM 101 CD GLU 13 -9.299 6.362 -20.288 1.00 0.00 ATOM 102 OE1 GLU 13 -8.848 7.112 -21.182 1.00 0.00 ATOM 103 OE2 GLU 13 -10.124 5.452 -20.512 1.00 0.00 ATOM 104 O GLU 13 -7.406 5.875 -16.133 1.00 0.00 ATOM 105 C GLU 13 -6.730 6.679 -16.787 1.00 0.00 ATOM 106 N ASP 14 -5.449 6.474 -17.070 1.00 0.00 ATOM 107 CA ASP 14 -4.748 5.267 -16.624 1.00 0.00 ATOM 108 CB ASP 14 -3.287 5.298 -17.080 1.00 0.00 ATOM 109 CG ASP 14 -3.136 5.056 -18.569 1.00 0.00 ATOM 110 OD1 ASP 14 -4.127 4.640 -19.208 1.00 0.00 ATOM 111 OD2 ASP 14 -2.028 5.280 -19.099 1.00 0.00 ATOM 112 O ASP 14 -4.656 3.985 -14.592 1.00 0.00 ATOM 113 C ASP 14 -4.745 5.105 -15.099 1.00 0.00 ATOM 114 N TRP 15 -4.866 6.220 -14.380 1.00 0.00 ATOM 115 CA TRP 15 -4.842 6.220 -12.915 1.00 0.00 ATOM 116 CB TRP 15 -4.276 7.543 -12.392 1.00 0.00 ATOM 117 CG TRP 15 -2.842 7.767 -12.760 1.00 0.00 ATOM 118 CD1 TRP 15 -2.368 8.543 -13.777 1.00 0.00 ATOM 119 CD2 TRP 15 -1.692 7.211 -12.112 1.00 0.00 ATOM 120 CE2 TRP 15 -0.554 7.692 -12.791 1.00 0.00 ATOM 121 CE3 TRP 15 -1.510 6.351 -11.025 1.00 0.00 ATOM 122 NE1 TRP 15 -0.994 8.507 -13.806 1.00 0.00 ATOM 123 CZ2 TRP 15 0.742 7.345 -12.421 1.00 0.00 ATOM 124 CZ3 TRP 15 -0.223 6.010 -10.659 1.00 0.00 ATOM 125 CH2 TRP 15 0.888 6.502 -11.351 1.00 0.00 ATOM 126 O TRP 15 -6.313 5.923 -11.061 1.00 0.00 ATOM 127 C TRP 15 -6.216 6.090 -12.276 1.00 0.00 ATOM 128 N VAL 16 -7.275 6.120 -13.074 1.00 0.00 ATOM 129 CA VAL 16 -8.635 6.008 -12.546 1.00 0.00 ATOM 130 CB VAL 16 -9.568 7.026 -13.228 1.00 0.00 ATOM 131 CG1 VAL 16 -9.093 8.448 -12.959 1.00 0.00 ATOM 132 CG2 VAL 16 -9.592 6.804 -14.733 1.00 0.00 ATOM 133 O VAL 16 -8.747 3.850 -13.583 1.00 0.00 ATOM 134 C VAL 16 -9.260 4.638 -12.789 1.00 0.00 ATOM 135 N ASP 17 -10.363 4.362 -12.097 1.00 0.00 ATOM 136 CA ASP 17 -11.093 3.109 -12.280 1.00 0.00 ATOM 137 CB ASP 17 -10.962 2.239 -11.029 1.00 0.00 ATOM 138 CG ASP 17 -11.582 2.884 -9.805 1.00 0.00 ATOM 139 OD1 ASP 17 -12.255 3.923 -9.959 1.00 0.00 ATOM 140 OD2 ASP 17 -11.391 2.349 -8.692 1.00 0.00 ATOM 141 O ASP 17 -12.955 4.534 -12.788 1.00 0.00 ATOM 142 C ASP 17 -12.563 3.385 -12.596 1.00 0.00 ATOM 143 N TYR 18 -13.340 2.317 -12.746 1.00 0.00 ATOM 144 CA TYR 18 -14.754 2.425 -13.089 1.00 0.00 ATOM 145 CB TYR 18 -15.132 0.994 -13.723 1.00 0.00 ATOM 146 CG TYR 18 -16.478 1.011 -14.330 1.00 0.00 ATOM 147 CD1 TYR 18 -16.638 1.379 -15.665 1.00 0.00 ATOM 148 CD2 TYR 18 -17.581 0.669 -13.551 1.00 0.00 ATOM 149 CE1 TYR 18 -17.913 1.385 -16.228 1.00 0.00 ATOM 150 CE2 TYR 18 -18.865 0.677 -14.091 1.00 0.00 ATOM 151 CZ TYR 18 -19.008 1.033 -15.431 1.00 0.00 ATOM 152 OH TYR 18 -20.282 1.026 -15.928 1.00 0.00 ATOM 153 O TYR 18 -16.627 3.726 -12.356 1.00 0.00 ATOM 154 C TYR 18 -15.556 3.199 -12.046 1.00 0.00 ATOM 155 N ASN 19 -15.043 3.264 -10.820 1.00 0.00 ATOM 156 CA ASN 19 -15.730 3.990 -9.768 1.00 0.00 ATOM 157 CB ASN 19 -15.068 3.720 -8.415 1.00 0.00 ATOM 158 CG ASN 19 -15.321 2.313 -7.912 1.00 0.00 ATOM 159 ND2 ASN 19 -14.496 1.865 -6.974 1.00 0.00 ATOM 160 OD1 ASN 19 -16.249 1.642 -8.360 1.00 0.00 ATOM 161 O ASN 19 -16.494 6.231 -9.380 1.00 0.00 ATOM 162 C ASN 19 -15.738 5.488 -10.011 1.00 0.00 ATOM 163 N GLY 20 -14.881 5.934 -10.926 1.00 0.00 ATOM 164 CA GLY 20 -14.802 7.348 -11.251 1.00 0.00 ATOM 165 O GLY 20 -13.764 9.359 -10.487 1.00 0.00 ATOM 166 C GLY 20 -13.755 8.122 -10.478 1.00 0.00 ATOM 167 N HIS 21 -12.893 7.410 -9.757 1.00 0.00 ATOM 168 CA HIS 21 -11.845 8.041 -8.962 1.00 0.00 ATOM 169 CB HIS 21 -12.142 7.874 -7.478 1.00 0.00 ATOM 170 CG HIS 21 -13.302 8.689 -7.004 1.00 0.00 ATOM 171 CD2 HIS 21 -14.591 8.351 -6.765 1.00 0.00 ATOM 172 ND1 HIS 21 -13.198 10.032 -6.715 1.00 0.00 ATOM 173 CE1 HIS 21 -14.373 10.487 -6.317 1.00 0.00 ATOM 174 NE2 HIS 21 -15.236 9.487 -6.339 1.00 0.00 ATOM 175 O HIS 21 -10.502 6.181 -9.669 1.00 0.00 ATOM 176 C HIS 21 -10.523 7.283 -9.119 1.00 0.00 ATOM 177 N LEU 22 -9.439 7.839 -8.586 1.00 0.00 ATOM 178 CA LEU 22 -8.131 7.179 -8.687 1.00 0.00 ATOM 179 CB LEU 22 -7.021 8.156 -8.239 1.00 0.00 ATOM 180 CG LEU 22 -6.753 9.378 -9.120 1.00 0.00 ATOM 181 CD1 LEU 22 -5.661 10.237 -8.499 1.00 0.00 ATOM 182 CD2 LEU 22 -6.340 8.922 -10.506 1.00 0.00 ATOM 183 O LEU 22 -8.419 5.897 -6.686 1.00 0.00 ATOM 184 C LEU 22 -8.069 5.905 -7.868 1.00 0.00 ATOM 185 N ARG 23 -7.636 4.699 -8.479 1.00 0.00 ATOM 186 CA ARG 23 -7.542 3.413 -7.772 1.00 0.00 ATOM 187 CB ARG 23 -7.169 2.285 -8.766 1.00 0.00 ATOM 188 CG ARG 23 -8.242 1.677 -9.650 1.00 0.00 ATOM 189 CD ARG 23 -7.634 0.465 -10.360 1.00 0.00 ATOM 190 NE ARG 23 -8.596 -0.280 -11.163 1.00 0.00 ATOM 191 CZ ARG 23 -9.006 0.082 -12.374 1.00 0.00 ATOM 192 NH1 ARG 23 -8.530 1.188 -12.933 1.00 0.00 ATOM 193 NH2 ARG 23 -9.890 -0.661 -13.028 1.00 0.00 ATOM 194 O ARG 23 -5.593 4.171 -6.625 1.00 0.00 ATOM 195 C ARG 23 -6.608 3.488 -6.564 1.00 0.00 ATOM 196 N ASP 24 -6.914 2.766 -5.482 1.00 0.00 ATOM 197 CA ASP 24 -6.070 2.883 -4.293 1.00 0.00 ATOM 198 CB ASP 24 -6.641 2.049 -3.122 1.00 0.00 ATOM 199 CG ASP 24 -7.945 2.568 -2.587 1.00 0.00 ATOM 200 OD1 ASP 24 -8.248 3.769 -2.790 1.00 0.00 ATOM 201 OD2 ASP 24 -8.729 1.821 -1.943 1.00 0.00 ATOM 202 O ASP 24 -3.709 3.052 -4.027 1.00 0.00 ATOM 203 C ASP 24 -4.633 2.466 -4.554 1.00 0.00 ATOM 204 N ALA 25 -4.381 1.446 -5.343 1.00 0.00 ATOM 205 CA ALA 25 -3.011 1.056 -5.647 1.00 0.00 ATOM 206 CB ALA 25 -3.010 -0.293 -6.367 1.00 0.00 ATOM 207 O ALA 25 -0.998 2.128 -6.392 1.00 0.00 ATOM 208 C ALA 25 -2.228 2.103 -6.440 1.00 0.00 ATOM 209 N PHE 26 -2.935 2.958 -7.171 1.00 0.00 ATOM 210 CA PHE 26 -2.266 3.992 -7.953 1.00 0.00 ATOM 211 CB PHE 26 -3.279 4.661 -8.880 1.00 0.00 ATOM 212 CG PHE 26 -3.513 3.847 -10.126 1.00 0.00 ATOM 213 CD1 PHE 26 -4.607 3.042 -10.189 1.00 0.00 ATOM 214 CD2 PHE 26 -2.594 3.782 -11.143 1.00 0.00 ATOM 215 CE1 PHE 26 -4.871 2.219 -11.292 1.00 0.00 ATOM 216 CE2 PHE 26 -2.832 2.955 -12.245 1.00 0.00 ATOM 217 CZ PHE 26 -3.966 2.175 -12.339 1.00 0.00 ATOM 218 O PHE 26 -0.500 5.513 -7.396 1.00 0.00 ATOM 219 C PHE 26 -1.567 5.003 -7.055 1.00 0.00 ATOM 220 N TYR 27 -2.169 5.294 -5.906 1.00 0.00 ATOM 221 CA TYR 27 -1.561 6.229 -4.971 1.00 0.00 ATOM 222 CB TYR 27 -2.482 6.466 -3.773 1.00 0.00 ATOM 223 CG TYR 27 -3.748 7.218 -4.111 1.00 0.00 ATOM 224 CD1 TYR 27 -3.867 7.906 -5.313 1.00 0.00 ATOM 225 CD2 TYR 27 -4.822 7.237 -3.230 1.00 0.00 ATOM 226 CE1 TYR 27 -5.020 8.597 -5.630 1.00 0.00 ATOM 227 CE2 TYR 27 -5.984 7.923 -3.532 1.00 0.00 ATOM 228 CZ TYR 27 -6.076 8.605 -4.746 1.00 0.00 ATOM 229 OH TYR 27 -7.226 9.291 -5.060 1.00 0.00 ATOM 230 O TYR 27 0.709 6.374 -4.214 1.00 0.00 ATOM 231 C TYR 27 -0.244 5.645 -4.478 1.00 0.00 ATOM 232 N LEU 28 -0.205 4.323 -4.322 1.00 0.00 ATOM 233 CA LEU 28 1.016 3.662 -3.867 1.00 0.00 ATOM 234 CB LEU 28 0.801 2.151 -3.770 1.00 0.00 ATOM 235 CG LEU 28 1.998 1.325 -3.296 1.00 0.00 ATOM 236 CD1 LEU 28 2.411 1.736 -1.891 1.00 0.00 ATOM 237 CD2 LEU 28 1.655 -0.157 -3.274 1.00 0.00 ATOM 238 O LEU 28 3.241 4.342 -4.488 1.00 0.00 ATOM 239 C LEU 28 2.123 3.990 -4.872 1.00 0.00 ATOM 240 N LEU 29 1.804 3.874 -6.152 1.00 0.00 ATOM 241 CA LEU 29 2.784 4.157 -7.191 1.00 0.00 ATOM 242 CB LEU 29 2.206 3.878 -8.580 1.00 0.00 ATOM 243 CG LEU 29 1.943 2.411 -8.923 1.00 0.00 ATOM 244 CD1 LEU 29 1.209 2.290 -10.249 1.00 0.00 ATOM 245 CD2 LEU 29 3.252 1.642 -9.033 1.00 0.00 ATOM 246 O LEU 29 4.367 5.945 -7.303 1.00 0.00 ATOM 247 C LEU 29 3.199 5.628 -7.116 1.00 0.00 ATOM 248 N ILE 30 2.242 6.528 -6.887 1.00 0.00 ATOM 249 CA ILE 30 2.571 7.955 -6.797 1.00 0.00 ATOM 250 CB ILE 30 1.355 8.847 -6.747 1.00 0.00 ATOM 251 CG1 ILE 30 0.535 8.642 -8.004 1.00 0.00 ATOM 252 CG2 ILE 30 1.722 10.310 -6.559 1.00 0.00 ATOM 253 CD1 ILE 30 -0.848 9.241 -7.958 1.00 0.00 ATOM 254 O ILE 30 4.451 9.038 -5.768 1.00 0.00 ATOM 255 C ILE 30 3.557 8.197 -5.657 1.00 0.00 ATOM 256 N PHE 31 3.380 7.473 -4.553 1.00 0.00 ATOM 257 CA PHE 31 4.278 7.620 -3.410 1.00 0.00 ATOM 258 CB PHE 31 3.762 6.737 -2.237 1.00 0.00 ATOM 259 CG PHE 31 2.583 7.306 -1.485 1.00 0.00 ATOM 260 CD1 PHE 31 1.678 6.456 -0.857 1.00 0.00 ATOM 261 CD2 PHE 31 2.392 8.686 -1.380 1.00 0.00 ATOM 262 CE1 PHE 31 0.597 6.967 -0.130 1.00 0.00 ATOM 263 CE2 PHE 31 1.313 9.206 -0.654 1.00 0.00 ATOM 264 CZ PHE 31 0.420 8.346 -0.031 1.00 0.00 ATOM 265 O PHE 31 6.666 7.826 -3.441 1.00 0.00 ATOM 266 C PHE 31 5.688 7.175 -3.801 1.00 0.00 ATOM 267 N SER 32 5.777 6.091 -4.549 1.00 0.00 ATOM 268 CA SER 32 7.080 5.604 -4.994 1.00 0.00 ATOM 269 CB SER 32 6.923 4.299 -5.777 1.00 0.00 ATOM 270 OG SER 32 6.442 3.259 -4.941 1.00 0.00 ATOM 271 O SER 32 8.960 6.855 -5.821 1.00 0.00 ATOM 272 C SER 32 7.756 6.625 -5.914 1.00 0.00 ATOM 273 N TYR 33 6.984 7.236 -6.808 1.00 0.00 ATOM 274 CA TYR 33 7.549 8.240 -7.707 1.00 0.00 ATOM 275 CB TYR 33 6.523 8.781 -8.686 1.00 0.00 ATOM 276 CG TYR 33 6.179 7.900 -9.876 1.00 0.00 ATOM 277 CD1 TYR 33 4.869 7.430 -10.018 1.00 0.00 ATOM 278 CD2 TYR 33 7.107 7.576 -10.873 1.00 0.00 ATOM 279 CE1 TYR 33 4.485 6.673 -11.129 1.00 0.00 ATOM 280 CE2 TYR 33 6.748 6.829 -11.998 1.00 0.00 ATOM 281 CZ TYR 33 5.426 6.374 -12.117 1.00 0.00 ATOM 282 OH TYR 33 5.028 5.654 -13.217 1.00 0.00 ATOM 283 O TYR 33 9.174 9.935 -7.207 1.00 0.00 ATOM 284 C TYR 33 8.100 9.400 -6.865 1.00 0.00 ATOM 285 N ALA 34 7.415 9.781 -5.819 1.00 0.00 ATOM 286 CA ALA 34 7.896 10.861 -4.956 1.00 0.00 ATOM 287 CB ALA 34 6.852 11.147 -3.888 1.00 0.00 ATOM 288 O ALA 34 10.128 11.381 -4.234 1.00 0.00 ATOM 289 C ALA 34 9.230 10.541 -4.286 1.00 0.00 ATOM 290 N THR 35 9.357 9.324 -3.750 1.00 0.00 ATOM 291 CA THR 35 10.594 8.928 -3.095 1.00 0.00 ATOM 292 CB THR 35 10.489 7.522 -2.475 1.00 0.00 ATOM 293 CG2 THR 35 11.797 7.137 -1.804 1.00 0.00 ATOM 294 OG1 THR 35 9.441 7.506 -1.497 1.00 0.00 ATOM 295 O THR 35 12.856 9.343 -3.811 1.00 0.00 ATOM 296 C THR 35 11.732 8.939 -4.116 1.00 0.00 ATOM 297 N ASP 36 11.431 8.505 -5.336 1.00 0.00 ATOM 298 CA ASP 36 12.425 8.487 -6.404 1.00 0.00 ATOM 299 CB ASP 36 11.845 7.842 -7.664 1.00 0.00 ATOM 300 CG ASP 36 11.692 6.338 -7.531 1.00 0.00 ATOM 301 OD1 ASP 36 12.246 5.768 -6.566 1.00 0.00 ATOM 302 OD2 ASP 36 11.016 5.731 -8.389 1.00 0.00 ATOM 303 O ASP 36 14.066 10.181 -6.890 1.00 0.00 ATOM 304 C ASP 36 12.869 9.915 -6.738 1.00 0.00 ATOM 305 N ALA 37 11.914 10.840 -6.821 1.00 0.00 ATOM 306 CA ALA 37 12.258 12.224 -7.138 1.00 0.00 ATOM 307 CB ALA 37 10.996 13.039 -7.385 1.00 0.00 ATOM 308 O ALA 37 13.956 13.665 -6.262 1.00 0.00 ATOM 309 C ALA 37 13.063 12.857 -6.009 1.00 0.00 ATOM 310 N LEU 38 12.754 12.492 -4.768 1.00 0.00 ATOM 311 CA LEU 38 13.506 13.029 -3.634 1.00 0.00 ATOM 312 CB LEU 38 13.008 12.455 -2.372 1.00 0.00 ATOM 313 CG LEU 38 13.808 12.853 -1.129 1.00 0.00 ATOM 314 CD1 LEU 38 13.883 14.366 -0.961 1.00 0.00 ATOM 315 CD2 LEU 38 13.244 12.192 0.162 1.00 0.00 ATOM 316 O LEU 38 15.884 13.425 -3.574 1.00 0.00 ATOM 317 C LEU 38 14.971 12.624 -3.794 1.00 0.00 ATOM 318 N MET 39 15.123 11.392 -4.189 1.00 0.00 ATOM 319 CA MET 39 16.478 10.892 -4.373 1.00 0.00 ATOM 320 CB MET 39 16.414 9.334 -4.603 1.00 0.00 ATOM 321 CG MET 39 16.049 8.478 -3.366 1.00 0.00 ATOM 322 SD MET 39 17.148 8.707 -1.969 1.00 0.00 ATOM 323 CE MET 39 18.580 7.953 -2.629 1.00 0.00 ATOM 324 O MET 39 18.364 11.903 -5.457 1.00 0.00 ATOM 325 C MET 39 17.173 11.597 -5.532 1.00 0.00 ATOM 326 N ASP 40 16.441 11.854 -6.614 1.00 0.00 ATOM 327 CA ASP 40 17.005 12.546 -7.769 1.00 0.00 ATOM 328 CB ASP 40 16.039 12.585 -8.982 1.00 0.00 ATOM 329 CG ASP 40 15.975 11.228 -9.687 1.00 0.00 ATOM 330 OD1 ASP 40 16.867 10.416 -9.675 1.00 0.00 ATOM 331 OD2 ASP 40 14.851 11.050 -10.350 1.00 0.00 ATOM 332 O ASP 40 18.370 14.520 -7.926 1.00 0.00 ATOM 333 C ASP 40 17.397 13.977 -7.401 1.00 0.00 ATOM 334 N ARG 41 16.617 14.586 -6.517 1.00 0.00 ATOM 335 CA ARG 41 16.868 15.953 -6.075 1.00 0.00 ATOM 336 CB ARG 41 15.615 16.454 -5.287 1.00 0.00 ATOM 337 CG ARG 41 14.448 16.705 -6.231 1.00 0.00 ATOM 338 CD ARG 41 13.094 17.066 -5.591 1.00 0.00 ATOM 339 NE ARG 41 12.096 17.066 -6.672 1.00 0.00 ATOM 340 CZ ARG 41 10.941 17.753 -6.680 1.00 0.00 ATOM 341 NH1 ARG 41 10.597 18.524 -5.647 1.00 0.00 ATOM 342 NH2 ARG 41 10.133 17.674 -7.740 1.00 0.00 ATOM 343 O ARG 41 18.865 17.097 -5.378 1.00 0.00 ATOM 344 C ARG 41 18.238 16.038 -5.403 1.00 0.00 ATOM 345 N ILE 42 18.691 14.908 -4.870 1.00 0.00 ATOM 346 CA ILE 42 19.985 14.824 -4.204 1.00 0.00 ATOM 347 CB ILE 42 19.551 14.191 -2.622 1.00 0.00 ATOM 348 CG1 ILE 42 19.745 12.706 -2.937 1.00 0.00 ATOM 349 CG2 ILE 42 18.122 14.479 -2.187 1.00 0.00 ATOM 350 CD1 ILE 42 19.538 11.790 -1.745 1.00 0.00 ATOM 351 O ILE 42 22.080 13.732 -4.675 1.00 0.00 ATOM 352 C ILE 42 21.041 14.214 -5.126 1.00 0.00 ATOM 353 N GLY 43 20.739 14.199 -6.422 1.00 0.00 ATOM 354 CA GLY 43 21.659 13.692 -7.438 1.00 0.00 ATOM 355 O GLY 43 22.930 11.709 -7.879 1.00 0.00 ATOM 356 C GLY 43 21.883 12.181 -7.434 1.00 0.00 ATOM 357 N LEU 44 20.903 11.427 -6.953 1.00 0.00 ATOM 358 CA LEU 44 21.011 9.971 -6.920 1.00 0.00 ATOM 359 CB LEU 44 20.642 9.478 -5.521 1.00 0.00 ATOM 360 CG LEU 44 21.506 10.133 -4.450 1.00 0.00 ATOM 361 CD1 LEU 44 21.090 9.607 -3.087 1.00 0.00 ATOM 362 CD2 LEU 44 22.989 9.808 -4.677 1.00 0.00 ATOM 363 O LEU 44 18.866 9.396 -7.843 1.00 0.00 ATOM 364 C LEU 44 20.089 9.242 -7.908 1.00 0.00 ATOM 365 N ASP 45 20.669 8.379 -8.746 1.00 0.00 ATOM 366 CA ASP 45 19.871 7.668 -9.741 1.00 0.00 ATOM 367 CB ASP 45 20.552 7.812 -11.104 1.00 0.00 ATOM 368 CG ASP 45 19.770 7.143 -12.218 1.00 0.00 ATOM 369 OD1 ASP 45 18.778 6.450 -11.916 1.00 0.00 ATOM 370 OD2 ASP 45 20.151 7.313 -13.395 1.00 0.00 ATOM 371 O ASP 45 20.843 5.565 -9.126 1.00 0.00 ATOM 372 C ASP 45 19.807 6.193 -9.356 1.00 0.00 ATOM 373 N ALA 46 18.594 5.651 -9.257 1.00 0.00 ATOM 374 CA ALA 46 18.422 4.247 -8.888 1.00 0.00 ATOM 375 CB ALA 46 16.955 3.944 -8.620 1.00 0.00 ATOM 376 O ALA 46 19.476 2.252 -9.677 1.00 0.00 ATOM 377 C ALA 46 18.978 3.337 -9.974 1.00 0.00 ATOM 378 N ASP 47 18.839 3.760 -11.251 1.00 0.00 ATOM 379 CA ASP 47 19.358 2.939 -12.340 1.00 0.00 ATOM 380 CB ASP 47 19.041 3.610 -13.678 1.00 0.00 ATOM 381 CG ASP 47 17.565 3.557 -14.019 1.00 0.00 ATOM 382 OD1 ASP 47 16.827 2.797 -13.355 1.00 0.00 ATOM 383 OD2 ASP 47 17.145 4.275 -14.950 1.00 0.00 ATOM 384 O ASP 47 21.405 1.683 -12.192 1.00 0.00 ATOM 385 C ASP 47 20.863 2.788 -12.125 1.00 0.00 ATOM 386 N SER 48 21.525 3.908 -11.845 1.00 0.00 ATOM 387 CA SER 48 22.968 3.918 -11.601 1.00 0.00 ATOM 388 CB