PFRMAT TS TARGET T0366 OLIGOMER 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 For T0366, we used only one monomer (try3-opt2) as the basis for our METHOD dimer submissions, but we superimposed on two different dimers of PDZ domains: METHOD 1tp5 and 1g9o. The superpositions were then optimized by undertaker. METHOD For 1g9o dimers, we had to use ProteinShop to modify the termini of METHOD the monomer, to avoid bad clashes in the dimerization interface. METHOD METHOD The 1tp5 dimers scored better with the undertaker costfcns and with METHOD rosetta's cost function, when rosetta was used to repack sidechains. METHOD METHOD METHOD METHOD Dimer 1 is try2-opt2, our best-scoring with undertaker cost functions, METHOD based on 1tp5. METHOD METHOD Dimer 2 is try1-opt2.unpack.gromacs0.repack-nonPC, rosetta's favorite METHOD of the dimers it repacked sidechains for. It is also based on METHOD 1tp5, but the undertaker-optimized model (try1-opt2) was METHOD reoptimized by gromacs and had sidechains repacked by rosetta. METHOD METHOD Dimer 3 is try5-opt2, our best scoring dimer based on the 1g9o superposition. METHOD We deliberately attempted to introduce some hydrogen bonds METHOD between the monomers at L36.O and D38.N. METHOD METHOD Dimer 4 is is try3-opt2.unpack.gromacs0.repack-nonPC, the 1g9o-based METHOD dimer that rosetta liked best. METHOD METHOD Dimer 5 is try4-opt2, the remaining 1g9o-based dimer, included only METHOD because it is slightly different from either try3-opt2 or try5-opt2. METHOD REMARK 6 REMARK 6 T0366 model 1 Sat Jul 29 16:35:20 2006 MODEL 5 PARENT 2fne_A 2fe5_A 1tp5_A 1g9o_A 2fcf_A REMARK 7 REMARK 7 ALLPARENTS 2fne_A 2fe5_A 1tp5_A 1g9o_A 2fcf_A 1qav_A 2h2b_A REMARK 7 ALLPARENTS 1n7e_A 1q3o_A 1ihj_A 2h3l_A 1mfg_A 1wf7_A 1n7f_A REMARK 7 ALLPARENTS 2f0a_A 1kwa_A 1nf3_C 1qau_A 2f5y_A 1r6j_A 1be9_A REMARK 7 ALLPARENTS 1l6o_A ATOM 1 N THR A 1 14.673 4.664 4.654 1.00 0.00 ATOM 2 CA THR A 1 14.646 6.052 5.193 1.00 0.00 ATOM 3 CB THR A 1 16.068 6.528 5.560 1.00 0.00 ATOM 4 CG2 THR A 1 16.015 7.861 6.295 1.00 0.00 ATOM 5 OG1 THR A 1 16.690 5.555 6.409 1.00 0.00 ATOM 6 O THR A 1 12.851 6.991 3.906 1.00 0.00 ATOM 7 C THR A 1 14.058 6.997 4.159 1.00 0.00 ATOM 8 N GLU A 2 14.894 7.856 3.575 1.00 0.00 ATOM 9 CA GLU A 2 14.437 8.820 2.582 1.00 0.00 ATOM 10 CB GLU A 2 15.574 9.745 2.149 1.00 0.00 ATOM 11 CG GLU A 2 15.962 10.759 3.208 1.00 0.00 ATOM 12 CD GLU A 2 17.105 11.656 2.776 1.00 0.00 ATOM 13 OE1 GLU A 2 17.456 11.650 1.576 1.00 0.00 ATOM 14 OE2 GLU A 2 17.646 12.379 3.639 1.00 0.00 ATOM 15 O GLU A 2 12.884 8.538 0.782 1.00 0.00 ATOM 16 C GLU A 2 13.907 8.128 1.331 1.00 0.00 ATOM 17 N ASN A 3 14.598 7.089 0.874 1.00 0.00 ATOM 18 CA ASN A 3 14.136 6.350 -0.298 1.00 0.00 ATOM 19 CB ASN A 3 15.162 5.292 -0.711 1.00 0.00 ATOM 20 CG ASN A 3 16.368 5.893 -1.394 1.00 0.00 ATOM 21 ND2 ASN A 3 17.435 5.107 -1.536 1.00 0.00 ATOM 22 OD1 ASN A 3 16.335 7.048 -1.805 1.00 0.00 ATOM 23 O ASN A 3 11.891 5.694 -0.875 1.00 0.00 ATOM 24 C ASN A 3 12.798 5.659 -0.038 1.00 0.00 ATOM 25 N LEU A 4 12.652 5.069 1.141 1.00 0.00 ATOM 26 CA LEU A 4 11.419 4.365 1.451 1.00 0.00 ATOM 27 CB LEU A 4 11.569 3.497 2.702 1.00 0.00 ATOM 28 CG LEU A 4 12.696 2.461 2.561 1.00 0.00 ATOM 29 CD1 LEU A 4 12.600 1.425 3.657 1.00 0.00 ATOM 30 CD2 LEU A 4 12.661 1.873 1.157 1.00 0.00 ATOM 31 O LEU A 4 9.100 4.923 1.352 1.00 0.00 ATOM 32 C LEU A 4 10.235 5.316 1.595 1.00 0.00 ATOM 33 N TYR A 5 10.494 6.580 1.951 1.00 0.00 ATOM 34 CA TYR A 5 9.414 7.532 2.104 1.00 0.00 ATOM 35 CB TYR A 5 9.597 8.202 3.598 1.00 0.00 ATOM 36 CG TYR A 5 8.367 8.745 4.248 1.00 0.00 ATOM 37 CD1 TYR A 5 7.562 7.924 5.019 1.00 0.00 ATOM 38 CD2 TYR A 5 7.972 10.060 4.055 1.00 0.00 ATOM 39 CE1 TYR A 5 6.412 8.402 5.609 1.00 0.00 ATOM 40 CE2 TYR A 5 6.815 10.546 4.644 1.00 0.00 ATOM 41 CZ TYR A 5 6.047 9.713 5.407 1.00 0.00 ATOM 42 OH TYR A 5 4.906 10.204 5.979 1.00 0.00 ATOM 43 O TYR A 5 8.944 9.545 0.853 1.00 0.00 ATOM 44 C TYR A 5 9.771 8.903 1.532 1.00 0.00 ATOM 45 N PHE A 6 11.009 9.648 1.796 1.00 0.00 ATOM 46 CA PHE A 6 11.345 10.962 1.272 1.00 0.00 ATOM 47 CB PHE A 6 12.652 11.470 1.850 1.00 0.00 ATOM 48 CG PHE A 6 12.586 11.737 3.322 1.00 0.00 ATOM 49 CD1 PHE A 6 11.907 12.852 3.813 1.00 0.00 ATOM 50 CD2 PHE A 6 13.172 10.857 4.222 1.00 0.00 ATOM 51 CE1 PHE A 6 11.812 13.084 5.182 1.00 0.00 ATOM 52 CE2 PHE A 6 13.081 11.081 5.595 1.00 0.00 ATOM 53 CZ PHE A 6 12.400 12.196 6.072 1.00 0.00 ATOM 54 O PHE A 6 10.885 11.965 -0.834 1.00 0.00 ATOM 55 C PHE A 6 10.412 11.319 0.097 1.00 0.00 ATOM 56 N GLN A 7 9.131 10.968 0.175 1.00 0.00 ATOM 57 CA GLN A 7 8.185 11.390 -0.851 1.00 0.00 ATOM 58 CB GLN A 7 8.113 10.339 -1.918 1.00 0.00 ATOM 59 CG GLN A 7 9.298 10.515 -2.873 1.00 0.00 ATOM 60 CD GLN A 7 9.484 11.971 -3.328 1.00 0.00 ATOM 61 OE1 GLN A 7 10.579 12.527 -3.236 1.00 0.00 ATOM 62 NE2 GLN A 7 8.414 12.585 -3.824 1.00 0.00 ATOM 63 O GLN A 7 6.066 10.700 0.117 1.00 0.00 ATOM 64 C GLN A 7 6.783 11.621 -0.286 1.00 0.00 ATOM 65 N SER A 8 6.293 12.937 -0.172 1.00 0.00 ATOM 66 CA SER A 8 4.962 13.225 0.391 1.00 0.00 ATOM 67 CB SER A 8 5.084 13.979 1.709 1.00 0.00 ATOM 68 OG SER A 8 3.799 14.420 2.127 1.00 0.00 ATOM 69 O SER A 8 4.750 15.121 -1.055 1.00 0.00 ATOM 70 C SER A 8 4.186 14.174 -0.516 1.00 0.00 ATOM 71 N MET A 9 2.933 13.795 -0.808 1.00 0.00 ATOM 72 CA MET A 9 2.046 14.580 -1.685 1.00 0.00 ATOM 73 CB MET A 9 1.427 13.699 -2.772 1.00 0.00 ATOM 74 CG MET A 9 2.434 13.127 -3.757 1.00 0.00 ATOM 75 SD MET A 9 3.284 14.403 -4.706 1.00 0.00 ATOM 76 CE MET A 9 1.966 14.953 -5.787 1.00 0.00 ATOM 77 O MET A 9 0.638 14.811 0.246 1.00 0.00 ATOM 78 C MET A 9 0.886 15.190 -0.902 1.00 0.00 ATOM 79 N GLY A 10 0.197 16.132 -1.513 1.00 0.00 ATOM 80 CA GLY A 10 -0.870 16.865 -0.831 1.00 0.00 ATOM 81 O GLY A 10 -2.366 15.166 -1.623 1.00 0.00 ATOM 82 C GLY A 10 -2.210 16.150 -0.902 1.00 0.00 ATOM 83 N LEU A 11 -3.182 16.655 -0.140 1.00 0.00 ATOM 84 CA LEU A 11 -4.505 16.069 -0.110 1.00 0.00 ATOM 85 CB LEU A 11 -5.367 16.746 0.957 1.00 0.00 ATOM 86 CG LEU A 11 -4.938 16.535 2.410 1.00 0.00 ATOM 87 CD1 LEU A 11 -5.799 17.364 3.352 1.00 0.00 ATOM 88 CD2 LEU A 11 -5.074 15.072 2.804 1.00 0.00 ATOM 89 O LEU A 11 -4.916 17.350 -2.096 1.00 0.00 ATOM 90 C LEU A 11 -5.086 16.281 -1.501 1.00 0.00 ATOM 91 N ARG A 12 -5.718 15.265 -2.044 1.00 0.00 ATOM 92 CA ARG A 12 -6.319 15.335 -3.370 1.00 0.00 ATOM 93 CB ARG A 12 -5.432 14.495 -4.402 1.00 0.00 ATOM 94 CG ARG A 12 -4.054 15.209 -4.448 1.00 0.00 ATOM 95 CD ARG A 12 -3.072 14.618 -5.474 1.00 0.00 ATOM 96 NE ARG A 12 -2.763 13.207 -5.123 1.00 0.00 ATOM 97 CZ ARG A 12 -2.466 12.306 -6.028 1.00 0.00 ATOM 98 NH1 ARG A 12 -2.345 12.632 -7.280 1.00 0.00 ATOM 99 NH2 ARG A 12 -2.298 11.074 -5.661 1.00 0.00 ATOM 100 O ARG A 12 -8.176 14.043 -2.554 1.00 0.00 ATOM 101 C ARG A 12 -7.773 14.878 -3.369 1.00 0.00 ATOM 102 N THR A 13 -8.560 15.432 -4.284 1.00 0.00 ATOM 103 CA THR A 13 -9.971 15.087 -4.382 1.00 0.00 ATOM 104 CB THR A 13 -10.853 16.349 -4.338 1.00 0.00 ATOM 105 CG2 THR A 13 -12.324 15.974 -4.439 1.00 0.00 ATOM 106 OG1 THR A 13 -10.635 17.044 -3.105 1.00 0.00 ATOM 107 O THR A 13 -9.877 14.875 -6.771 1.00 0.00 ATOM 108 C THR A 13 -10.198 14.358 -5.706 1.00 0.00 ATOM 109 N VAL A 14 -10.785 13.170 -5.631 1.00 0.00 ATOM 110 CA VAL A 14 -11.055 12.381 -6.826 1.00 0.00 ATOM 111 CB VAL A 14 -10.100 11.175 -6.915 1.00 0.00 ATOM 112 CG1 VAL A 14 -10.393 10.354 -8.161 1.00 0.00 ATOM 113 CG2 VAL A 14 -8.655 11.643 -6.978 1.00 0.00 ATOM 114 O VAL A 14 -12.924 11.257 -5.841 1.00 0.00 ATOM 115 C VAL A 14 -12.476 11.843 -6.826 1.00 0.00 ATOM 116 N GLU A 15 -13.186 12.044 -7.929 1.00 0.00 ATOM 117 CA GLU A 15 -14.546 11.543 -8.036 1.00 0.00 ATOM 118 CB GLU A 15 -15.438 12.562 -8.749 1.00 0.00 ATOM 119 CG GLU A 15 -16.881 12.117 -8.914 1.00 0.00 ATOM 120 CD GLU A 15 -17.730 13.144 -9.637 1.00 0.00 ATOM 121 OE1 GLU A 15 -17.186 14.206 -10.011 1.00 0.00 ATOM 122 OE2 GLU A 15 -18.937 12.889 -9.828 1.00 0.00 ATOM 123 O GLU A 15 -13.935 10.149 -9.894 1.00 0.00 ATOM 124 C GLU A 15 -14.541 10.239 -8.823 1.00 0.00 ATOM 125 N MET A 16 -15.067 9.190 -8.201 1.00 0.00 ATOM 126 CA MET A 16 -15.132 7.875 -8.823 1.00 0.00 ATOM 127 CB MET A 16 -14.658 6.791 -7.852 1.00 0.00 ATOM 128 CG MET A 16 -13.194 6.904 -7.462 1.00 0.00 ATOM 129 SD MET A 16 -12.661 5.578 -6.363 1.00 0.00 ATOM 130 CE MET A 16 -13.353 6.130 -4.807 1.00 0.00 ATOM 131 O MET A 16 -17.496 7.971 -8.478 1.00 0.00 ATOM 132 C MET A 16 -16.578 7.628 -9.221 1.00 0.00 ATOM 133 N LYS A 17 -16.792 7.178 -10.453 1.00 0.00 ATOM 134 CA LYS A 17 -18.143 6.904 -10.920 1.00 0.00 ATOM 135 CB LYS A 17 -18.471 7.721 -12.169 1.00 0.00 ATOM 136 CG LYS A 17 -18.487 9.224 -11.943 1.00 0.00 ATOM 137 CD LYS A 17 -18.857 9.971 -13.216 1.00 0.00 ATOM 138 CE LYS A 17 -18.910 11.471 -12.981 1.00 0.00 ATOM 139 NZ LYS A 17 -19.394 12.206 -14.181 1.00 0.00 ATOM 140 O LYS A 17 -17.642 4.914 -12.206 1.00 0.00 ATOM 141 C LYS A 17 -18.236 5.417 -11.230 1.00 0.00 ATOM 142 N LYS A 18 -18.961 4.712 -10.270 1.00 0.00 ATOM 143 CA LYS A 18 -19.080 3.272 -10.384 1.00 0.00 ATOM 144 CB LYS A 18 -18.610 2.533 -9.128 1.00 0.00 ATOM 145 CG LYS A 18 -19.339 2.943 -7.858 1.00 0.00 ATOM 146 CD LYS A 18 -18.851 2.145 -6.661 1.00 0.00 ATOM 147 CE LYS A 18 -19.594 2.537 -5.396 1.00 0.00 ATOM 148 NZ LYS A 18 -19.114 1.778 -4.207 1.00 0.00 ATOM 149 O LYS A 18 -21.463 3.270 -10.002 1.00 0.00 ATOM 150 C LYS A 18 -20.488 2.732 -10.540 1.00 0.00 ATOM 151 N GLY A 19 -20.611 1.660 -11.352 1.00 0.00 ATOM 152 CA GLY A 19 -21.855 0.964 -11.569 1.00 0.00 ATOM 153 O GLY A 19 -20.897 -0.667 -10.097 1.00 0.00 ATOM 154 C GLY A 19 -21.909 -0.287 -10.689 1.00 0.00 ATOM 155 N PRO A 20 -23.075 -0.923 -10.596 1.00 0.00 ATOM 156 CA PRO A 20 -23.213 -2.129 -9.775 1.00 0.00 ATOM 157 CB PRO A 20 -24.688 -2.509 -9.924 1.00 0.00 ATOM 158 CG PRO A 20 -25.385 -1.214 -10.169 1.00 0.00 ATOM 159 CD PRO A 20 -24.483 -0.419 -11.070 1.00 0.00 ATOM 160 O PRO A 20 -21.996 -4.175 -9.502 1.00 0.00 ATOM 161 C PRO A 20 -22.456 -3.328 -10.302 1.00 0.00 ATOM 162 N THR A 21 -22.249 -3.453 -11.591 1.00 0.00 ATOM 163 CA THR A 21 -21.518 -4.594 -12.131 1.00 0.00 ATOM 164 CB THR A 21 -21.676 -4.723 -13.637 1.00 0.00 ATOM 165 CG2 THR A 21 -23.135 -5.010 -13.975 1.00 0.00 ATOM 166 OG1 THR A 21 -21.263 -3.509 -14.281 1.00 0.00 ATOM 167 O THR A 21 -19.335 -5.577 -11.937 1.00 0.00 ATOM 168 C THR A 21 -20.024 -4.563 -11.802 1.00 0.00 ATOM 169 N ASP A 22 -19.447 -3.374 -11.369 1.00 0.00 ATOM 170 CA ASP A 22 -18.026 -3.279 -11.083 1.00 0.00 ATOM 171 CB ASP A 22 -17.274 -2.470 -12.231 1.00 0.00 ATOM 172 CG ASP A 22 -17.620 -1.006 -12.269 1.00 0.00 ATOM 173 OD1 ASP A 22 -18.578 -0.602 -11.546 1.00 0.00 ATOM 174 OD2 ASP A 22 -16.978 -0.197 -13.013 1.00 0.00 ATOM 175 O ASP A 22 -16.442 -3.169 -9.305 1.00 0.00 ATOM 176 C ASP A 22 -17.537 -2.801 -9.730 1.00 0.00 ATOM 177 N SER A 23 -18.325 -1.976 -9.050 1.00 0.00 ATOM 178 CA SER A 23 -17.892 -1.473 -7.759 1.00 0.00 ATOM 179 CB SER A 23 -17.284 -2.647 -6.926 1.00 0.00 ATOM 180 OG SER A 23 -17.206 -2.310 -5.550 1.00 0.00 ATOM 181 O SER A 23 -16.308 -0.118 -8.937 1.00 0.00 ATOM 182 C SER A 23 -16.711 -0.521 -7.840 1.00 0.00 ATOM 183 N LEU A 24 -16.151 -0.169 -6.687 1.00 0.00 ATOM 184 CA LEU A 24 -15.020 0.749 -6.613 1.00 0.00 ATOM 185 CB LEU A 24 -14.657 1.040 -5.154 1.00 0.00 ATOM 186 CG LEU A 24 -15.660 1.884 -4.362 1.00 0.00 ATOM 187 CD1 LEU A 24 -15.269 1.941 -2.893 1.00 0.00 ATOM 188 CD2 LEU A 24 -15.707 3.304 -4.898 1.00 0.00 ATOM 189 O LEU A 24 -13.074 0.924 -8.012 1.00 0.00 ATOM 190 C LEU A 24 -13.784 0.198 -7.315 1.00 0.00 ATOM 191 N GLY A 25 -13.525 -1.091 -7.136 1.00 0.00 ATOM 192 CA GLY A 25 -12.370 -1.704 -7.766 1.00 0.00 ATOM 193 O GLY A 25 -10.008 -1.340 -7.574 1.00 0.00 ATOM 194 C GLY A 25 -11.080 -1.533 -6.988 1.00 0.00 ATOM 195 N ILE A 26 -11.173 -1.608 -5.662 1.00 0.00 ATOM 196 CA ILE A 26 -10.001 -1.474 -4.802 1.00 0.00 ATOM 197 CB ILE A 26 -9.807 -0.012 -4.324 1.00 0.00 ATOM 198 CG1 ILE A 26 -11.038 0.456 -3.541 1.00 0.00 ATOM 199 CG2 ILE A 26 -9.561 0.905 -5.522 1.00 0.00 ATOM 200 CD1 ILE A 26 -10.825 1.780 -2.808 1.00 0.00 ATOM 201 O ILE A 26 -11.137 -2.718 -3.092 1.00 0.00 ATOM 202 C ILE A 26 -10.060 -2.317 -3.531 1.00 0.00 ATOM 203 N SER A 27 -8.894 -2.601 -2.975 1.00 0.00 ATOM 204 CA SER A 27 -8.796 -3.393 -1.751 1.00 0.00 ATOM 205 CB SER A 27 -8.000 -4.632 -1.986 1.00 0.00 ATOM 206 OG SER A 27 -8.774 -5.374 -2.888 1.00 0.00 ATOM 207 O SER A 27 -7.150 -1.818 -1.000 1.00 0.00 ATOM 208 C SER A 27 -8.127 -2.508 -0.705 1.00 0.00 ATOM 209 N ILE A 28 -8.624 -2.511 0.536 1.00 0.00 ATOM 210 CA ILE A 28 -8.052 -1.671 1.575 1.00 0.00 ATOM 211 CB ILE A 28 -9.213 -1.123 2.420 1.00 0.00 ATOM 212 CG1 ILE A 28 -10.049 -0.165 1.564 1.00 0.00 ATOM 213 CG2 ILE A 28 -8.672 -0.443 3.670 1.00 0.00 ATOM 214 CD1 ILE A 28 -9.315 1.086 1.126 1.00 0.00 ATOM 215 O ILE A 28 -7.597 -3.654 2.875 1.00 0.00 ATOM 216 C ILE A 28 -7.336 -2.458 2.667 1.00 0.00 ATOM 217 N ALA A 29 -6.396 -1.789 3.327 1.00 0.00 ATOM 218 CA ALA A 29 -5.763 -2.255 4.555 1.00 0.00 ATOM 219 CB ALA A 29 -4.315 -2.645 4.301 1.00 0.00 ATOM 220 O ALA A 29 -6.193 0.023 5.194 1.00 0.00 ATOM 221 C ALA A 29 -5.832 -1.097 5.562 1.00 0.00 ATOM 222 N GLY A 30 -5.570 -1.404 6.825 1.00 0.00 ATOM 223 CA GLY A 30 -5.513 -0.360 7.892 1.00 0.00 ATOM 224 O GLY A 30 -7.899 -0.668 8.140 1.00 0.00 ATOM 225 C GLY A 30 -6.844 -0.147 8.582 1.00 0.00 ATOM 226 N GLY A 31 -6.831 0.640 9.649 1.00 0.00 ATOM 227 CA GLY A 31 -8.047 0.813 10.418 1.00 0.00 ATOM 228 O GLY A 31 -6.496 0.377 12.183 1.00 0.00 ATOM 229 C GLY A 31 -7.569 0.894 11.850 1.00 0.00 ATOM 230 N VAL A 32 -8.382 1.609 12.679 1.00 0.00 ATOM 231 CA VAL A 32 -8.113 1.613 14.105 1.00 0.00 ATOM 232 CB VAL A 32 -9.146 2.438 14.907 1.00 0.00 ATOM 233 CG1 VAL A 32 -8.827 2.371 16.399 1.00 0.00 ATOM 234 CG2 VAL A 32 -9.126 3.885 14.445 1.00 0.00 ATOM 235 O VAL A 32 -9.104 -0.528 14.559 1.00 0.00 ATOM 236 C VAL A 32 -8.122 0.203 14.701 1.00 0.00 ATOM 237 N GLY A 33 -6.992 -0.182 15.378 1.00 0.00 ATOM 238 CA GLY A 33 -6.905 -1.507 15.973 1.00 0.00 ATOM 239 O GLY A 33 -6.854 -3.790 15.236 1.00 0.00 ATOM 240 C GLY A 33 -6.654 -2.601 14.945 1.00 0.00 ATOM 241 N SER A 34 -6.190 -2.208 13.745 1.00 0.00 ATOM 242 CA SER A 34 -5.853 -3.156 12.649 1.00 0.00 ATOM 243 CB SER A 34 -5.563 -2.394 11.353 1.00 0.00 ATOM 244 OG SER A 34 -4.366 -1.644 11.460 1.00 0.00 ATOM 245 O SER A 34 -3.868 -3.597 13.924 1.00 0.00 ATOM 246 C SER A 34 -4.611 -3.967 13.011 1.00 0.00 ATOM 247 N PRO A 35 -4.379 -5.123 12.337 1.00 0.00 ATOM 248 CA PRO A 35 -3.198 -5.940 12.638 1.00 0.00 ATOM 249 CB PRO A 35 -3.249 -7.013 11.552 1.00 0.00 ATOM 250 CG PRO A 35 -4.721 -7.209 11.367 1.00 0.00 ATOM 251 CD PRO A 35 -5.228 -5.784 11.331 1.00 0.00 ATOM 252 O PRO A 35 -0.954 -5.501 13.227 1.00 0.00 ATOM 253 C PRO A 35 -1.893 -5.152 12.541 1.00 0.00 ATOM 254 N LEU A 36 -1.823 -4.123 11.694 1.00 0.00 ATOM 255 CA LEU A 36 -0.613 -3.311 11.539 1.00 0.00 ATOM 256 CB LEU A 36 -0.579 -2.667 10.150 1.00 0.00 ATOM 257 CG LEU A 36 -0.545 -3.627 8.959 1.00 0.00 ATOM 258 CD1 LEU A 36 -0.618 -2.859 7.647 1.00 0.00 ATOM 259 CD2 LEU A 36 0.741 -4.440 8.963 1.00 0.00 ATOM 260 O LEU A 36 0.590 -1.577 12.670 1.00 0.00 ATOM 261 C LEU A 36 -0.471 -2.187 12.584 1.00 0.00 ATOM 262 N GLY A 37 -1.513 -1.957 13.392 1.00 0.00 ATOM 263 CA GLY A 37 -1.527 -0.853 14.378 1.00 0.00 ATOM 264 O GLY A 37 -3.731 -0.446 13.526 1.00 0.00 ATOM 265 C GLY A 37 -2.773 -0.012 14.175 1.00 0.00 ATOM 266 N ASP A 38 -2.816 1.170 14.730 1.00 0.00 ATOM 267 CA ASP A 38 -3.905 2.126 14.546 1.00 0.00 ATOM 268 CB ASP A 38 -3.938 3.094 15.712 1.00 0.00 ATOM 269 CG ASP A 38 -5.161 4.000 15.639 1.00 0.00 ATOM 270 OD1 ASP A 38 -5.637 4.331 14.522 1.00 0.00 ATOM 271 OD2 ASP A 38 -5.650 4.390 16.711 1.00 0.00 ATOM 272 O ASP A 38 -2.702 3.850 13.358 1.00 0.00 ATOM 273 C ASP A 38 -3.526 2.935 13.292 1.00 0.00 ATOM 274 N VAL A 39 -4.118 2.536 12.204 1.00 0.00 ATOM 275 CA VAL A 39 -3.863 3.182 10.910 1.00 0.00 ATOM 276 CB VAL A 39 -3.094 2.200 9.925 1.00 0.00 ATOM 277 CG1 VAL A 39 -1.810 1.567 10.465 1.00 0.00 ATOM 278 CG2 VAL A 39 -4.037 1.109 9.415 1.00 0.00 ATOM 279 O VAL A 39 -6.195 3.294 10.511 1.00 0.00 ATOM 280 C VAL A 39 -5.092 3.776 10.283 1.00 0.00 ATOM 281 N PRO A 40 -4.900 4.800 9.452 1.00 0.00 ATOM 282 CA PRO A 40 -5.934 5.244 8.542 1.00 0.00 ATOM 283 CB PRO A 40 -5.359 6.387 7.803 1.00 0.00 ATOM 284 CG PRO A 40 -4.485 7.027 8.837 1.00 0.00 ATOM 285 CD PRO A 40 -3.829 5.846 9.499 1.00 0.00 ATOM 286 O PRO A 40 -5.405 3.199 7.344 1.00 0.00 ATOM 287 C PRO A 40 -6.173 4.191 7.455 1.00 0.00 ATOM 288 N ILE A 41 -7.220 4.403 6.679 1.00 0.00 ATOM 289 CA ILE A 41 -7.591 3.449 5.611 1.00 0.00 ATOM 290 CB ILE A 41 -9.105 3.532 5.341 1.00 0.00 ATOM 291 CG1 ILE A 41 -9.888 3.352 6.643 1.00 0.00 ATOM 292 CG2 ILE A 41 -9.532 2.443 4.368 1.00 0.00 ATOM 293 CD1 ILE A 41 -9.630 2.031 7.335 1.00 0.00 ATOM 294 O ILE A 41 -6.763 4.875 3.881 1.00 0.00 ATOM 295 C ILE A 41 -6.767 3.749 4.367 1.00 0.00 ATOM 296 N PHE A 42 -6.027 2.743 3.848 1.00 0.00 ATOM 297 CA PHE A 42 -5.203 2.932 2.668 1.00 0.00 ATOM 298 CB PHE A 42 -3.765 2.490 2.917 1.00 0.00 ATOM 299 CG PHE A 42 -2.986 3.439 3.782 1.00 0.00 ATOM 300 CD1 PHE A 42 -3.185 3.480 5.159 1.00 0.00 ATOM 301 CD2 PHE A 42 -2.024 4.274 3.219 1.00 0.00 ATOM 302 CE1 PHE A 42 -2.431 4.336 5.964 1.00 0.00 ATOM 303 CE2 PHE A 42 -1.267 5.129 4.013 1.00 0.00 ATOM 304 CZ PHE A 42 -1.469 5.161 5.383 1.00 0.00 ATOM 305 O PHE A 42 -5.727 0.793 1.841 1.00 0.00 ATOM 306 C PHE A 42 -5.653 1.989 1.588 1.00 0.00 ATOM 307 N ILE A 43 -5.676 2.482 0.360 1.00 0.00 ATOM 308 CA ILE A 43 -5.797 1.605 -0.803 1.00 0.00 ATOM 309 CB ILE A 43 -6.200 2.443 -2.062 1.00 0.00 ATOM 310 CG1 ILE A 43 -7.564 3.114 -1.852 1.00 0.00 ATOM 311 CG2 ILE A 43 -6.210 1.566 -3.301 1.00 0.00 ATOM 312 CD1 ILE A 43 -7.970 4.080 -2.969 1.00 0.00 ATOM 313 O ILE A 43 -3.420 1.265 -0.909 1.00 0.00 ATOM 314 C ILE A 43 -4.550 0.764 -0.959 1.00 0.00 ATOM 315 N ALA A 44 -4.739 -0.607 -1.097 1.00 0.00 ATOM 316 CA ALA A 44 -3.659 -1.543 -1.195 1.00 0.00 ATOM 317 CB ALA A 44 -3.872 -2.738 -0.277 1.00 0.00 ATOM 318 O ALA A 44 -2.401 -2.176 -3.200 1.00 0.00 ATOM 319 C ALA A 44 -3.507 -2.086 -2.640 1.00 0.00 ATOM 320 N MET A 45 -4.567 -2.384 -3.288 1.00 0.00 ATOM 321 CA MET A 45 -4.504 -2.876 -4.654 1.00 0.00 ATOM 322 CB MET A 45 -4.563 -4.395 -4.667 1.00 0.00 ATOM 323 CG MET A 45 -3.344 -5.074 -4.054 1.00 0.00 ATOM 324 SD MET A 45 -3.602 -6.981 -3.755 1.00 0.00 ATOM 325 CE MET A 45 -4.557 -6.872 -2.062 1.00 0.00 ATOM 326 O MET A 45 -6.736 -2.054 -4.855 1.00 0.00 ATOM 327 C MET A 45 -5.641 -2.207 -5.401 1.00 0.00 ATOM 328 N MET A 46 -5.419 -1.886 -6.681 1.00 0.00 ATOM 329 CA MET A 46 -6.450 -1.360 -7.573 1.00 0.00 ATOM 330 CB MET A 46 -6.044 -0.080 -8.273 1.00 0.00 ATOM 331 CG MET A 46 -5.609 1.005 -7.317 1.00 0.00 ATOM 332 SD MET A 46 -5.246 2.563 -8.122 1.00 0.00 ATOM 333 CE MET A 46 -6.933 3.121 -8.480 1.00 0.00 ATOM 334 O MET A 46 -5.704 -2.697 -9.415 1.00 0.00 ATOM 335 C MET A 46 -6.658 -2.315 -8.739 1.00 0.00 ATOM 336 N HIS A 47 -7.905 -2.665 -8.937 1.00 0.00 ATOM 337 CA HIS A 47 -8.257 -3.569 -10.029 1.00 0.00 ATOM 338 CB HIS A 47 -9.642 -4.207 -9.896 1.00 0.00 ATOM 339 CG HIS A 47 -9.849 -4.995 -8.646 1.00 0.00 ATOM 340 CD2 HIS A 47 -8.979 -5.469 -7.722 1.00 0.00 ATOM 341 ND1 HIS A 47 -11.083 -5.458 -8.275 1.00 0.00 ATOM 342 CE1 HIS A 47 -10.984 -6.138 -7.151 1.00 0.00 ATOM 343 NE2 HIS A 47 -9.713 -6.169 -6.797 1.00 0.00 ATOM 344 O HIS A 47 -8.743 -1.777 -11.561 1.00 0.00 ATOM 345 C HIS A 47 -8.207 -2.873 -11.378 1.00 0.00 ATOM 346 N PRO A 48 -7.545 -3.534 -12.317 1.00 0.00 ATOM 347 CA PRO A 48 -7.381 -3.032 -13.671 1.00 0.00 ATOM 348 CB PRO A 48 -6.585 -4.130 -14.378 1.00 0.00 ATOM 349 CG PRO A 48 -5.777 -4.764 -13.294 1.00 0.00 ATOM 350 CD PRO A 48 -6.661 -4.793 -12.080 1.00 0.00 ATOM 351 O PRO A 48 -9.657 -3.677 -14.224 1.00 0.00 ATOM 352 C PRO A 48 -8.760 -2.819 -14.355 1.00 0.00 ATOM 353 N THR A 49 -8.854 -1.679 -14.983 1.00 0.00 ATOM 354 CA THR A 49 -10.089 -1.279 -15.679 1.00 0.00 ATOM 355 CB THR A 49 -10.275 -2.215 -16.879 1.00 0.00 ATOM 356 CG2 THR A 49 -9.091 -2.083 -17.827 1.00 0.00 ATOM 357 OG1 THR A 49 -10.373 -3.572 -16.429 1.00 0.00 ATOM 358 O THR A 49 -12.469 -1.124 -15.423 1.00 0.00 ATOM 359 C THR A 49 -11.367 -1.073 -14.872 1.00 0.00 ATOM 360 N GLY A 50 -11.278 -0.875 -13.604 1.00 0.00 ATOM 361 CA GLY A 50 -12.444 -0.671 -12.767 1.00 0.00 ATOM 362 O GLY A 50 -11.904 1.613 -13.177 1.00 0.00 ATOM 363 C GLY A 50 -12.594 0.827 -12.541 1.00 0.00 ATOM 364 N VAL A 51 -13.447 1.218 -11.570 1.00 0.00 ATOM 365 CA VAL A 51 -13.674 2.648 -11.327 1.00 0.00 ATOM 366 CB VAL A 51 -14.820 2.847 -10.327 1.00 0.00 ATOM 367 CG1 VAL A 51 -15.001 4.286 -9.881 1.00 0.00 ATOM 368 CG2 VAL A 51 -16.143 2.329 -10.915 1.00 0.00 ATOM 369 O VAL A 51 -12.107 4.436 -11.344 1.00 0.00 ATOM 370 C VAL A 51 -12.447 3.372 -10.829 1.00 0.00 ATOM 371 N ALA A 52 -11.752 2.826 -9.812 1.00 0.00 ATOM 372 CA ALA A 52 -10.600 3.486 -9.229 1.00 0.00 ATOM 373 CB ALA A 52 -10.033 2.666 -8.079 1.00 0.00 ATOM 374 O ALA A 52 -8.975 4.776 -10.393 1.00 0.00 ATOM 375 C ALA A 52 -9.527 3.683 -10.280 1.00 0.00 ATOM 376 N ALA A 53 -9.231 2.629 -11.033 1.00 0.00 ATOM 377 CA ALA A 53 -8.193 2.669 -12.063 1.00 0.00 ATOM 378 CB ALA A 53 -8.059 1.308 -12.730 1.00 0.00 ATOM 379 O ALA A 53 -7.677 4.347 -13.706 1.00 0.00 ATOM 380 C ALA A 53 -8.552 3.691 -13.141 1.00 0.00 ATOM 381 N GLN A 54 -9.845 3.817 -13.430 1.00 0.00 ATOM 382 CA GLN A 54 -10.303 4.750 -14.453 1.00 0.00 ATOM 383 CB GLN A 54 -11.818 4.650 -14.632 1.00 0.00 ATOM 384 CG GLN A 54 -12.282 3.364 -15.296 1.00 0.00 ATOM 385 CD GLN A 54 -13.791 3.283 -15.421 1.00 0.00 ATOM 386 OE1 GLN A 54 -14.504 4.216 -15.051 1.00 0.00 ATOM 387 NE2 GLN A 54 -14.279 2.167 -15.946 1.00 0.00 ATOM 388 O GLN A 54 -9.774 7.007 -15.042 1.00 0.00 ATOM 389 C GLN A 54 -9.961 6.206 -14.134 1.00 0.00 ATOM 390 N THR A 55 -9.858 6.551 -12.854 1.00 0.00 ATOM 391 CA THR A 55 -9.536 7.934 -12.489 1.00 0.00 ATOM 392 CB THR A 55 -9.654 8.206 -10.985 1.00 0.00 ATOM 393 CG2 THR A 55 -11.052 7.903 -10.492 1.00 0.00 ATOM 394 OG1 THR A 55 -8.589 7.587 -10.250 1.00 0.00 ATOM 395 O THR A 55 -7.845 9.567 -12.963 1.00 0.00 ATOM 396 C THR A 55 -8.114 8.367 -12.840 1.00 0.00 