SER 48 23.600 5.204 -11.453 1.00 0.00 ATOM 389 OG SER 48 23.055 5.901 -10.371 1.00 0.00 ATOM 390 O SER 48 24.318 2.484 -10.227 1.00 0.00 ATOM 391 C SER 48 23.312 3.191 -10.304 1.00 0.00 ATOM 392 N ARG 49 22.499 3.363 -9.348 1.00 0.00 ATOM 393 CA ARG 49 22.764 2.700 -8.077 1.00 0.00 ATOM 394 CB ARG 49 21.786 3.290 -6.991 1.00 0.00 ATOM 395 CG ARG 49 22.119 2.739 -5.606 1.00 0.00 ATOM 396 CD ARG 49 21.386 3.537 -4.516 1.00 0.00 ATOM 397 NE ARG 49 19.949 3.415 -4.684 1.00 0.00 ATOM 398 CZ ARG 49 18.991 4.215 -5.133 1.00 0.00 ATOM 399 NH1 ARG 49 19.243 5.464 -5.567 1.00 0.00 ATOM 400 NH2 ARG 49 17.736 3.716 -5.135 1.00 0.00 ATOM 401 O ARG 49 23.477 0.464 -7.583 1.00 0.00 ATOM 402 C ARG 49 22.680 1.178 -8.204 1.00 0.00 ATOM 403 N GLY 50 21.691 0.687 -8.981 1.00 0.00 ATOM 404 CA GLY 50 21.534 -0.741 -9.166 1.00 0.00 ATOM 405 O GLY 50 23.251 -2.442 -9.323 1.00 0.00 ATOM 406 C GLY 50 22.834 -1.327 -9.703 1.00 0.00 ATOM 407 N GLN 51 23.513 -0.555 -10.609 1.00 0.00 ATOM 408 CA GLN 51 24.766 -1.036 -11.162 1.00 0.00 ATOM 409 CB GLN 51 25.183 -0.060 -12.279 1.00 0.00 ATOM 410 CG GLN 51 24.368 -0.211 -13.560 1.00 0.00 ATOM 411 CD GLN 51 24.302 1.065 -14.389 1.00 0.00 ATOM 412 OE1 GLN 51 25.320 1.682 -14.687 1.00 0.00 ATOM 413 NE2 GLN 51 23.093 1.455 -14.768 1.00 0.00 ATOM 414 O GLN 51 26.693 -2.061 -10.161 1.00 0.00 ATOM 415 C GLN 51 25.814 -1.199 -10.066 1.00 0.00 ATOM 416 N SER 52 25.714 -0.401 -9.009 1.00 0.00 ATOM 417 CA SER 52 26.655 -0.486 -7.899 1.00 0.00 ATOM 418 CB SER 52 26.978 0.889 -7.367 1.00 0.00 ATOM 419 OG SER 52 25.810 1.525 -6.955 1.00 0.00 ATOM 420 O SER 52 26.667 -1.537 -5.739 1.00 0.00 ATOM 421 C SER 52 26.117 -1.442 -6.837 1.00 0.00 ATOM 422 N GLY 53 25.024 -2.157 -7.190 1.00 0.00 ATOM 423 CA GLY 53 24.431 -3.105 -6.263 1.00 0.00 ATOM 424 O GLY 53 23.299 -3.165 -4.185 1.00 0.00 ATOM 425 C GLY 53 23.602 -2.490 -5.140 1.00 0.00 ATOM 426 N ASN 54 23.287 -1.192 -5.235 1.00 0.00 ATOM 427 CA ASN 54 22.458 -0.529 -4.225 1.00 0.00 ATOM 428 CB ASN 54 23.040 0.815 -3.893 1.00 0.00 ATOM 429 CG ASN 54 24.454 0.711 -3.336 1.00 0.00 ATOM 430 ND2 ASN 54 25.362 1.529 -3.870 1.00 0.00 ATOM 431 OD1 ASN 54 24.721 -0.084 -2.430 1.00 0.00 ATOM 432 O ASN 54 20.824 0.443 -5.694 1.00 0.00 ATOM 433 C ASN 54 21.030 -0.228 -4.680 1.00 0.00 ATOM 434 N SER 55 20.053 -0.742 -3.943 1.00 0.00 ATOM 435 CA SER 55 18.649 -0.515 -4.269 1.00 0.00 ATOM 436 CB SER 55 18.100 -1.717 -5.042 1.00 0.00 ATOM 437 OG SER 55 18.076 -2.877 -4.227 1.00 0.00 ATOM 438 O SER 55 18.319 -0.549 -1.889 1.00 0.00 ATOM 439 C SER 55 17.833 -0.312 -2.996 1.00 0.00 ATOM 440 N LEU 56 16.591 0.130 -3.161 1.00 0.00 ATOM 441 CA LEU 56 15.715 0.378 -2.023 1.00 0.00 ATOM 442 CB LEU 56 15.391 1.869 -1.894 1.00 0.00 ATOM 443 CG LEU 56 16.581 2.804 -1.665 1.00 0.00 ATOM 444 CD1 LEU 56 16.136 4.256 -1.689 1.00 0.00 ATOM 445 CD2 LEU 56 17.231 2.526 -0.318 1.00 0.00 ATOM 446 O LEU 56 13.827 -0.397 -3.274 1.00 0.00 ATOM 447 C LEU 56 14.421 -0.397 -2.196 1.00 0.00 ATOM 448 N PHE 57 13.985 -1.062 -1.132 1.00 0.00 ATOM 449 CA PHE 57 12.752 -1.829 -1.202 1.00 0.00 ATOM 450 CB PHE 57 13.044 -3.340 -1.095 1.00 0.00 ATOM 451 CG PHE 57 13.483 -3.980 -2.346 1.00 0.00 ATOM 452 CD1 PHE 57 14.851 -4.108 -2.593 1.00 0.00 ATOM 453 CD2 PHE 57 12.585 -4.524 -3.271 1.00 0.00 ATOM 454 CE1 PHE 57 15.276 -4.766 -3.716 1.00 0.00 ATOM 455 CE2 PHE 57 13.040 -5.176 -4.410 1.00 0.00 ATOM 456 CZ PHE 57 14.391 -5.283 -4.648 1.00 0.00 ATOM 457 O PHE 57 12.325 -1.317 1.102 1.00 0.00 ATOM 458 C PHE 57 11.852 -1.520 -0.016 1.00 0.00 ATOM 459 N THR 58 10.549 -1.481 -0.270 1.00 0.00 ATOM 460 CA THR 58 9.585 -1.217 0.792 1.00 0.00 ATOM 461 CB THR 58 8.195 -0.893 0.215 1.00 0.00 ATOM 462 CG2 THR 58 7.211 -0.584 1.334 1.00 0.00 ATOM 463 OG1 THR 58 8.287 0.247 -0.649 1.00 0.00 ATOM 464 O THR 58 9.093 -3.517 1.261 1.00 0.00 ATOM 465 C THR 58 9.455 -2.433 1.708 1.00 0.00 ATOM 466 N LEU 59 9.721 -2.231 2.997 1.00 0.00 ATOM 467 CA LEU 59 9.635 -3.300 3.987 1.00 0.00 ATOM 468 CB LEU 59 10.641 -3.191 5.098 1.00 0.00 ATOM 469 CG LEU 59 12.044 -3.688 4.707 1.00 0.00 ATOM 470 CD1 LEU 59 13.019 -3.466 5.854 1.00 0.00 ATOM 471 CD2 LEU 59 12.024 -5.165 4.340 1.00 0.00 ATOM 472 O LEU 59 7.705 -4.359 4.969 1.00 0.00 ATOM 473 C LEU 59 8.272 -3.303 4.687 1.00 0.00 ATOM 474 N GLU 60 7.730 -2.112 4.923 1.00 0.00 ATOM 475 CA GLU 60 6.424 -1.971 5.562 1.00 0.00 ATOM 476 CB GLU 60 6.547 -1.956 7.086 1.00 0.00 ATOM 477 CG GLU 60 6.999 -3.277 7.694 1.00 0.00 ATOM 478 CD GLU 60 6.957 -3.278 9.217 1.00 0.00 ATOM 479 OE1 GLU 60 6.879 -4.379 9.805 1.00 0.00 ATOM 480 OE2 GLU 60 7.004 -2.185 9.825 1.00 0.00 ATOM 481 O GLU 60 6.556 0.311 4.846 1.00 0.00 ATOM 482 C GLU 60 5.831 -0.651 5.087 1.00 0.00 ATOM 483 N ALA 61 4.515 -0.626 4.909 1.00 0.00 ATOM 484 CA ALA 61 3.849 0.576 4.433 1.00 0.00 ATOM 485 CB ALA 61 3.825 0.635 2.913 1.00 0.00 ATOM 486 O ALA 61 1.675 -0.373 4.814 1.00 0.00 ATOM 487 C ALA 61 2.413 0.606 4.938 1.00 0.00 ATOM 488 N HIS 62 2.028 1.729 5.539 1.00 0.00 ATOM 489 CA HIS 62 0.670 1.906 6.035 1.00 0.00 ATOM 490 CB HIS 62 0.581 1.874 7.566 1.00 0.00 ATOM 491 CG HIS 62 1.546 0.940 8.220 1.00 0.00 ATOM 492 CD2 HIS 62 1.537 -0.409 8.333 1.00 0.00 ATOM 493 ND1 HIS 62 2.664 1.377 8.887 1.00 0.00 ATOM 494 CE1 HIS 62 3.317 0.328 9.369 1.00 0.00 ATOM 495 NE2 HIS 62 2.654 -0.768 9.048 1.00 0.00 ATOM 496 O HIS 62 0.750 4.215 5.403 1.00 0.00 ATOM 497 C HIS 62 0.117 3.156 5.365 1.00 0.00 ATOM 498 N ILE 63 -1.039 3.022 4.727 1.00 0.00 ATOM 499 CA ILE 63 -1.674 4.157 4.072 1.00 0.00 ATOM 500 CB ILE 63 -1.748 3.934 2.549 1.00 0.00 ATOM 501 CG1 ILE 63 -0.346 3.771 1.964 1.00 0.00 ATOM 502 CG2 ILE 63 -2.421 5.119 1.870 1.00 0.00 ATOM 503 CD1 ILE 63 -0.336 3.343 0.512 1.00 0.00 ATOM 504 O ILE 63 -3.858 3.333 4.645 1.00 0.00 ATOM 505 C ILE 63 -3.101 4.310 4.592 1.00 0.00 ATOM 506 N ASN 64 -3.458 5.535 4.940 1.00 0.00 ATOM 507 CA ASN 64 -4.796 5.847 5.423 1.00 0.00 ATOM 508 CB ASN 64 -4.753 6.503 6.805 1.00 0.00 ATOM 509 CG ASN 64 -4.119 5.609 7.852 1.00 0.00 ATOM 510 ND2 ASN 64 -2.961 6.021 8.357 1.00 0.00 ATOM 511 OD1 ASN 64 -4.666 4.564 8.205 1.00 0.00 ATOM 512 O ASN 64 -4.797 7.769 3.986 1.00 0.00 ATOM 513 C ASN 64 -5.412 6.780 4.389 1.00 0.00 ATOM 514 N TYR 65 -6.617 6.442 3.943 1.00 0.00 ATOM 515 CA TYR 65 -7.315 7.208 2.919 1.00 0.00 ATOM 516 CB TYR 65 -8.010 6.235 1.945 1.00 0.00 ATOM 517 CG TYR 65 -7.011 5.467 1.083 1.00 0.00 ATOM 518 CD1 TYR 65 -6.342 6.071 0.037 1.00 0.00 ATOM 519 CD2 TYR 65 -6.705 4.143 1.384 1.00 0.00 ATOM 520 CE1 TYR 65 -5.409 5.377 -0.731 1.00 0.00 ATOM 521 CE2 TYR 65 -5.813 3.394 0.604 1.00 0.00 ATOM 522 CZ TYR 65 -5.178 4.040 -0.424 1.00 0.00 ATOM 523 OH TYR 65 -4.264 3.369 -1.221 1.00 0.00 ATOM 524 O TYR 65 -9.191 7.552 4.375 1.00 0.00 ATOM 525 C TYR 65 -8.428 8.045 3.546 1.00 0.00 ATOM 526 N LEU 66 -8.531 9.306 3.126 1.00 0.00 ATOM 527 CA LEU 66 -9.536 10.230 3.671 1.00 0.00 ATOM 528 CB LEU 66 -8.876 11.432 4.347 1.00 0.00 ATOM 529 CG LEU 66 -7.994 11.127 5.561 1.00 0.00 ATOM 530 CD1 LEU 66 -7.310 12.390 6.059 1.00 0.00 ATOM 531 CD2 LEU 66 -8.826 10.555 6.700 1.00 0.00 ATOM 532 O LEU 66 -11.714 10.809 2.826 1.00 0.00 ATOM 533 C LEU 66 -10.497 10.775 