ATOM 397 N GLN A 56 -7.217 7.399 -13.023 1.00 0.00 ATOM 398 CA GLN A 56 -5.809 7.699 -13.304 1.00 0.00 ATOM 399 CB GLN A 56 -5.924 8.057 -14.973 1.00 0.00 ATOM 400 CG GLN A 56 -7.175 7.566 -15.616 1.00 0.00 ATOM 401 CD GLN A 56 -7.665 8.517 -16.658 1.00 0.00 ATOM 402 OE1 GLN A 56 -8.283 9.555 -16.358 1.00 0.00 ATOM 403 NE2 GLN A 56 -7.375 8.186 -17.915 1.00 0.00 ATOM 404 O GLN A 56 -4.176 9.212 -12.417 1.00 0.00 ATOM 405 C GLN A 56 -5.202 8.560 -12.183 1.00 0.00 ATOM 406 N LYS A 57 -5.891 8.617 -11.048 1.00 0.00 ATOM 407 CA LYS A 57 -5.460 9.506 -9.977 1.00 0.00 ATOM 408 CB LYS A 57 -6.513 10.608 -9.846 1.00 0.00 ATOM 409 CG LYS A 57 -6.626 11.505 -11.068 1.00 0.00 ATOM 410 CD LYS A 57 -7.686 12.578 -10.871 1.00 0.00 ATOM 411 CE LYS A 57 -7.918 13.368 -12.148 1.00 0.00 ATOM 412 NZ LYS A 57 -8.899 14.468 -11.949 1.00 0.00 ATOM 413 O LYS A 57 -4.381 9.303 -7.844 1.00 0.00 ATOM 414 C LYS A 57 -5.092 8.769 -8.701 1.00 0.00 ATOM 415 N LEU A 58 -5.732 7.668 -8.495 1.00 0.00 ATOM 416 CA LEU A 58 -5.514 6.933 -7.263 1.00 0.00 ATOM 417 CB LEU A 58 -6.802 6.177 -6.926 1.00 0.00 ATOM 418 CG LEU A 58 -8.068 7.024 -6.791 1.00 0.00 ATOM 419 CD1 LEU A 58 -9.286 6.139 -6.579 1.00 0.00 ATOM 420 CD2 LEU A 58 -7.958 7.974 -5.609 1.00 0.00 ATOM 421 O LEU A 58 -3.903 5.591 -8.578 1.00 0.00 ATOM 422 C LEU A 58 -4.284 6.030 -7.452 1.00 0.00 ATOM 423 N ARG A 59 -3.691 5.698 -6.281 1.00 0.00 ATOM 424 CA ARG A 59 -2.545 4.851 -6.212 1.00 0.00 ATOM 425 CB ARG A 59 -1.256 5.708 -6.120 1.00 0.00 ATOM 426 CG ARG A 59 0.052 4.977 -5.795 1.00 0.00 ATOM 427 CD ARG A 59 0.589 4.187 -6.976 1.00 0.00 ATOM 428 NE ARG A 59 2.033 3.972 -6.889 1.00 0.00 ATOM 429 CZ ARG A 59 2.948 4.829 -7.337 1.00 0.00 ATOM 430 NH1 ARG A 59 2.581 5.974 -7.900 1.00 0.00 ATOM 431 NH2 ARG A 59 4.233 4.518 -7.286 1.00 0.00 ATOM 432 O ARG A 59 -3.021 4.416 -3.908 1.00 0.00 ATOM 433 C ARG A 59 -2.476 4.029 -4.939 1.00 0.00 ATOM 434 N VAL A 60 -1.864 2.855 -5.044 1.00 0.00 ATOM 435 CA VAL A 60 -1.671 1.991 -3.892 1.00 0.00 ATOM 436 CB VAL A 60 -0.992 0.681 -4.313 1.00 0.00 ATOM 437 CG1 VAL A 60 -0.663 -0.127 -3.100 1.00 0.00 ATOM 438 CG2 VAL A 60 -1.920 -0.106 -5.228 1.00 0.00 ATOM 439 O VAL A 60 0.130 3.509 -3.421 1.00 0.00 ATOM 440 C VAL A 60 -0.783 2.812 -2.965 1.00 0.00 ATOM 441 N GLY A 61 -1.080 2.774 -1.672 1.00 0.00 ATOM 442 CA GLY A 61 -0.305 3.536 -0.711 1.00 0.00 ATOM 443 O GLY A 61 -0.784 5.325 0.809 1.00 0.00 ATOM 444 C GLY A 61 -1.042 4.794 -0.272 1.00 0.00 ATOM 445 N ASP A 62 -2.035 5.222 -1.069 1.00 0.00 ATOM 446 CA ASP A 62 -2.813 6.412 -0.706 1.00 0.00 ATOM 447 CB ASP A 62 -3.732 6.794 -1.870 1.00 0.00 ATOM 448 CG ASP A 62 -2.970 7.345 -3.057 1.00 0.00 ATOM 449 OD1 ASP A 62 -1.768 7.648 -2.905 1.00 0.00 ATOM 450 OD2 ASP A 62 -3.574 7.477 -4.142 1.00 0.00 ATOM 451 O ASP A 62 -4.242 5.012 0.631 1.00 0.00 ATOM 452 C ASP A 62 -3.665 6.106 0.517 1.00 0.00 ATOM 453 N ARG A 63 -3.742 7.076 1.406 1.00 0.00 ATOM 454 CA ARG A 63 -4.573 6.945 2.604 1.00 0.00 ATOM 455 CB ARG A 63 -4.039 7.802 3.705 1.00 0.00 ATOM 456 CG ARG A 63 -4.994 7.980 4.864 1.00 0.00 ATOM 457 CD ARG A 63 -4.520 8.896 5.953 1.00 0.00 ATOM 458 NE ARG A 63 -3.236 8.453 6.468 1.00 0.00 ATOM 459 CZ ARG A 63 -2.367 9.218 7.089 1.00 0.00 ATOM 460 NH1 ARG A 63 -2.601 10.485 7.343 1.00 0.00 ATOM 461 NH2 ARG A 63 -1.213 8.675 7.459 1.00 0.00 ATOM 462 O ARG A 63 -5.910 8.657 1.588 1.00 0.00 ATOM 463 C ARG A 63 -5.895 7.604 2.223 1.00 0.00 ATOM 464 N ILE A 64 -7.016 6.970 2.566 1.00 0.00 ATOM 465 CA ILE A 64 -8.321 7.530 2.274 1.00 0.00 ATOM 466 CB ILE A 64 -9.364 6.432 1.992 1.00 0.00 ATOM 467 CG1 ILE A 64 -8.952 5.607 0.772 1.00 0.00 ATOM 468 CG2 ILE A 64 -10.728 7.050 1.719 1.00 0.00 ATOM 469 CD1 ILE A 64 -9.798 4.371 0.557 1.00 0.00 ATOM 470 O ILE A 64 -8.648 7.779 4.636 1.00 0.00 ATOM 471 C ILE A 64 -8.649 8.326 3.533 1.00 0.00 ATOM 472 N VAL A 65 -8.857 9.628 3.377 1.00 0.00 ATOM 473 CA VAL A 65 -9.128 10.489 4.524 1.00 0.00 ATOM 474 CB VAL A 65 -8.268 11.755 4.533 1.00 0.00 ATOM 475 CG1 VAL A 65 -6.837 11.407 4.697 1.00 0.00 ATOM 476 CG2 VAL A 65 -8.391 12.514 3.264 1.00 0.00 ATOM 477 O VAL A 65 -11.062 11.197 5.720 1.00 0.00 ATOM 478 C VAL A 65 -10.589 10.904 4.631 1.00 0.00 ATOM 479 N THR A 66 -11.277 10.971 3.516 1.00 0.00 ATOM 480 CA THR A 66 -12.691 11.331 3.545 1.00 0.00 ATOM 481 CB THR A 66 -12.836 12.861 3.436 1.00 0.00 ATOM 482 CG2 THR A 66 -14.297 13.267 3.558 1.00 0.00 ATOM 483 OG1 THR A 66 -12.091 13.489 4.486 1.00 0.00 ATOM 484 O THR A 66 -12.955 10.729 1.239 1.00 0.00 ATOM 485 C THR A 66 -13.444 10.675 2.383 1.00 0.00 ATOM 486 N ILE A 67 -14.649 10.258 2.652 1.00 0.00 ATOM 487 CA ILE A 67 -15.569 9.747 1.610 1.00 0.00 ATOM 488 CB ILE A 67 -15.856 8.264 1.906 1.00 0.00 ATOM 489 CG1 ILE A 67 -14.551 7.464 1.937 1.00 0.00 ATOM 490 CG2 ILE A 67 -16.758 7.673 0.834 1.00 0.00 ATOM 491 CD1 ILE A 67 -14.728 6.026 2.372 1.00 0.00 ATOM 492 O ILE A 67 -17.632 10.432 2.576 1.00 0.00 ATOM 493 C ILE A 67 -16.865 10.543 1.617 1.00 0.00 ATOM 494 N CYS A 68 -17.157 11.275 0.569 1.00 0.00 ATOM 495 CA CYS A 68 -18.357 12.088 0.512 1.00 0.00 ATOM 496 CB CYS A 68 -19.610 11.218 0.391 1.00 0.00 ATOM 497 SG CYS A 68 -19.689 10.229 -1.120 1.00 0.00 ATOM 498 O CYS A 68 -19.634 13.205 2.222 1.00 0.00 ATOM 499 C CYS A 68 -18.526 13.012 1.721 1.00 0.00 ATOM 500 N GLY A 69 -17.419 13.565 2.200 1.00 0.00 ATOM 501 CA GLY A 69 -17.478 14.482 3.328 1.00 0.00 ATOM 502 O GLY A 69 -17.193 14.460 5.700 1.00 0.00 ATOM 503 C GLY A 69 -17.345 13.796 4.672 1.00 0.00 ATOM 504 N THR A 70 -17.399 12.472 4.676 1.00 0.00 ATOM 505 CA