2.616 1.00 0.00 ATOM 534 N HIS 67 -9.939 11.226 1.498 1.00 0.00 ATOM 535 CA HIS 67 -10.737 11.798 0.420 1.00 0.00 ATOM 536 CB HIS 67 -10.686 13.325 0.502 1.00 0.00 ATOM 537 CG HIS 67 -11.274 13.883 1.761 1.00 0.00 ATOM 538 CD2 HIS 67 -10.743 14.417 3.007 1.00 0.00 ATOM 539 ND1 HIS 67 -12.633 13.991 1.965 1.00 0.00 ATOM 540 CE1 HIS 67 -12.852 14.523 3.181 1.00 0.00 ATOM 541 NE2 HIS 67 -11.722 14.780 3.810 1.00 0.00 ATOM 542 O HIS 67 -9.121 10.731 -0.993 1.00 0.00 ATOM 543 C HIS 67 -10.224 11.269 -0.914 1.00 0.00 ATOM 544 N GLU 68 -11.034 11.387 -1.974 1.00 0.00 ATOM 545 CA GLU 68 -10.619 10.897 -3.288 1.00 0.00 ATOM 546 CB GLU 68 -11.785 10.290 -4.071 1.00 0.00 ATOM 547 CG GLU 68 -12.344 9.013 -3.464 1.00 0.00 ATOM 548 CD GLU 68 -11.318 7.898 -3.408 1.00 0.00 ATOM 549 OE1 GLU 68 -10.742 7.565 -4.464 1.00 0.00 ATOM 550 OE2 GLU 68 -11.091 7.358 -2.305 1.00 0.00 ATOM 551 O GLU 68 -10.660 13.043 -4.337 1.00 0.00 ATOM 552 C GLU 68 -10.138 11.949 -4.263 1.00 0.00 ATOM 553 N VAL 69 -9.203 11.599 -5.107 1.00 0.00 ATOM 554 CA VAL 69 -8.733 12.384 -6.229 1.00 0.00 ATOM 555 CB VAL 69 -7.221 12.145 -6.385 1.00 0.00 ATOM 556 CG1 VAL 69 -6.661 12.995 -7.515 1.00 0.00 ATOM 557 CG2 VAL 69 -6.490 12.509 -5.102 1.00 0.00 ATOM 558 O VAL 69 -9.907 10.799 -7.583 1.00 0.00 ATOM 559 C VAL 69 -9.508 11.960 -7.473 1.00 0.00 ATOM 560 N LYS 70 -9.706 12.871 -8.419 1.00 0.00 ATOM 561 CA LYS 70 -10.439 12.513 -9.624 1.00 0.00 ATOM 562 CB LYS 70 -11.756 13.288 -9.691 1.00 0.00 ATOM 563 CG LYS 70 -12.731 12.951 -8.573 1.00 0.00 ATOM 564 CD LYS 70 -13.995 13.788 -8.676 1.00 0.00 ATOM 565 CE LYS 70 -14.966 13.458 -7.552 1.00 0.00 ATOM 566 NZ LYS 70 -16.247 14.205 -7.688 1.00 0.00 ATOM 567 O LYS 70 -8.512 13.259 -10.843 1.00 0.00 ATOM 568 C LYS 70 -9.639 12.770 -10.890 1.00 0.00 ATOM 569 N LEU 71 -10.224 12.389 -12.015 1.00 0.00 ATOM 570 CA LEU 71 -9.591 12.571 -13.313 1.00 0.00 ATOM 571 CB LEU 71 -10.542 12.146 -14.433 1.00 0.00 ATOM 572 CG LEU 71 -9.990 12.224 -15.858 1.00 0.00 ATOM 573 CD1 LEU 71 -8.840 11.246 -16.043 1.00 0.00 ATOM 574 CD2 LEU 71 -11.070 11.884 -16.872 1.00 0.00 ATOM 575 O LEU 71 -10.124 14.907 -13.458 1.00 0.00 ATOM 576 C LEU 71 -9.257 14.034 -13.565 1.00 0.00 ATOM 577 N GLY 72 -7.991 14.282 -13.887 1.00 0.00 ATOM 578 CA GLY 72 -7.472 15.609 -14.195 1.00 0.00 ATOM 579 O GLY 72 -6.631 17.611 -13.178 1.00 0.00 ATOM 580 C GLY 72 -7.076 16.476 -13.000 1.00 0.00 ATOM 581 N THR 73 -7.233 15.966 -11.786 1.00 0.00 ATOM 582 CA THR 73 -6.823 16.740 -10.613 1.00 0.00 ATOM 583 CB THR 73 -7.380 16.183 -9.262 1.00 0.00 ATOM 584 CG2 THR 73 -7.062 17.033 -8.081 1.00 0.00 ATOM 585 OG1 THR 73 -8.828 16.191 -9.238 1.00 0.00 ATOM 586 O THR 73 -4.643 15.749 -10.702 1.00 0.00 ATOM 587 C THR 73 -5.302 16.760 -10.518 1.00 0.00 ATOM 588 N GLU 74 -4.765 17.926 -10.260 1.00 0.00 ATOM 589 CA GLU 74 -3.342 18.069 -10.069 1.00 0.00 ATOM 590 CB GLU 74 -2.859 19.433 -10.601 1.00 0.00 ATOM 591 CG GLU 74 -3.115 19.605 -12.085 1.00 0.00 ATOM 592 CD GLU 74 -4.425 20.343 -12.393 1.00 0.00 ATOM 593 OE1 GLU 74 -5.400 20.276 -11.588 1.00 0.00 ATOM 594 OE2 GLU 74 -4.484 21.007 -13.457 1.00 0.00 ATOM 595 O GLU 74 -3.823 18.431 -7.755 1.00 0.00 ATOM 596 C GLU 74 -3.162 17.802 -8.583 1.00 0.00 ATOM 597 N VAL 75 -2.268 16.886 -8.247 1.00 0.00 ATOM 598 CA VAL 75 -2.028 16.560 -6.850 1.00 0.00 ATOM 599 CB VAL 75 -2.175 15.057 -6.544 1.00 0.00 ATOM 600 CG1 VAL 75 -3.600 14.597 -6.810 1.00 0.00 ATOM 601 CG2 VAL 75 -1.236 14.241 -7.419 1.00 0.00 ATOM 602 O VAL 75 0.320 16.768 -7.292 1.00 0.00 ATOM 603 C VAL 75 -0.580 16.802 -6.453 1.00 0.00 ATOM 604 N TRP 76 -0.381 17.020 -5.179 1.00 0.00 ATOM 605 CA TRP 76 0.958 17.232 -4.644 1.00 0.00 ATOM 606 CB TRP 76 0.975 18.533 -3.865 1.00 0.00 ATOM 607 CG TRP 76 1.078 19.699 -4.830 1.00 0.00 ATOM 608 CD1 TRP 76 -0.033 20.275 -5.398 1.00 0.00 ATOM 609 CD2 TRP 76 2.252 20.269 -5.245 1.00 0.00 ATOM 610 CE2 TRP 76 1.790 21.225 -6.136 1.00 0.00 ATOM 611 CE3 TRP 76 3.602 20.092 -5.031 1.00 0.00 ATOM 612 NE1 TRP 76 0.432 21.201 -6.192 1.00 0.00 ATOM 613 CZ2 TRP 76 2.710 22.047 -6.777 1.00 0.00 ATOM 614 CZ3 TRP 76 4.501 20.904 -5.671 1.00 0.00 ATOM 615 CH2 TRP 76 4.063 21.866 -6.553 1.00 0.00 ATOM 616 O TRP 76 0.511 15.847 -2.746 1.00 0.00 ATOM 617 C TRP 76 1.289 16.129 -3.663 1.00 0.00 ATOM 618 N VAL 77 2.430 15.484 -3.871 1.00 0.00 ATOM 619 CA VAL 77 2.863 14.429 -2.968 1.00 0.00 ATOM 620 CB VAL 77 3.473 13.241 -3.735 1.00 0.00 ATOM 621 CG1 VAL 77 3.974 12.180 -2.765 1.00 0.00 ATOM 622 CG2 VAL 77 2.437 12.606 -4.648 1.00 0.00 ATOM 623 O VAL 77 4.819 15.748 -2.596 1.00 0.00 ATOM 624 C VAL 77 3.896 15.111 -2.085 1.00 0.00 ATOM 625 N GLN 78 3.740 15.000 -0.769 1.00 0.00 ATOM 626 CA GLN 78 4.689 15.606 0.158 1.00 0.00 ATOM 627 CB GLN 78 3.978 16.382 1.247 1.00 0.00 ATOM 628 CG GLN 78 3.200 17.584 0.703 1.00 0.00 ATOM 629 CD GLN 78 2.430 18.329 1.761 1.00 0.00 ATOM 630 OE1 GLN 78 2.757 18.268 2.947 1.00 0.00 ATOM 631 NE2 GLN 78 1.409 19.071 1.333 1.00 0.00 ATOM 632 O GLN 78 4.906 13.544 1.352 1.00 0.00 ATOM 633 C GLN 78 5.482 14.503 0.845 1.00 0.00 ATOM 634 N THR 79 6.803 14.642 0.847 1.00 0.00 ATOM 635 CA THR 79 7.675 13.623 1.422 1.00 0.00 ATOM 636 CB THR 79 8.466 12.895 0.320 1.00 0.00 ATOM 637 CG2 THR 79 7.517 12.247 -0.677 1.00 0.00 ATOM 638 OG1 THR 79 9.296 13.833 -0.374 1.00 0.00 ATOM 639 O THR 79 9.251 15.276 2.196 1.00 0.00 ATOM 640 C THR 79 8.654 14.220 2.428 1.00 0.00 ATOM 641 N GLN 80 8.890 13.435 3.516 1.00 0.00 ATOM 642 CA GLN 80 9.849 13.806 4.544 1.00 0.00 ATOM 643 CB GLN 80 9.141 14.626 5.616 1.00 0.00 ATOM 644 CG GLN 80 9.890 14.772 6.914 1.00 0.00 ATOM 645 CD GLN 80 9.230 15.762 7.846 1.00 0.00 ATOM 646 OE1 GLN 80 8.038 15.649 8.165 1.00 0.00 ATOM 647 NE2 GLN 80 10.005 16.753 8.294 1.00 0.00 ATOM 648 O GLN 80 9.802 11.518 5.249 1.00 0.00 ATOM 649 C GLN 80 10.483 12.529 5.090 1.00 0.00 ATOM 650 N ILE 81 11.778 12.567 5.374 1.00 0.00 ATOM 651 CA ILE 81 12.445 11.408 5.956 1.00 0.00 ATOM 652 CB ILE 81 13.889 11.217 5.424 1.00 0.00 ATOM 653 CG1 ILE 81 13.860 11.075 3.890 1.00 0.00 ATOM 654 CG2 ILE 81 14.492 10.051 6.074 1.00 0.00 ATOM 655 CD1 ILE 81 15.219 10.989 3.259 1.00 0.00 ATOM 656 O ILE 81 13.121 12.588 7.906 1.00 0.00 ATOM 657 C ILE 81 12.430 11.657 7.450 1.00 0.00 ATOM 658 N LEU 82 11.699 10.915 8.202 1.00 0.00 ATOM 659 CA LEU 82 11.569 11.087 9.641 1.00 0.00 ATOM 660 CB LEU 82 10.172 10.703 10.118 1.00 0.00 ATOM 661 CG LEU 82 9.093 11.724 9.707 1.00 0.00 ATOM 662 CD1 LEU 82 7.720 11.104 10.067 1.00 0.00 ATOM 663 CD2 LEU 82 9.263 13.070 10.387 1.00 0.00 ATOM 664 O LEU 82 12.857 10.637 11.608 1.00 0.00 ATOM 665 C LEU 82 12.574 10.286 10.463 1.00 0.00 ATOM 666 N GLY 83 13.060 9.177 9.910 1.00 0.00 ATOM 667 CA GLY 83 14.029 8.339 10.613 1.00 0.00 ATOM 668 O GLY 83 14.720 7.297 8.568 1.00 0.00 ATOM 669 C GLY 83 15.055 7.719 9.676 1.00 0.00 ATOM 670 N PHE 84 16.296 7.633 10.148 1.00 0.00 ATOM 671 CA PHE 84 17.382 7.037 9.379 1.00 0.00 ATOM 672 CB PHE 84 18.266 8.156 8.803 1.00 0.00 ATOM 673 CG PHE 84 19.525 7.645 8.169 1.00 0.00 ATOM 674 CD1 PHE 84 19.490 7.024 6.920 1.00 0.00 ATOM 675 CD2 PHE 84 20.742 7.752 8.833 1.00 0.00 ATOM 676 CE1 PHE 84 20.642 6.523 6.354 1.00 0.00 ATOM 677 CE2 PHE 84 21.916 7.244 8.264 1.00 0.00 ATOM 678 CZ PHE 84 21.866 6.631 7.030 1.00 0.00 ATOM 679 O PHE 84 18.617 6.528 11.368 1.00 0.00 ATOM 680 C PHE 84 18.170 6.115 10.296 1.00 0.00 ATOM 681 N ASP 85 18.290 4.854 9.903 1.00 0.00 ATOM 682 CA ASP 85 19.036 3.886 10.691 1.00 0.00 ATOM 683 CB ASP 85 18.120 2.786 11.234 1.00 0.00 ATOM 684 CG ASP 85 18.697 2.094 12.451 1.00 0.00 ATOM 685 OD1 ASP 85 19.879 2.341 12.770 1.00 0.00 ATOM 686 OD2 ASP 85 17.967 1.305 13.088 1.00 0.00 ATOM 687 O ASP 85 20.443 3.788 8.726 1.00 0.00 ATOM 688 C ASP 85 20.125 3.283 9.810 1.00 0.00 ATOM 689 N ARG 86 20.681 2.141 10.326 1.00 0.00 ATOM 690 CA ARG 86 21.838 1.572 9.643 1.00 0.00 ATOM 691 CB ARG 86 22.244 0.244 10.171 1.00 0.00 ATOM 692 CG ARG 86 23.000 0.360 11.495 1.00 0.00 ATOM 693 CD ARG 86 23.655 -0.956 11.889 1.00 0.00 ATOM 694 NE ARG 86 22.663 -1.959 12.230 1.00 0.00 ATOM 695 CZ ARG 86 22.058 -2.023 13.409 1.00 0.00 ATOM 696 NH1 ARG 86 22.362 -1.141 14.353 1.00 0.00 ATOM 697 NH2 ARG 86 21.142 -2.953 13.642 1.00 0.00 ATOM 698 O ARG 86 22.144 1.807 7.277 1.00 0.00 ATOM 699 C ARG 86 21.523 1.256 8.190 1.00 0.00 ATOM 700 N LYS 87 20.509 0.313 8.010 1.00 0.00 ATOM 701 CA LYS 87 20.148 -0.101 6.659 1.00 0.00 ATOM 702 CB LYS 87 20.406 -1.785 6.712 1.00 0.00 ATOM 703 CG LYS 87 21.370 -2.331 7.768 1.00 0.00 ATOM 704 CD LYS 87 21.099 -3.807 8.010 1.00 0.00 ATOM 705 CE LYS 87 22.367 -4.527 8.528 1.00 0.00 ATOM 706 NZ LYS 87 22.017 -5.766 9.275 1.00 0.00 ATOM 707 O LYS 87 18.193 -0.245 5.293 1.00 0.00 ATOM 708 C LYS 87 18.749 0.323 6.235 1.00 0.00 ATOM 709 N ARG 88 18.145 1.263 6.952 1.00 0.00 ATOM 710 CA ARG 88 16.794 1.664 6.594 1.00 0.00 ATOM 711 CB ARG 88 15.708 0.786 7.218 1.00 0.00 ATOM 712 CG ARG 88 15.652 0.850 8.736 1.00 0.00 ATOM 713 CD ARG 88 14.569 -0.059 9.290 1.00 0.00 ATOM 714 NE ARG 88 14.489 0.003 10.747 1.00 0.00 ATOM 715 CZ ARG 88 13.733 0.865 11.418 1.00 0.00 ATOM 716 NH1 ARG 88 13.726 0.850 12.743 1.00 0.00 ATOM 717 NH2 ARG 88 12.982 1.741 10.760 1.00 0.00 ATOM 718 O ARG 88 17.263 3.804 7.574 1.00 0.00 ATOM 719 C ARG 88 16.456 3.090 6.978 1.00 0.00 ATOM 720 N LEU 89 15.321 3.549 6.459 1.00 0.00 ATOM 721 CA LEU 89 14.829 4.883 6.743 1.00 0.00 ATOM 722 CB LEU 89 15.114 5.847 5.599 1.00 0.00 ATOM 723 CG LEU 89 14.446 5.656 4.235 1.00 0.00 ATOM 724 CD1 LEU 89 14.498 6.975 3.457 1.00 0.00 ATOM 725 CD2 LEU 89 15.144 4.545 3.465 1.00 0.00 ATOM 726 O LEU 89 12.742 3.808 6.297 1.00 0.00 ATOM 727 C LEU 89 13.315 4.820 6.717 1.00 0.00 ATOM 728 N HIS 90 12.705 5.804 7.357 1.00 0.00 ATOM 729 CA HIS 90 11.250 5.898 7.420 1.00 0.00 ATOM 730 CB HIS 90 10.741 5.882 8.864 1.00 0.00 ATOM 731 CG HIS 90 9.251 5.979 8.979 1.00 0.00 ATOM 732 CD2 HIS 90 8.303 7.016 9.357 1.00 0.00 ATOM 733 ND1 HIS 90 8.413 4.922 8.697 1.00 0.00 ATOM 734 CE1 HIS 90 7.140 5.306 8.891 1.00 0.00 ATOM 735 NE2 HIS 90 7.065 6.564 9.286 1.00 0.00 ATOM 736 O HIS 90 11.285 8.280 7.070 1.00 0.00 ATOM 737 C HIS 90 10.806 7.188 6.746 1.00 0.00 ATOM 738 N VAL 91 9.909 7.044 5.781 1.00 0.00 ATOM 739 CA VAL 91 9.371 8.176 5.046 1.00 0.00 ATOM 740 CB VAL 91 9.491 8.000 3.486 1.00 0.00 ATOM 741 CG1 VAL 91 10.918 7.730 3.060 1.00 0.00 ATOM 742 CG2 VAL 91 8.558 6.875 3.021 1.00 0.00 ATOM 743 O VAL 91 7.190 7.535 5.802 1.00 0.00 ATOM 744 C VAL 91 7.968 8.459 5.554 1.00 0.00 ATOM 745 N TYR 92 7.643 9.736 5.684 1.00 0.00 ATOM 746 CA TYR 92 6.311 10.157 6.080 1.00 0.00 ATOM 747 CB TYR 92 6.384 11.018 7.343 1.00 0.00 ATOM 748 CG TYR 92 5.038 11.505 7.829 1.00 0.00 ATOM 749 CD1 TYR 92 4.176 10.656 8.511 1.00 0.00 ATOM 750 CD2 TYR 92 4.633 12.817 7.605 1.00 0.00 ATOM 751 CE1 TYR 92 2.944 11.093 8.958 1.00 0.00 ATOM 752 CE2 TYR 92 3.403 13.270 8.046 1.00 0.00 ATOM 753 CZ TYR 92 2.560 12.395 8.729 1.00 0.00 ATOM 754 OH TYR 92 1.332 12.834 9.172 1.00 0.00 ATOM 755 O TYR 92 6.625 11.746 4.315 1.00 0.00 ATOM 756 C TYR 92 5.881 10.905 4.825 1.00 0.00 ATOM 757 N HIS 93 4.743 10.519 4.263 1.00 0.00 ATOM 758 CA HIS 93 4.269 11.136 3.033 1.00 0.00 ATOM 759 CB HIS 93 4.361 10.199 1.820 1.00 0.00 ATOM 760 CG HIS 93 5.759 9.829 1.438 1.00 0.00 ATOM 761 CD2 HIS 93 6.948 10.091 2.033 1.00 0.00 ATOM 762 ND1 HIS 93 6.053 9.066 0.330 1.00 0.00 ATOM 763 CE1 HIS 93 7.358 8.887 0.248 1.00 0.00 ATOM 764 NE2 HIS 93 7.926 9.510 1.266 1.00 0.00 ATOM 765 O HIS 93 2.039 10.731 3.815 1.00 0.00 ATOM 766 C HIS 93 2.769 11.372 3.062 1.00 0.00 ATOM 767 N SER 94 2.320 12.330 2.259 1.00 0.00 ATOM 768 CA SER 94 0.906 12.635 2.161 1.00 0.00 ATOM 769 CB SER 94 0.536 13.711 3.183 1.00 0.00 ATOM 770 OG SER 94 1.163 14.943 2.874 1.00 0.00 ATOM 771 O SER 94 1.463 13.547 0.015 1.00 0.00 ATOM 772 C SER 94 0.578 13.134 0.766 1.00 0.00 ATOM 773 N LEU 95 -0.681 12.993 0.383 1.00 0.00 ATOM 774 CA LEU 95 -1.113 13.438 -0.927 1.00 0.00 ATOM 775 CB LEU 95 -1.602 12.257 -1.770 1.00 0.00 ATOM 776 CG LEU 95 -2.152 12.596 -3.158 1.00 0.00 ATOM 777 CD1 LEU 95 -1.050 13.135 -4.057 1.00 0.00 ATOM 778 CD2 LEU 95 -2.743 11.359 -3.818 1.00 0.00 ATOM 779 O LEU 95 -3.282 14.046 -0.123 1.00 0.00 ATOM 780 C LEU 95 -2.279 14.412 -0.756 1.00 0.00 ATOM 781 N HIS 96 -2.153 15.599 -1.373 1.00 0.00 ATOM 782 CA HIS 96 -3.141 16.638 -1.209 1.00 0.00 ATOM 783 CB HIS 96 -2.582 17.836 -0.431 1.00 0.00 ATOM 784 CG HIS 96 -2.145 17.508 0.961 1.00 0.00 ATOM 785 CD2 HIS 96 -0.944 17.128 1.452 1.00 0.00 ATOM 786 ND1 HIS 96 -2.998 17.572 2.037 1.00 0.00 ATOM 787 CE1 HIS 96 -2.345 17.241 3.137 1.00 0.00 ATOM 788 NE2 HIS 96 -1.097 16.962 2.807 1.00 0.00 ATOM 789 O HIS 96 -3.091 17.157 -3.579 1.00 0.00 ATOM 790 C HIS 96 -3.709 17.235 -2.514 1.00 0.00 ATOM 791 N ARG 97 -4.906 17.803 -2.385 1.00 0.00 ATOM 792 CA ARG 97 -5.625 18.498 -3.461 1.00 0.00 ATOM 793 CB ARG 97 -7.068 18.711 -3.223 1.00 0.00 ATOM 794 CG ARG 97 -7.881 19.042 -4.490 1.00 0.00 ATOM 795 CD ARG 97 -9.385 19.257 -4.201 1.00 0.00 ATOM 796 NE ARG 97 -10.113 18.063 -3.735 1.00 0.00 ATOM 797 CZ ARG 97 -10.476 17.034 -4.504 1.00 0.00 ATOM 798 NH1 ARG 97 -10.184 17.015 -5.800 1.00 0.00 ATOM 799 NH2 ARG 97 -11.165 16.021 -3.984 1.00 0.00 ATOM 800 O ARG 97 -4.673 20.571 -2.745 1.00 0.00 ATOM 801 C ARG 97 -4.773 19.746 -3.655 1.00 0.00 ATOM 802 N ALA 98 -4.132 19.869 -4.811 1.00 0.00 ATOM 803 CA ALA 98 -3.260 21.020 -5.082 1.00 0.00 ATOM 804 CB ALA 98 -2.898 21.115 -6.582 1.00 0.00 ATOM 805 O ALA 98 -3.311 23.335 -4.474 1.00 0.00 ATOM 806 C ALA 98 -3.934 22.377 -4.933 1.00 0.00 ATOM 807 N GLY 99 -5.205 22.472 -5.285 1.00 0.00 ATOM 808 CA GLY 99 -5.930 23.724 -5.172 1.00 0.00 ATOM 809 O GLY 99 -6.199 25.282 -3.370 1.00 0.00 ATOM 810 C GLY 99 -6.354 24.127 -3.763 1.00 0.00 ATOM 811 N PHE 100 -6.871 23.185 -2.983 1.00 0.00 ATOM 812 CA PHE 100 -7.368 23.506 -1.650 1.00 0.00 ATOM 813 CB PHE 100 -8.980 22.899 -1.737 1.00 0.00 ATOM 814 CG PHE 100 -9.758 23.018 -3.013 1.00 0.00 ATOM 815 CD1 PHE 100 -9.291 22.439 -4.180 1.00 0.00 ATOM 816 CD2 PHE 100 -11.026 23.582 -3.007 1.00 0.00 ATOM 817 CE1 PHE 100 -10.010 22.530 -5.354 1.00 0.00 ATOM 818 CE2 PHE 100 -11.774 23.647 -4.173 1.00 0.00 ATOM 819 CZ PHE 100 -11.264 23.141 -5.348 1.00 0.00 ATOM 820 O PHE 100 -6.926 23.034 0.627 1.00 0.00 ATOM 821 C PHE 100 -6.601 22.833 -0.538 1.00 0.00 ATOM 822 N ASP 