THR A 70 -17.277 11.731 5.919 1.00 0.00 ATOM 506 CB THR A 70 -17.994 10.371 5.841 1.00 0.00 ATOM 507 CG2 THR A 70 -17.827 9.607 7.145 1.00 0.00 ATOM 508 OG1 THR A 70 -19.390 10.577 5.597 1.00 0.00 ATOM 509 O THR A 70 -15.108 10.798 5.471 1.00 0.00 ATOM 510 C THR A 70 -15.810 11.463 6.232 1.00 0.00 ATOM 511 N SER A 71 -15.359 11.977 7.367 1.00 0.00 ATOM 512 CA SER A 71 -13.976 11.818 7.793 1.00 0.00 ATOM 513 CB SER A 71 -13.654 12.785 8.944 1.00 0.00 ATOM 514 OG SER A 71 -13.840 14.141 8.534 1.00 0.00 ATOM 515 O SER A 71 -14.291 9.795 9.051 1.00 0.00 ATOM 516 C SER A 71 -13.626 10.390 8.205 1.00 0.00 ATOM 517 N THR A 72 -12.565 9.847 7.616 1.00 0.00 ATOM 518 CA THR A 72 -12.124 8.492 7.926 1.00 0.00 ATOM 519 CB THR A 72 -12.172 7.583 6.684 1.00 0.00 ATOM 520 CG2 THR A 72 -13.597 7.459 6.169 1.00 0.00 ATOM 521 OG1 THR A 72 -11.351 8.140 5.651 1.00 0.00 ATOM 522 O THR A 72 -10.066 7.421 8.509 1.00 0.00 ATOM 523 C THR A 72 -10.687 8.480 8.437 1.00 0.00 ATOM 524 N GLU A 73 -10.155 9.651 8.778 1.00 0.00 ATOM 525 CA GLU A 73 -8.774 9.745 9.245 1.00 0.00 ATOM 526 CB GLU A 73 -8.414 11.199 9.557 1.00 0.00 ATOM 527 CG GLU A 73 -8.269 12.081 8.327 1.00 0.00 ATOM 528 CD GLU A 73 -7.997 13.530 8.678 1.00 0.00 ATOM 529 OE1 GLU A 73 -8.012 13.862 9.882 1.00 0.00 ATOM 530 OE2 GLU A 73 -7.774 14.334 7.748 1.00 0.00 ATOM 531 O GLU A 73 -7.334 8.646 10.809 1.00 0.00 ATOM 532 C GLU A 73 -8.487 8.942 10.512 1.00 0.00 ATOM 533 N GLY A 74 -9.524 8.608 11.271 1.00 0.00 ATOM 534 CA GLY A 74 -9.320 7.827 12.489 1.00 0.00 ATOM 535 O GLY A 74 -10.712 6.246 13.650 1.00 0.00 ATOM 536 C GLY A 74 -10.333 6.689 12.569 1.00 0.00 ATOM 537 N MET A 75 -10.794 6.243 11.406 1.00 0.00 ATOM 538 CA MET A 75 -11.774 5.169 11.340 1.00 0.00 ATOM 539 CB MET A 75 -12.455 5.154 9.971 1.00 0.00 ATOM 540 CG MET A 75 -13.263 6.405 9.666 1.00 0.00 ATOM 541 SD MET A 75 -14.698 6.587 10.741 1.00 0.00 ATOM 542 CE MET A 75 -14.109 7.832 11.887 1.00 0.00 ATOM 543 O MET A 75 -10.004 3.549 11.232 1.00 0.00 ATOM 544 C MET A 75 -11.179 3.785 11.533 1.00 0.00 ATOM 545 N THR A 76 -11.990 2.883 12.077 1.00 0.00 ATOM 546 CA THR A 76 -11.582 1.497 12.268 1.00 0.00 ATOM 547 CB THR A 76 -12.453 0.801 13.331 1.00 0.00 ATOM 548 CG2 THR A 76 -12.402 1.564 14.645 1.00 0.00 ATOM 549 OG1 THR A 76 -13.812 0.748 12.879 1.00 0.00 ATOM 550 O THR A 76 -12.379 1.463 9.984 1.00 0.00 ATOM 551 C THR A 76 -11.703 0.913 10.867 1.00 0.00 ATOM 552 N HIS A 77 -11.140 -0.279 10.642 1.00 0.00 ATOM 553 CA HIS A 77 -11.334 -0.937 9.360 1.00 0.00 ATOM 554 CB HIS A 77 -10.619 -2.318 9.490 1.00 0.00 ATOM 555 CG HIS A 77 -10.711 -3.178 8.268 1.00 0.00 ATOM 556 CD2 HIS A 77 -11.715 -3.964 7.809 1.00 0.00 ATOM 557 ND1 HIS A 77 -9.674 -3.318 7.379 1.00 0.00 ATOM 558 CE1 HIS A 77 -10.028 -4.184 6.428 1.00 0.00 ATOM 559 NE2 HIS A 77 -11.274 -4.586 6.662 1.00 0.00 ATOM 560 O HIS A 77 -13.237 -0.832 7.880 1.00 0.00 ATOM 561 C HIS A 77 -12.826 -1.062 9.021 1.00 0.00 ATOM 562 N THR A 78 -13.614 -1.521 9.986 1.00 0.00 ATOM 563 CA THR A 78 -15.048 -1.699 9.776 1.00 0.00 ATOM 564 CB THR A 78 -15.744 -2.212 11.050 1.00 0.00 ATOM 565 CG2 THR A 78 -17.242 -2.350 10.816 1.00 0.00 ATOM 566 OG1 THR A 78 -15.211 -3.494 11.406 1.00 0.00 ATOM 567 O THR A 78 -16.618 -0.413 8.516 1.00 0.00 ATOM 568 C THR A 78 -15.784 -0.412 9.413 1.00 0.00 ATOM 569 N GLN A 79 -15.505 0.689 10.122 1.00 0.00 ATOM 570 CA GLN A 79 -16.158 1.962 9.821 1.00 0.00 ATOM 571 CB GLN A 79 -15.656 3.073 10.704 1.00 0.00 ATOM 572 CG GLN A 79 -16.072 2.901 12.154 1.00 0.00 ATOM 573 CD GLN A 79 -15.425 3.902 13.072 1.00 0.00 ATOM 574 OE1 GLN A 79 -14.289 3.727 13.491 1.00 0.00 ATOM 575 NE2 GLN A 79 -16.150 4.961 13.404 1.00 0.00 ATOM 576 O GLN A 79 -16.680 2.921 7.680 1.00 0.00 ATOM 577 C GLN A 79 -15.825 2.406 8.397 1.00 0.00 ATOM 578 N ALA A 80 -14.583 2.188 7.978 1.00 0.00 ATOM 579 CA ALA A 80 -14.159 2.560 6.633 1.00 0.00 ATOM 580 CB ALA A 80 -12.745 2.199 6.365 1.00 0.00 ATOM 581 O ALA A 80 -15.316 2.256 4.555 1.00 0.00 ATOM 582 C ALA A 80 -14.905 1.736 5.590 1.00 0.00 ATOM 583 N VAL A 81 -15.053 0.443 5.852 1.00 0.00 ATOM 584 CA VAL A 81 -15.744 -0.438 4.923 1.00 0.00 ATOM 585 CB VAL A 81 -15.712 -1.895 5.419 1.00 0.00 ATOM 586 CG1 VAL A 81 -16.622 -2.768 4.568 1.00 0.00 ATOM 587 CG2 VAL A 81 -14.298 -2.454 5.341 1.00 0.00 ATOM 588 O VAL A 81 -17.746 -0.001 3.675 1.00 0.00 ATOM 589 C VAL A 81 -17.210 -0.033 4.780 1.00 0.00 ATOM 590 N ASN A 82 -17.846 0.310 5.896 1.00 0.00 ATOM 591 CA ASN A 82 -19.249 0.703 5.866 1.00 0.00 ATOM 592 CB ASN A 82 -19.830 0.795 7.255 1.00 0.00 ATOM 593 CG ASN A 82 -19.851 -0.558 7.943 1.00 0.00 ATOM 594 ND2 ASN A 82 -19.985 -0.560 9.256 1.00 0.00 ATOM 595 OD1 ASN A 82 -19.760 -1.594 7.283 1.00 0.00 ATOM 596 O ASN A 82 -20.367 2.141 4.314 1.00 0.00 ATOM 597 C ASN A 82 -19.446 2.010 5.104 1.00 0.00 ATOM 598 N LEU A 83 -18.550 2.958 5.331 1.00 0.00 ATOM 599 CA LEU A 83 -18.622 4.251 4.647 1.00 0.00 ATOM 600 CB LEU A 83 -17.520 5.188 5.142 1.00 0.00 ATOM 601 CG LEU A 83 -17.657 5.697 6.579 1.00 0.00 ATOM 602 CD1 LEU A 83 -16.413 6.463 7.000 1.00 0.00 ATOM 603 CD2 LEU A 83 -18.854 6.624 6.708 1.00 0.00 ATOM 604 O LEU A 83 -19.261 4.543 2.348 1.00 0.00 ATOM 605 C LEU A 83 -18.467 4.034 3.147 1.00 0.00 ATOM 606 N LEU A 84 -17.464 3.252 2.748 1.00 0.00 ATOM 607 CA LEU A 84 -17.256 3.005 1.321 1.00 0.00 ATOM 608 CB LEU A 84 -15.956 2.231 1.054 1.00 0.00 ATOM 609 CG LEU A 84 -14.723 3.130 1.081 1.00 0.00 ATOM 610 CD1 LEU A 84 -13.462 2.335 1.272 1.00 0.00 ATOM 611 CD2 LEU A 84 -14.636 3.974 -0.244 1.00 0.00 ATOM 612 O LEU A 84 -18.816 2.475 -0.426 1.00 0.00 ATOM 613 C LEU A 84 -18.376 2.187 0.687 1.00 0.00 ATOM 614 N LYS A 85 -18.897 1.225 1.435 1.00 0.00 ATOM 615 CA LYS A 85 -19.969 0.367 0.942 1.00 0.00 ATOM 616 CB LYS A 85 -20.302 -0.718 1.968 1.00 0.00 ATOM 617 CG LYS A 85 -21.352 -1.711 1.501 1.00 0.00 ATOM 618 CD LYS A 85 -21.562 -2.813 2.527 1.00 0.00 ATOM 619 CE LYS A 85 -22.607 -3.813 2.058 1.00 0.00 ATOM 620 NZ LYS A 85 -22.812 -4.910 3.045 1.00 0.00 ATOM 621 O LYS A 85 -22.007 0.781 -0.247 1.00 0.00 ATOM 622 C LYS A 85 -21.267 1.119 0.681 1.00 0.00 ATOM 623 N ASN A 86 -21.506 2.210 1.418 1.00 0.00 ATOM 624 CA ASN A 86 -22.727 2.986 1.258 1.00 0.00 ATOM 625 CB ASN A 86 -23.149 3.596 2.598 1.00 0.00 ATOM 626 CG ASN A 86 -23.662 2.558 3.576 1.00 0.00 ATOM 627 ND2 ASN A 86 -23.550 2.857 4.866 1.00 0.00 ATOM 628 OD1 ASN A 86 -24.150 1.503 3.176 1.00 0.00 ATOM 629 O ASN A 86 -23.744 4.720 -0.049 1.00 0.00 ATOM 630 C ASN A 86 -22.733 4.052 0.172 1.00 0.00 ATOM 631 N ALA A 87 -21.617 4.209 -0.524 1.00 0.00 ATOM 632 CA ALA A 87 -21.491 5.218 -1.571 1.00 0.00 ATOM 633 CB ALA A 87 -20.029 5.383 -1.954 1.00 0.00 ATOM 634 O ALA A 87 -22.616 3.789 -3.148 1.00 0.00 ATOM 635 C ALA A 87 -22.298 4.941 -2.840 1.00 0.00 ATOM 636 N SER A 88 -22.624 6.006 -3.564 1.00 0.00 ATOM 637 CA SER A 88 -23.385 5.869 -4.793 1.00 0.00 ATOM 638 CB SER A 88 -24.373 7.025 -4.951 1.00 0.00 ATOM 639 OG SER A 88 -23.693 8.262 -5.084 1.00 0.00 ATOM 640 O SER A 88 -21.339 5.651 -5.987 1.00 0.00 ATOM 641 C SER A 88 -22.539 5.896 -6.038 1.00 0.00 ATOM 642 N GLY A 89 -23.192 6.052 -7.182 1.00 0.00 ATOM 643 CA GLY A 89 -22.460 6.096 -8.433 1.00 0.00 ATOM 644 O GLY A 89 -20.292 6.950 -9.004 1.00 0.00 ATOM 645 C GLY A 89 -21.348 7.134 -8.398 1.00 0.00 ATOM 646 N SER A 90 -21.674 8.259 -7.619 1.00 0.00 ATOM 647 CA SER A 90 -20.740 9.371 -7.522 1.00 0.00 ATOM 648 CB SER A 90 -21.449 10.688 -7.831 1.00 0.00 ATOM 649 OG SER A 90 -20.562 11.775 -7.614 1.00 0.00 ATOM 650 O SER A 90 -20.693 9.758 -5.154 1.00 0.00 ATOM 651 C SER A 90 -20.070 9.398 -6.153 1.00 0.00 ATOM 652 N ILE A 91 -18.809 8.982 -6.110 1.00 0.00 ATOM 653 CA ILE A 91 -18.060 8.930 -4.859 1.00 0.00 ATOM 654 CB ILE A 91 -17.571 7.497 -4.526 1.00 0.00 ATOM 655 CG1 ILE A 91 -18.646 6.458 -4.739 1.00 0.00 ATOM 656 CG2 ILE A 91 -17.142 7.410 -3.055 1.00 0.00 ATOM 657 CD1 ILE A 91 -18.083 5.065 -4.493 1.00 0.00 ATOM 658 O ILE A 91 -15.901 9.698 -5.582 1.00 0.00 ATOM 659 C ILE A 91 -16.877 9.892 -4.847 1.00 0.00 ATOM 660 N GLU A 92 -16.956 10.929 -4.005 1.00 0.00 ATOM 661 CA GLU A 92 -15.884 11.911 -3.893 1.00 0.00 ATOM 662 CB GLU A 92 -16.469 13.303 -3.645 1.00 0.00 ATOM 663 CG GLU A 92 -15.426 14.401 -3.517 1.00 0.00 ATOM 664 CD GLU A 92 -16.041 15.762 -3.259 1.00 0.00 ATOM 665 OE1 GLU A 92 -17.285 15.845 -3.178 1.00 0.00 ATOM 666 OE2 GLU A 92 -15.280 16.745 -3.137 1.00 0.00 ATOM 667 O GLU A 92 -15.376 11.496 -1.584 1.00 0.00 ATOM 668 C GLU A 92 -14.958 11.551 -2.736 1.00 0.00 ATOM 669 N MET A 93 -13.699 11.278 -3.051 1.00 0.00 ATOM 670 CA MET A 93 -12.736 10.905 -2.026 1.00 0.00 ATOM 671 CB MET A 93 -11.995 9.635 -2.437 1.00 0.00 ATOM 672 CG MET A 93 -12.893 8.461 -2.810 1.00 0.00 ATOM 673 SD MET A 93 -13.822 7.760 -1.428 1.00 0.00 ATOM 674 CE MET A 93 -12.660 6.535 -0.833 1.00 0.00 ATOM 675 O MET A 93 -11.080 12.443 -2.801 1.00 0.00 ATOM 676 C MET A 93 -11.635 11.928 -1.832 1.00 0.00 ATOM 677 N GLN A 94 -11.258 12.136 -0.575 1.00 0.00 ATOM 678 CA GLN A 94 -10.150 13.015 -0.244 1.00 0.00 ATOM 679 CB GLN A 94 -10.509 14.107 0.735 1.00 0.00 ATOM 680 CG GLN A 94 -9.468 15.219 0.545 1.00 0.00 ATOM 681 CD GLN A 94 -10.111 16.597 0.395 1.00 0.00 ATOM 682 OE1 GLN A 94 -9.493 17.526 -0.141 1.00 0.00 ATOM 683 NE2 GLN A 94 -11.365 16.705 0.808 1.00 0.00 ATOM 684 O GLN A 94 -9.318 11.219 1.099 1.00 0.00 ATOM 685 C GLN A 94 -9.076 12.049 0.221 1.00 0.00 ATOM 686 N VAL A 95 -7.919 12.086 -0.420 1.00 0.00 ATOM 687 CA VAL A 95 -6.877 11.098 -0.185 1.00 0.00 ATOM 688 CB VAL A 95 -6.707 10.048 -1.297 1.00 0.00 ATOM 689 CG1 VAL A 95 -7.971 9.210 -1.436 1.00 0.00 ATOM 690 CG2 VAL A 95 -6.431 10.724 -2.631 1.00 0.00 ATOM 691 O VAL A 95 -5.418 12.975 -0.459 1.00 0.00 ATOM 692 C VAL A 95 -5.538 11.806 -0.095 1.00 0.00 ATOM 693 N VAL A 96 -4.547 11.105 0.444 1.00 0.00 ATOM 694 CA VAL A 96 -3.218 11.668 0.602 1.00 0.00 ATOM 695 CB VAL A 96 -3.106 12.366 1.969 1.00 0.00 ATOM 696 CG1 VAL A 96 -3.348 11.375 3.096 1.00 0.00 ATOM 697 CG2 VAL A 96 -1.718 12.965 2.150 1.00 0.00 ATOM 698 O VAL A 96 -2.350 9.461 0.963 1.00 0.00 ATOM 699 C VAL A 96 -2.147 10.586 0.507 1.00 0.00 ATOM 700 N ALA A 97 -1.044 10.906 -0.157 1.00 0.00 ATOM 701 CA ALA A 97 0.051 9.956 -0.319 1.00 0.00 ATOM 702 CB ALA A 97 0.976 10.387 -1.412 1.00 0.00 ATOM 703 O ALA A 97 2.077 9.557 0.947 1.00 0.00 ATOM 704 C ALA A 97 0.854 9.425 0.841 1.00 0.00 ATOM 705 N GLY A 98 0.314 8.719 1.710 1.00 0.00 ATOM 706 CA GLY A 98 0.888 8.136 2.913 1.00 0.00 ATOM 707 O GLY A 98 1.925 8.708 4.979 1.00 0.00 ATOM 708 C GLY A 98 1.417 9.115 3.950 1.00 0.00 ATOM 709 N GLY A 99 1.442 10.379 3.621 1.00 0.00 ATOM 710 CA GLY A 99 1.802 11.393 4.594 1.00 0.00 ATOM 711 O GLY A 99 4.062 11.708 3.863 1.00 0.00 ATOM 712 C GLY A 99 3.066 12.204 4.386 1.00 0.00 ATOM 713 N ASP A 100 3.023 13.501 4.892 1.00 0.00 ATOM 714 CA ASP A 100 4.182 14.377 4.776 1.00 0.00 ATOM 715 CB ASP A 100 5.090 14.392 3.850 1.00 0.00 ATOM 716 CG ASP A 100 6.281 13.654 4.421 1.00 0.00 ATOM 717 OD1 ASP A 100 6.315 13.349 5.633 1.00 0.00 ATOM 718 OD2 ASP A 100 7.209 13.373 3.634 1.00 0.00 ATOM 719 O ASP A 100 2.933 16.467 5.025 1.00 0.00 ATOM 720 C