101 -5.532 22.002 -0.889 1.00 0.00 ATOM 823 CA ASP 101 -4.705 21.279 0.091 1.00 0.00 ATOM 824 CB ASP 101 -4.218 22.400 1.011 1.00 0.00 ATOM 825 CG ASP 101 -3.241 23.336 0.325 1.00 0.00 ATOM 826 OD1 ASP 101 -2.299 22.839 -0.323 1.00 0.00 ATOM 827 OD2 ASP 101 -3.422 24.569 0.437 1.00 0.00 ATOM 828 O ASP 101 -5.043 19.871 1.986 1.00 0.00 ATOM 829 C ASP 101 -5.488 20.270 0.913 1.00 0.00 ATOM 830 N GLU 102 -6.676 19.863 0.349 1.00 0.00 ATOM 831 CA GLU 102 -7.462 18.839 1.034 1.00 0.00 ATOM 832 CB GLU 102 -8.746 18.567 0.248 1.00 0.00 ATOM 833 CG GLU 102 -9.733 17.662 0.966 1.00 0.00 ATOM 834 CD GLU 102 -11.012 17.455 0.178 1.00 0.00 ATOM 835 OE1 GLU 102 -11.125 18.020 -0.931 1.00 0.00 ATOM 836 OE2 GLU 102 -11.900 16.726 0.668 1.00 0.00 ATOM 837 O GLU 102 -6.028 17.127 0.159 1.00 0.00 ATOM 838 C GLU 102 -6.620 17.567 1.146 1.00 0.00 ATOM 839 N VAL 103 -6.535 17.000 2.347 1.00 0.00 ATOM 840 CA VAL 103 -5.747 15.784 2.549 1.00 0.00 ATOM 841 CB VAL 103 -5.551 15.475 4.044 1.00 0.00 ATOM 842 CG1 VAL 103 -4.698 14.221 4.198 1.00 0.00 ATOM 843 CG2 VAL 103 -4.869 16.657 4.736 1.00 0.00 ATOM 844 O VAL 103 -7.415 14.068 2.605 1.00 0.00 ATOM 845 C VAL 103 -6.470 14.564 1.993 1.00 0.00 ATOM 846 N LEU 104 -5.969 14.026 0.884 1.00 0.00 ATOM 847 CA LEU 104 -6.594 12.858 0.265 1.00 0.00 ATOM 848 CB LEU 104 -6.145 12.727 -1.191 1.00 0.00 ATOM 849 CG LEU 104 -6.581 13.849 -2.135 1.00 0.00 ATOM 850 CD1 LEU 104 -5.961 13.661 -3.515 1.00 0.00 ATOM 851 CD2 LEU 104 -8.096 13.862 -2.294 1.00 0.00 ATOM 852 O LEU 104 -7.086 10.750 1.302 1.00 0.00 ATOM 853 C LEU 104 -6.227 11.582 1.016 1.00 0.00 ATOM 854 N ALA 105 -4.943 11.437 1.318 1.00 0.00 ATOM 855 CA ALA 105 -4.448 10.289 2.066 1.00 0.00 ATOM 856 CB ALA 105 -4.427 9.060 1.174 1.00 0.00 ATOM 857 O ALA 105 -2.371 11.496 2.179 1.00 0.00 ATOM 858 C ALA 105 -3.032 10.535 2.576 1.00 0.00 ATOM 859 N ALA 106 -2.581 9.692 3.498 1.00 0.00 ATOM 860 CA ALA 106 -1.242 9.825 4.050 1.00 0.00 ATOM 861 CB ALA 106 -1.286 10.554 5.384 1.00 0.00 ATOM 862 O ALA 106 -1.375 7.453 4.372 1.00 0.00 ATOM 863 C ALA 106 -0.650 8.446 4.262 1.00 0.00 ATOM 864 N SER 107 0.672 8.379 4.276 1.00 0.00 ATOM 865 CA SER 107 1.334 7.103 4.446 1.00 0.00 ATOM 866 CB SER 107 1.702 6.505 3.084 1.00 0.00 ATOM 867 OG SER 107 2.678 7.296 2.429 1.00 0.00 ATOM 868 O SER 107 3.255 8.235 5.329 1.00 0.00 ATOM 869 C SER 107 2.623 7.183 5.245 1.00 0.00 ATOM 870 N GLU 108 2.981 6.059 5.850 1.00 0.00 ATOM 871 CA GLU 108 4.230 5.931 6.582 1.00 0.00 ATOM 872 CB GLU 108 3.883 5.468 7.986 1.00 0.00 ATOM 873 CG GLU 108 3.368 6.652 8.810 1.00 0.00 ATOM 874 CD GLU 108 2.808 6.177 10.141 1.00 0.00 ATOM 875 OE1 GLU 108 3.438 5.307 10.774 1.00 0.00 ATOM 876 OE2 GLU 108 1.729 6.675 10.532 1.00 0.00 ATOM 877 O GLU 108 4.304 3.659 5.820 1.00 0.00 ATOM 878 C GLU 108 4.883 4.750 5.884 1.00 0.00 ATOM 879 N GLN 109 6.074 4.971 5.344 1.00 0.00 ATOM 880 CA GLN 109 6.760 3.932 4.599 1.00 0.00 ATOM 881 CB GLN 109 6.876 4.361 3.110 1.00 0.00 ATOM 882 CG GLN 109 5.521 4.647 2.454 1.00 0.00 ATOM 883 CD GLN 109 5.688 5.213 1.069 1.00 0.00 ATOM 884 OE1 GLN 109 6.762 5.209 0.464 1.00 0.00 ATOM 885 NE2 GLN 109 4.547 5.727 0.544 1.00 0.00 ATOM 886 O GLN 109 9.003 4.428 5.272 1.00 0.00 ATOM 887 C GLN 109 8.124 3.574 5.163 1.00 0.00 ATOM 888 N MET 110 8.305 2.294 5.475 1.00 0.00 ATOM 889 CA MET 110 9.586 1.821 5.974 1.00 0.00 ATOM 890 CB MET 110 9.389 0.721 7.019 1.00 0.00 ATOM 891 CG MET 110 10.684 0.180 7.606 1.00 0.00 ATOM 892 SD MET 110 10.406 -1.085 8.860 1.00 0.00 ATOM 893 CE MET 110 9.861 -0.080 10.238 1.00 0.00 ATOM 894 O MET 110 9.879 0.314 4.138 1.00 0.00 ATOM 895 C MET 110 10.306 1.302 4.734 1.00 0.00 ATOM 896 N LEU 111 11.467 1.881 4.441 1.00 0.00 ATOM 897 CA LEU 111 12.250 1.497 3.277 1.00 0.00 ATOM 898 CB LEU 111 12.637 2.701 2.417 1.00 0.00 ATOM 899 CG LEU 111 13.639 2.332 1.310 1.00 0.00 ATOM 900 CD1 LEU 111 12.992 1.359 0.328 1.00 0.00 ATOM 901 CD2 LEU 111 14.105 3.589 0.584 1.00 0.00 ATOM 902 O LEU 111 14.244 1.502 4.612 1.00 0.00 ATOM 903 C LEU 111 13.589 0.937 3.737 1.00 0.00 ATOM 904 N LEU 112 13.993 -0.175 3.134 1.00 0.00 ATOM 905 CA LEU 112 15.252 -0.809 3.493 1.00 0.00 ATOM 906 CB LEU 112 15.046 -2.261 3.928 1.00 0.00 ATOM 907 CG LEU 112 16.304 -3.040 4.311 1.00 0.00 ATOM 908 CD1 LEU 112 16.924 -2.469 5.579 1.00 0.00 ATOM 909 CD2 LEU 112 15.977 -4.506 4.561 1.00 0.00 ATOM 910 O LEU 112 15.770 -1.026 1.139 1.00 0.00 ATOM 911 C LEU 112 16.198 -0.748 2.280 1.00 0.00 ATOM 912 N HIS 113 17.471 -0.462 2.554 1.00 0.00 ATOM 913 CA HIS 113 18.479 -0.482 1.522 1.00 0.00 ATOM 914 CB HIS 113 19.749 0.117 2.058 1.00 0.00 ATOM 915 CG HIS 113 20.762 0.341 0.976 1.00 0.00 ATOM 916 CD2 HIS 113 20.903 -0.222 -0.252 1.00 0.00 ATOM 917 ND1 HIS 113 21.789 1.256 1.097 1.00 0.00 ATOM 918 CE1 HIS 113 22.522 1.243 -0.005 1.00 0.00 ATOM 919 NE2 HIS 113 22.007 0.356 -0.839 1.00 0.00 ATOM 920 O HIS 113 19.193 -2.611 2.353 1.00 0.00 ATOM 921 C HIS 113 18.943 -1.920 1.362 1.00 0.00 ATOM 922 N VAL 114 19.058 -2.380 0.123 1.00 0.00 ATOM 923 CA VAL 114 19.479 -3.753 -0.106 1.00 0.00 ATOM 924 CB VAL 114 18.275 -4.677 -0.370 1.00 0.00 ATOM 925 CG1 VAL 114 17.358 -4.718 0.844 1.00 0.00 ATOM 926 CG2 VAL 114 17.472 -4.181 -1.562 1.00 0.00 ATOM 927 O VAL 114 20.592 -3.006 -2.103 1.00 0.00 ATOM 928 C VAL 114 20.406 -3.920 -1.295 1.00 0.00 ATOM 929 N ASP 115 21.046 -5.082 -1.336 1.00 0.00 ATOM 930 CA ASP 115 21.906 -5.465 -2.437 1.00 0.00 ATOM 931 CB ASP 115 22.967 -6.428 -1.949 1.00 0.00 ATOM 932 CG ASP 115 23.992 -6.703 -3.026 1.00 0.00 ATOM 933 OD1 ASP 115 23.612 -6.713 -4.214 1.00 0.00 ATOM 934 OD2 ASP 115 25.173 -6.922 -2.686 1.00 0.00 ATOM 935 O ASP 115 20.298 -7.178 -2.908 1.00 0.00 ATOM 936 C ASP 115 20.879 -6.177 -3.320 1.00 0.00 ATOM 937 N LEU 116 20.552 -5.593 -4.484 1.00 0.00 ATOM 938 CA LEU 116 19.577 -6.141 -5.433 1.00 0.00 ATOM 939 CB LEU 116 19.519 -5.118 -6.648 1.00 0.00 ATOM 940 CG LEU 116 18.544 -5.567 -7.741 1.00 0.00 ATOM 941 CD1 LEU 116 17.101 -5.709 -7.146 1.00 0.00 ATOM 942 CD2 LEU 116 18.542 -4.545 -8.869 1.00 0.00 ATOM 943 O LEU 116 18.801 -8.278 -6.182 1.00 0.00 ATOM 944 C LEU 116 19.776 -7.577 -5.906 1.00 0.00 ATOM 945 N ALA 117 21.028 -7.997 -6.050 1.00 0.00 ATOM 946 CA ALA 117 21.320 -9.345 -6.522 1.00 0.00 ATOM 947 CB ALA 117 22.810 -9.456 -6.890 1.00 0.00 ATOM 948 O ALA 117 20.371 -11.452 -5.903 1.00 0.00 ATOM 949 C ALA 117 20.914 -10.418 -5.523 1.00 0.00 ATOM 950 N GLY 118 21.145 -10.155 -4.242 1.00 0.00 ATOM 951 CA GLY 118 20.790 -11.114 -3.201 1.00 0.00 ATOM 952 O GLY 118 19.080 -11.415 -1.546 1.00 0.00 ATOM 953 C GLY 118 19.553 -10.689 -2.422 1.00 0.00 ATOM 954 N PRO 119 19.049 -9.423 -2.741 1.00 0.00 ATOM 955 CA PRO 119 17.876 -8.896 -2.061 1.00 0.00 ATOM 956 CB PRO 119 16.712 -9.265 -2.844 1.00 0.00 ATOM 957 CG PRO 119 17.129 -10.480 -3.601 1.00 0.00 ATOM 958 CD PRO 119 18.547 -10.139 -4.016 1.00 0.00 ATOM 959 O PRO 119 17.251 -9.492 0.182 1.00 0.00 ATOM 960 C PRO 119 18.118 -9.035 -0.559 1.00 0.00 ATOM 961 N GLN 120 19.297 -8.612 -0.114 1.00 0.00 ATOM 962 CA GLN 120 19.640 -8.671 1.305 1.00 0.00 ATOM 963 CB GLN 120 20.841 -9.583 1.569 1.00 0.00 ATOM 964 CG GLN 120 20.586 -11.050 1.268 1.00 0.00 ATOM 965 CD GLN 120 21.805 -11.914 1.515 1.00 0.00 ATOM 966 OE1 GLN 120 22.850 -11.424 1.942 1.00 0.00 ATOM 967 NE2 GLN 120 21.675 -13.210 1.247 1.00 0.00 ATOM 968 O GLN 120 20.661 -6.516 1.031 1.00 0.00 ATOM 969 C GLN 120 19.993 -7.257 1.752 1.00 0.00 ATOM 970 N SER 121 19.470 -6.833 2.913 1.00 0.00 ATOM 971 CA SER 121 19.739 -5.490 3.435 1.00 0.00 ATOM 972 CB SER 121 19.186 -5.345 4.854 1.00 0.00 ATOM 973 OG SER 121 19.883 -6.181 5.761 1.00 0.00 ATOM 974 O SER 121 22.073 -5.948 3.717 1.00 0.00 ATOM 975 C SER 121 21.212 -5.109 3.498 1.00 0.00 ATOM 976 N ALA 122 21.504 -3.860 3.286 1.00 0.00 ATOM 977 CA ALA 122 22.825 -3.285 3.381 1.00 0.00 ATOM 978 CB ALA 122 23.473 -3.259 2.006 1.00 0.00 ATOM 979 O ALA 122 21.694 -1.209 3.790 1.00 0.00 ATOM 980 C ALA 122 22.728 -1.872 3.929 1.00 0.00 ATOM 981 N PRO 123 23.799 -1.421 4.572 1.00 0.00 ATOM 982 CA PRO 123 23.829 -0.087 5.146 1.00 0.00 ATOM 983 CB PRO 123 25.181 -0.028 5.873 1.00 0.00 ATOM 984 CG PRO 123 25.552 -1.515 6.107 1.00 0.00 ATOM 985 CD PRO 123 25.047 -2.183 4.851 1.00 0.00 ATOM 986 O PRO 123 23.989 0.798 2.921 1.00 0.00 ATOM 987 C PRO 123 23.567 0.955 4.068 1.00 0.00 ATOM 988 N PHE 124 22.847 2.007 4.432 1.00 0.00 ATOM 989 CA PHE 124 22.529 3.063 3.485 1.00 0.00 ATOM 990 CB PHE 124 21.395 3.968 4.119 1.00 0.00 ATOM 991 CG PHE 124 20.459 4.579 3.132 1.00 0.00 ATOM 992 CD1 PHE 124 19.382 3.818 2.645 1.00 0.00 ATOM 993 CD2 PHE 124 20.637 5.908 2.692 1.00 0.00 ATOM 994 CE1 PHE 124 18.510 4.356 1.697 1.00 0.00 ATOM 995 CE2 PHE 124 19.741 6.457 1.760 1.00 0.00 ATOM 996 CZ PHE 124 18.689 5.681 1.256 1.00 0.00 ATOM 997 O PHE 124 24.746 3.906 3.829 1.00 0.00 ATOM 998 C PHE 124 23.836 3.696 3.027 1.00 0.00 ATOM 999 N GLY 125 23.992 3.933 1.731 1.00 0.00 ATOM 1000 CA GLY 125 25.225 4.549 1.228 1.00 0.00 ATOM 1001 O GLY 125 24.496 6.623 2.182 1.00 0.00 ATOM 1002 C GLY 125 25.450 5.895 1.910 1.00 0.00 ATOM 1003 N HIS 126 26.706 6.219 2.202 1.00 0.00 ATOM 1004 CA HIS 126 27.012 7.483 2.854 1.00 0.00 ATOM 1005 CB HIS 126 28.437 7.609 3.222 1.00 0.00 ATOM 1006 CG HIS 126 29.000 6.364 3.827 1.00 0.00 ATOM 1007 CD2 HIS 126 29.422 6.098 5.084 1.00 0.00 ATOM 1008 ND1 HIS 126 29.214 5.214 3.098 1.00 0.00 ATOM 1009 CE1 HIS 126 29.749 4.295 3.880 1.00 0.00 ATOM 1010 NE2 HIS 126 29.886 4.807 5.092 1.00 0.00 ATOM 1011 O HIS 126 26.310 9.747 2.474 1.00 0.00 ATOM 1012 C HIS 126 26.682 8.684 1.974 1.00 0.00 ATOM 1013 N THR 127 26.834 8.517 0.663 1.00 0.00 ATOM 1014 CA THR 127 26.549 9.592 -0.280 1.00 0.00 ATOM 1015 CB THR 127 26.850 9.167 -1.728 1.00 0.00 ATOM 1016 CG2 THR 127 26.477 10.278 -2.698 1.00 0.00 ATOM 1017 OG1 THR 127 28.250 8.883 -1.866 1.00 0.00 ATOM 1018 O THR 127 24.737 11.138 -0.014 1.00 0.00 ATOM 1019 C THR 127 25.081 9.962 -0.109 1.00 0.00 ATOM 1020 N THR 128 24.215 8.953 -0.022 1.00 0.00 ATOM 1021 CA THR 128 22.790 9.193 0.144 1.00 0.00 ATOM 1022 CB THR 128 22.003 7.876 0.010 1.00 0.00 ATOM 1023 CG2 THR 128 20.508 8.136 0.115 1.00 0.00 ATOM 1024 OG1 THR 128 22.279 7.278 -1.264 1.00 0.00 ATOM 1025 O THR 128 21.634 10.751 1.558 1.00 0.00 ATOM 1026 C THR 128 22.450 9.828 1.486 1.00 0.00 ATOM 1027 N VAL 129 23.073 9.323 2.548 1.00 0.00 ATOM 1028 CA VAL 129 22.851 9.856 3.885 1.00 0.00 ATOM 1029 CB VAL 129 23.624 9.031 4.946 1.00 0.00 ATOM 1030 CG1 VAL 129 23.430 9.631 6.330 1.00 0.00 ATOM 1031 CG2 VAL 129 23.135 7.574 4.942 1.00 0.00 ATOM 1032 O VAL 129 22.582 12.179 4.431 1.00 0.00 ATOM 1033 C VAL 129 23.295 11.318 3.912 1.00 0.00 ATOM 1034 N CYS 130 24.435 11.594 3.304 1.00 0.00 ATOM 1035 CA CYS 130 24.935 12.964 3.245 1.00 0.00 ATOM 1036 CB CYS 130 26.343 12.974 2.640 1.00 0.00 ATOM 1037 SG CYS 130 27.592 12.261 3.750 1.00 0.00 ATOM 1038 O CYS 130 23.826 15.025 2.736 1.00 0.00 ATOM 1039 C CYS 130 24.004 13.836 2.432 1.00 0.00 ATOM 1040 N ARG 131 23.339 13.283 1.398 1.00 0.00 ATOM 1041 CA ARG 131 22.417 14.107 0.627 1.00 0.00 ATOM 1042 CB ARG 131 21.947 13.399 -0.590 1.00 0.00 ATOM 1043 CG ARG 131 22.834 13.612 -1.730 1.00 0.00 ATOM 1044 CD ARG 131 22.735 15.046 -2.381 1.00 0.00 ATOM 1045 NE ARG 131 23.620 14.949 -3.505 1.00 0.00 ATOM 1046 CZ ARG 131 24.908 15.157 -3.460 1.00 0.00 ATOM 1047 NH1 ARG 131 25.471 15.665 -2.357 1.00 0.00 ATOM 1048 NH2 ARG 131 25.649 14.891 -4.534 1.00 0.00 ATOM 1049 O ARG 131 20.704 15.643 1.331 1.00 0.00 ATOM 1050 C ARG 131 21.190 14.519 1.448 1.00 0.00 ATOM 1051 N LEU 132 20.679 13.599 2.256 1.00 0.00 ATOM 1052 CA LEU 132 19.512 13.881 3.074 1.00 0.00 ATOM 1053 CB LEU 132 19.133 12.655 3.899 1.00 0.00 ATOM 1054 CG LEU 132 18.788 11.446 3.010 1.00 0.00 ATOM 1055 CD1 LEU 132 18.395 10.245 3.928 1.00 0.00 ATOM 1056 CD2 LEU 132 17.654 11.775 2.041 1.00 0.00 ATOM 1057 O LEU 132 19.106 15.959 4.194 1.00 0.00 ATOM 1058 C LEU 132 19.869 15.009 4.031 1.00 0.00 ATOM 1059 N ASN 133 21.057 14.934 4.615 1.00 0.00 ATOM 1060 CA ASN 133 21.503 15.961 5.545 1.00 0.00 ATOM 1061 CB ASN 133 22.830 15.585 6.166 1.00 0.00 ATOM 1062 CG ASN 133 22.719 14.363 7.053 1.00 0.00 ATOM 1063 ND2 ASN 133 23.842 13.928 7.611 1.00 0.00 ATOM 1064 OD1 ASN 133 21.631 13.815 7.238 1.00 0.00 ATOM 1065 O ASN 133 21.227 18.342 5.403 1.00 0.00 ATOM 1066 C ASN 133 21.609 17.314 4.846 1.00 0.00 ATOM 1067 N HIS 134 22.122 17.299 3.614 1.00 0.00 ATOM 1068 CA HIS 134 22.270 18.527 2.857 1.00 0.00 ATOM 1069 CB HIS 134 22.951 18.365 1.545 1.00 0.00 ATOM 1070 CG HIS 134 24.442 18.424 1.671 1.00 0.00 ATOM 1071 CD2 HIS 134 25.321 19.413 1.381 1.00 0.00 ATOM 1072 ND1 HIS 134 25.187 17.396 2.211 1.00 0.00 ATOM 1073 CE1 HIS 134 26.458 17.750 2.247 1.00 0.00 ATOM 1074 NE2 HIS 134 26.568 18.969 1.751 1.00 0.00 ATOM 1075 O HIS 134 20.705 20.325 2.673 1.00 0.00 ATOM 1076 C HIS 134 20.903 19.122 2.524 1.00 0.00 ATOM 1077 N LEU 135 19.968 18.291 2.063 1.00 0.00 ATOM 1078 CA LEU 135 18.612 18.745 1.734 1.00 0.00 ATOM 1079 CB LEU 135 17.842 17.605 1.061 1.00 0.00 ATOM 1080 CG LEU 135 16.378 17.852 0.683 1.00 0.00 ATOM 1081 CD1 LEU 135 16.290 19.025 -0.270 1.00 0.00 ATOM 1082 CD2 LEU 135 15.794 16.600 0.041 1.00 0.00 ATOM 1083 O LEU 135 17.245 20.336 2.884 1.00 0.00 ATOM 1084 C LEU 135 17.913 19.317 2.963 1.00 0.00 ATOM 1085 N VAL 136 18.108 18.684 4.112 1.00 0.00 ATOM 1086 CA VAL 136 17.506 19.180 5.353 1.00 0.00 ATOM 1087 CB VAL 136 17.747 18.135 6.446 1.00 0.00 ATOM 1088 CG1 VAL 136 17.325 18.694 7.777 1.00 0.00 ATOM 1089 CG2 VAL 136 16.968 16.846 6.112 1.00 0.00 ATOM 1090 O VAL 136 17.373 21.442 6.133 1.00 0.00 ATOM 1091 C VAL 136 18.096 20.535 5.729 1.00 0.00 ATOM 1092 N GLU 137 19.399 20.676 5.589 1.00 0.00 ATOM 1093 CA GLU 137 20.052 21.939 5.902 1.00 0.00 ATOM 1094 CB GLU 137 21.567 21.802 5.720 1.00 0.00 ATOM 1095 CG GLU 137 22.213 20.892 6.757 1.00 0.00 ATOM 1096 CD GLU 137 23.701 20.737 6.537 1.00 0.00 ATOM 1097 OE1 GLU 137 24.441 21.728 6.700 1.00 0.00 ATOM 1098 OE2 GLU 137 24.126 19.617 6.188 1.00 0.00 ATOM 1099 O GLU 137 19.171 24.129 5.476 1.00 0.00 ATOM 1100 C GLU 137 19.495 23.041 5.006 1.00 0.00 ATOM 1101 N GLN 138 19.278 22.713 3.737 1.00 0.00 ATOM 1102 CA GLN 138 18.747 23.679 2.780 1.00 0.00 ATOM 1103 CB GLN 138 18.755 23.051 1.354 1.00 0.00 ATOM 1104 CG GLN 138 18.185 23.979 0.292 1.00 0.00 ATOM 1105 CD GLN 138 18.303 23.428 -1.114 1.00 0.00 ATOM 1106 OE1 GLN 138 18.436 24.184 -2.077 1.00 0.00 ATOM 1107 NE2 GLN 138 18.239 22.107 -1.247 1.00 0.00 ATOM 1108 O GLN 138 16.955 25.259 3.062 1.00 0.00 ATOM 1109 C GLN 138 17.296 24.075 3.071 1.00 0.00 ATOM 1110 N GLN 139 16.477 23.053 3.365 1.00 0.00 ATOM 1111 CA GLN 139 15.061 23.342 3.652 1.00 0.00 ATOM 1112 CB GLN 139 14.247 22.050 3.787 1.00 0.00 ATOM 1113 CG GLN 139 12.736 22.350 3.893 1.00 0.00 ATOM 1114 CD GLN 139 12.181 23.288 2.854 1.00 0.00 ATOM 1115 OE1 GLN 139 12.286 23.063 1.635 1.00 0.00 ATOM 1116 NE2 GLN 139 11.516 24.388 3.280 1.00 0.00 ATOM 1117 O GLN 139 13.879 24.926 5.064 1.00 0.00 ATOM 1118 C GLN 139 14.852 24.165 4.931 1.00 0.00 ATOM 1119 N GLU 140 15.678 23.924 5.926 1.00 0.00 ATOM 1120 CA GLU 140 15.692 24.811 7.107 1.00 0.00 ATOM 1121 CB GLU 140 16.702 24.221 8.100 1.00 0.00 ATOM 1122 CG GLU 140 16.647 25.098 9.401 1.00 0.00 ATOM 1123 CD GLU 140 17.789 24.735 10.318 1.00 0.00 ATOM 1124 OE1 GLU 140 18.957 24.808 9.930 1.00 0.00 ATOM 1125 OE2 GLU 140 17.553 24.398 11.506 1.00 0.00 ATOM 1126 O GLU 140 15.239 27.181 7.071 1.00 0.00 ATOM 1127 C GLU 140 15.966 26.268 6.705 1.00 0.00 ATOM 1128 N GLY 141 17.044 26.494 6.011 1.00 0.00 ATOM 1129 CA GLY 141 17.368 27.837 5.623 1.00 0.00 ATOM 1130 O GLY 141 16.128 29.676 4.775 1.00 0.00 ATOM 1131 C GLY 141 16.293 28.451 4.761 1.00 0.00 ATOM 1132 N ALA 142 15.584 27.630 3.983 1.00 0.00 ATOM 1133 CA ALA 142 14.635 28.217 3.023 1.00 0.00 ATOM 1134 CB ALA 142 14.513 27.336 1.823 1.00 0.00 ATOM 1135 O ALA 142 12.952 27.261 4.443 1.00 0.00 ATOM 1136 C ALA 142 13.285 28.201 3.733 1.00 0.00 ATOM 1137 N GLN 143 12.490 29.224 3.458 1.00 0.00 ATOM 1138 CA GLN 143 11.158 29.388 4.036 1.00 0.00 ATOM 1139 CB GLN 143 11.027 30.608 4.891 1.00 0.00 ATOM 1140 CG GLN 143 11.913 30.645 6.107 1.00 0.00 ATOM 1141 CD GLN 143 11.806 31.979 6.809 1.00 0.00 ATOM 1142 OE1 GLN 143 10.760 32.637 6.771 1.00 0.00 ATOM 1143 NE2 GLN 143 12.881 32.393 7.452 1.00 0.00 ATOM 1144 O GLN 143 10.287 30.218 1.966 1.00 0.00 ATOM 1145 C GLN 143 10.156 29.408 2.892 1.00 0.00 ATOM 1146 N ALA 144 9.216 28.412 2.903 1.00 0.00 ATOM 1147 CA ALA 144 8.189 28.379 1.874 1.00 0.00 ATOM 1148 CB ALA 144 8.439 27.224 0.881 1.00 0.00 ATOM 1149 O ALA 144 6.708 27.643 3.599 1.00 0.00 ATOM 1150 C ALA 144 6.816 28.174 2.502 1.00 0.00 ATOM 1151 N PRO 145 5.773 28.665 1.851 1.00 0.00 ATOM 1152 CA PRO 145 4.423 28.508 2.393 1.00 0.00 ATOM 1153 CB PRO 145 3.542 29.162 1.326 1.00 0.00 ATOM 1154 CG PRO 145 4.357 29.053 0.080 1.00 0.00 ATOM 1155 CD PRO 145 5.746 29.374 0.564 1.00 0.00 ATOM 1156 O PRO 145 3.463 26.669 3.567 1.00 0.00 ATOM 1157 C PRO 145 4.145 27.004 2.590 1.00 0.00 ATOM 1158 N GLN 146 4.715 26.126 1.732 1.00 0.00 ATOM 1159 CA GLN 146 4.563 24.697 1.948 1.00 0.00 ATOM 1160 CB GLN 146 5.077 23.929 0.762 1.00 0.00 ATOM 1161 CG GLN 146 4.356 24.393 -0.500 1.00 0.00 ATOM 1162 CD GLN 146 5.036 23.945 -1.765 1.00 0.00 ATOM 1163 OE1 GLN 146 6.263 23.848 -1.816 1.00 0.00 ATOM 1164 NE2 GLN 146 4.250 23.714 -2.814 1.00 0.00 ATOM 1165 O GLN 146 4.752 23.488 4.033 1.00 0.00 ATOM 1166 C GLN 146 5.272 24.250 3.239 1.00 0.00 ATOM 1167 N TYR 147 6.475 24.809 3.437 1.00 0.00 ATOM 1168 CA TYR 147 7.249 24.531 4.668 1.00 0.00 ATOM 1169 CB TYR 147 8.690 25.190 4.379 1.00 0.00 ATOM 1170 CG TYR 147 9.477 25.406 5.633 1.00 0.00 ATOM 1171 CD1 TYR 147 10.243 24.403 6.220 1.00 0.00 ATOM 1172 CD2 TYR 147 9.474 26.640 6.283 1.00 0.00 ATOM 1173 CE1 TYR 147 10.963 24.635 7.381 1.00 0.00 ATOM 1174 CE2 TYR 147 10.157 26.855 7.441 1.00 0.00 ATOM 1175 CZ TYR 147 10.917 25.828 7.992 1.00 0.00 ATOM 1176 OH TYR 147 11.575 26.094 9.171 1.00 0.00 ATOM 1177 O TYR 147 6.546 24.338 6.931 1.00 0.00 ATOM 1178 C TYR 147 6.539 25.031 5.920 1.00 0.00 ATOM 1179 N MET 148 5.883 26.178 5.854 1.00 0.00 ATOM 1180 CA MET 148 5.156 26.692 7.002 1.00 0.00 ATOM 1181 CB MET 148 4.651 28.110 6.724 1.00 0.00 ATOM 1182 CG MET 148 3.967 28.768 7.912 1.00 0.00 ATOM 1183 SD MET 148 5.074 28.991 9.318 1.00 0.00 ATOM 1184 CE MET 148 6.119 30.317 8.718 1.00 0.00 ATOM 1185 O MET 148 3.751 25.441 8.486 1.00 0.00 ATOM 1186 C MET 148 3.979 25.762 7.318 1.00 0.00 ATOM 1187 N GLY 149 3.248 25.322 6.299 1.00 0.00 ATOM 1188 CA GLY 149 2.130 24.430 6.498 1.00 0.00 ATOM 1189 O GLY 149 1.903 22.637 8.061 1.00 0.00 ATOM 1190 C GLY 149 2.536 23.107 7.125 1.00 0.00 ATOM 1191 N ARG 150 3.577 22.494 6.582 1.00 0.00 ATOM 1192 CA ARG 150 4.061 21.246 7.170 1.00 0.00 ATOM 1193 CB ARG 150 5.107 20.553 6.301 1.00 0.00 ATOM 1194 CG ARG 150 5.537 19.189 6.867 1.00 0.00 ATOM 1195 CD ARG 150 6.722 18.628 6.153 1.00 0.00 ATOM 1196 NE ARG 150 7.863 19.518 6.024 1.00 0.00 ATOM 1197 CZ ARG 150 8.769 19.962 6.847 1.00 0.00 ATOM 1198 NH1 ARG 150 8.847 19.527 8.118 1.00 0.00 ATOM 1199 NH2 ARG 150 9.709 20.872 6.517 1.00 0.00 ATOM 1200 O ARG 150 4.202 20.615 9.514 1.00 0.00 ATOM 1201 C ARG 150 4.522 21.427 8.636 1.00 0.00 ATOM 1202 N THR 151 5.255 22.496 8.890 1.00 0.00 ATOM 1203 CA THR 151 5.698 22.789 10.261 1.00 0.00 ATOM 1204 CB THR 151 6.675 23.971 10.227 1.00 0.00 ATOM 1205 CG2 THR 151 7.152 24.340 11.628 1.00 0.00 ATOM 1206 OG1 THR 151 7.869 23.552 9.558 1.00 0.00 ATOM 1207 O THR 151 4.524 22.522 12.351 1.00 0.00 ATOM 1208 C THR 151 4.533 23.028 11.224 1.00 0.00 ATOM 1209 N ILE 152 3.555 23.832 10.789 1.00 0.00 ATOM 1210 CA ILE 152 2.384 24.116 11.611 1.00 0.00 ATOM 1211 CB ILE 152 1.423 25.104 10.888 1.00 0.00 ATOM 1212 CG1 ILE 152 2.021 26.516 10.855 1.00 0.00 ATOM 1213 CG2 ILE 152 0.038 25.116 11.556 1.00 0.00 ATOM 1214 CD1 ILE 152 1.349 27.445 9.843 1.00 0.00 ATOM 1215 O ILE 152 1.341 22.559 13.076 1.00 0.00 ATOM 1216 C ILE 152 1.656 22.811 11.898 1.00 0.00 ATOM 1217 N LYS 153 1.396 21.896 10.911 1.00 0.00 ATOM 1218 CA LYS 153 0.715 20.639 11.182 1.00 0.00 ATOM 1219 CB LYS 153 -0.794 20.883 11.032 1.00 0.00 ATOM 1220 CG LYS 153 -1.715 19.721 11.375 1.00 0.00 ATOM 1221 CD LYS 153 -3.161 20.092 11.045 1.00 0.00 ATOM 1222 CE LYS 153 -4.143 18.959 11.316 1.00 0.00 ATOM 1223 NZ LYS 153 -4.241 18.613 12.755 1.00 0.00 ATOM 1224 O LYS 153 1.205 19.781 9.007 1.00 0.00 ATOM 1225 C LYS 153 1.146 19.557 10.214 1.00 0.00 ATOM 1226 N LEU 154 1.426 18.372 10.745 1.00 0.00 ATOM 1227 CA LEU 154 1.829 17.240 9.922 1.00 0.00 ATOM 1228 CB LEU 154 2.017 15.992 10.794 1.00 0.00 ATOM 1229 CG LEU 154 3.272 15.881 11.655 1.00 0.00 ATOM 1230 CD1 LEU 154 3.205 14.619 12.521 1.00 0.00 ATOM 1231 CD2 LEU 154 4.491 15.854 10.750 1.00 0.00 ATOM 1232 O LEU 154 -0.442 16.915 9.232 1.00 0.00 ATOM 1233 C LEU 154 0.748 16.941 8.897 1.00 0.00 ATOM 1234 N PRO 155 1.133 16.775 7.621 1.00 0.00 ATOM 1235 CA PRO 155 0.112 16.471 6.616 1.00 0.00 ATOM 1236 CB PRO 155 0.933 16.346 5.335 1.00 0.00 ATOM 1237 CG PRO 155 2.059 17.306 5.568 1.00 0.00 ATOM 1238 CD PRO 155 2.445 16.993 6.987 1.00 0.00 ATOM 1239 O PRO 155 0.177 14.230 7.472 1.00 0.00 ATOM 1240 C PRO 155 -0.513 15.127 7.003 1.00 0.00 ATOM 1241 N ALA 156 -1.838 15.017 6.840 1.00 0.00 ATOM 1242 CA ALA 156 -2.503 13.777 7.211 1.00 0.00 ATOM 1243 CB ALA 156 -4.009 13.956 7.226 1.00 0.00 ATOM 1244 O ALA 156 -1.983 11.471 6.801 1.00 0.00 ATOM 1245 C ALA 156 -2.007 12.618 6.354 1.00 0.00 TER END