ASP A 100 3.928 15.790 5.297 1.00 0.00 ATOM 721 N VAL A 101 4.977 16.235 5.980 1.00 0.00 ATOM 722 CA VAL A 101 4.993 17.562 6.586 1.00 0.00 ATOM 723 CB VAL A 101 6.309 17.807 7.392 1.00 0.00 ATOM 724 CG1 VAL A 101 6.319 19.229 7.984 1.00 0.00 ATOM 725 CG2 VAL A 101 6.410 16.781 8.534 1.00 0.00 ATOM 726 O VAL A 101 3.882 19.504 5.762 1.00 0.00 ATOM 727 C VAL A 101 4.779 18.683 5.591 1.00 0.00 ATOM 728 N SER A 102 5.568 18.680 4.528 1.00 0.00 ATOM 729 CA SER A 102 5.453 19.701 3.485 1.00 0.00 ATOM 730 CB SER A 102 6.561 19.517 2.458 1.00 0.00 ATOM 731 OG SER A 102 6.408 18.300 1.737 1.00 0.00 ATOM 732 O SER A 102 3.697 20.707 2.196 1.00 0.00 ATOM 733 C SER A 102 4.112 19.688 2.751 1.00 0.00 ATOM 734 N GLU A 103 3.399 18.565 2.829 1.00 0.00 ATOM 735 CA GLU A 103 2.118 18.435 2.153 1.00 0.00 ATOM 736 CB GLU A 103 2.357 17.353 0.974 1.00 0.00 ATOM 737 CG GLU A 103 3.269 17.809 -0.167 1.00 0.00 ATOM 738 CD GLU A 103 2.842 19.136 -0.774 1.00 0.00 ATOM 739 OE1 GLU A 103 1.626 19.362 -0.934 1.00 0.00 ATOM 740 OE2 GLU A 103 3.725 19.953 -1.107 1.00 0.00 ATOM 741 O GLU A 103 -0.257 18.475 2.614 1.00 0.00 ATOM 742 C GLU A 103 0.903 18.279 3.055 1.00 0.00 ATOM 743 N THR A 104 1.151 17.843 4.305 1.00 0.00 ATOM 744 CA THR A 104 0.083 17.583 5.240 1.00 0.00 ATOM 745 CB THR A 104 -0.668 16.289 4.909 1.00 0.00 ATOM 746 CG2 THR A 104 0.272 15.088 4.873 1.00 0.00 ATOM 747 OG1 THR A 104 -1.697 16.031 5.879 1.00 0.00 ATOM 748 O THR A 104 1.917 17.196 6.693 1.00 0.00 ATOM 749 C THR A 104 0.727 17.462 6.604 1.00 0.00 ATOM 750 N SER A 105 -0.054 17.565 7.662 1.00 0.00 ATOM 751 CA SER A 105 0.471 17.363 9.005 1.00 0.00 ATOM 752 CB SER A 105 -0.573 17.808 10.024 1.00 0.00 ATOM 753 OG SER A 105 -1.771 17.061 9.862 1.00 0.00 ATOM 754 O SER A 105 1.641 15.633 10.211 1.00 0.00 ATOM 755 C SER A 105 0.916 15.914 9.251 1.00 0.00 ATOM 756 N VAL A 106 0.448 14.996 8.411 1.00 0.00 ATOM 757 CA VAL A 106 0.798 13.578 8.514 1.00 0.00 ATOM 758 CB VAL A 106 -0.423 12.704 8.887 1.00 0.00 ATOM 759 CG1 VAL A 106 -0.804 12.933 10.346 1.00 0.00 ATOM 760 CG2 VAL A 106 -1.592 13.001 7.981 1.00 0.00 ATOM 761 O VAL A 106 0.666 13.425 6.174 1.00 0.00 ATOM 762 C VAL A 106 1.364 13.172 7.157 1.00 0.00 ATOM 763 N THR B 1 -14.673 -4.664 4.654 1.00 0.00 ATOM 764 CA THR B 1 -14.646 -6.052 5.193 1.00 0.00 ATOM 765 CB THR B 1 -16.068 -6.528 5.560 1.00 0.00 ATOM 766 CG2 THR B 1 -16.015 -7.861 6.295 1.00 0.00 ATOM 767 OG1 THR B 1 -16.690 -5.555 6.409 1.00 0.00 ATOM 768 O THR B 1 -12.851 -6.991 3.906 1.00 0.00 ATOM 769 C THR B 1 -14.058 -6.997 4.159 1.00 0.00 ATOM 770 N GLU B 2 -14.894 -7.856 3.575 1.00 0.00 ATOM 771 CA GLU B 2 -14.437 -8.820 2.582 1.00 0.00 ATOM 772 CB GLU B 2 -15.574 -9.745 2.149 1.00 0.00 ATOM 773 CG GLU B 2 -15.962 -10.759 3.208 1.00 0.00 ATOM 774 CD GLU B 2 -17.105 -11.656 2.776 1.00 0.00 ATOM 775 OE1 GLU B 2 -17.456 -11.650 1.577 1.00 0.00 ATOM 776 OE2 GLU B 2 -17.646 -12.379 3.639 1.00 0.00 ATOM 777 O GLU B 2 -12.884 -8.538 0.782 1.00 0.00 ATOM 778 C GLU B 2 -13.907 -8.128 1.331 1.00 0.00 ATOM 779 N ASN B 3 -14.598 -7.089 0.874 1.00 0.00 ATOM 780 CA ASN B 3 -14.136 -6.350 -0.298 1.00 0.00 ATOM 781 CB ASN B 3 -15.162 -5.292 -0.711 1.00 0.00 ATOM 782 CG ASN B 3 -16.368 -5.893 -1.394 1.00 0.00 ATOM 783 ND2 ASN B 3 -17.435 -5.107 -1.536 1.00 0.00 ATOM 784 OD1 ASN B 3 -16.335 -7.048 -1.805 1.00 0.00 ATOM 785 O ASN B 3 -11.891 -5.694 -0.875 1.00 0.00 ATOM 786 C ASN B 3 -12.798 -5.659 -0.038 1.00 0.00 ATOM 787 N LEU B 4 -12.652 -5.069 1.141 1.00 0.00 ATOM 788 CA LEU B 4 -11.419 -4.365 1.451 1.00 0.00 ATOM 789 CB LEU B 4 -11.569 -3.497 2.702 1.00 0.00 ATOM 790 CG LEU B 4 -12.696 -2.461 2.561 1.00 0.00 ATOM 791 CD1 LEU B 4 -12.600 -1.425 3.657 1.00 0.00 ATOM 792 CD2 LEU B 4 -12.661 -1.873 1.157 1.00 0.00 ATOM 793 O LEU B 4 -9.100 -4.923 1.352 1.00 0.00 ATOM 794 C LEU B 4 -10.235 -5.316 1.595 1.00 0.00 ATOM 795 N TYR B 5 -10.494 -6.580 1.951 1.00 0.00 ATOM 796 CA TYR B 5 -9.414 -7.532 2.104 1.00 0.00 ATOM 797 CB TYR B 5 -9.597 -8.202 3.598 1.00 0.00 ATOM 798 CG TYR B 5 -8.367 -8.745 4.248 1.00 0.00 ATOM 799 CD1 TYR B 5 -7.562 -7.924 5.019 1.00 0.00 ATOM 800 CD2 TYR B 5 -7.972 -10.060 4.055 1.00 0.00 ATOM 801 CE1 TYR B 5 -6.412 -8.401 5.609 1.00 0.00 ATOM 802 CE2 TYR B 5 -6.815 -10.546 4.644 1.00 0.00 ATOM 803 CZ TYR B 5 -6.047 -9.713 5.407 1.00 0.00 ATOM 804 OH TYR B 5 -4.906 -10.204 5.979 1.00 0.00 ATOM 805 O TYR B 5 -8.944 -9.545 0.853 1.00 0.00 ATOM 806 C TYR B 5 -9.771 -8.903 1.532 1.00 0.00 ATOM 807 N PHE B 6 -11.009 -9.648 1.796 1.00 0.00 ATOM 808 CA PHE B 6 -11.345 -10.962 1.272 1.00 0.00 ATOM 809 CB PHE B 6 -12.652 -11.470 1.850 1.00 0.00 ATOM 810 CG PHE B 6 -12.586 -11.737 3.322 1.00 0.00 ATOM 811 CD1 PHE B 6 -11.907 -12.852 3.813 1.00 0.00 ATOM 812 CD2 PHE B 6 -13.172 -10.857 4.222 1.00 0.00 ATOM 813 CE1 PHE B 6 -11.812 -13.084 5.182 1.00 0.00 ATOM 814 CE2 PHE B 6 -13.081 -11.080 5.595 1.00 0.00 ATOM 815 CZ PHE B 6 -12.400 -12.196 6.072 1.00 0.00 ATOM 816 O PHE B 6 -10.885 -11.965 -0.834 1.00 0.00 ATOM 817 C PHE B 6 -10.412 -11.319 0.097 1.00 0.00 ATOM 818 N GLN B 7 -9.131 -10.968 0.175 1.00 0.00 ATOM 819 CA GLN B 7 -8.185 -11.390 -0.851 1.00 0.00 ATOM 820 CB GLN B 7 -8.113 -10.339 -1.918 1.00 0.00 ATOM 821 CG GLN B 7 -9.298 -10.515 -2.873 1.00 0.00 ATOM 822 CD GLN B 7 -9.484 -11.971 -3.328 1.00 0.00 ATOM 823 OE1 GLN B 7 -10.579 -12.527 -3.236 1.00 0.00 ATOM 824 NE2 GLN B 7 -8.414 -12.585 -3.824 1.00 0.00 ATOM 825 O GLN B 7 -6.066 -10.700 0.117 1.00 0.00 ATOM 826 C GLN B 7 -6.783 -11.621 -0.286 1.00 0.00 ATOM 827 N SER B 8 -6.293 -12.937 -0.172 1.00 0.00 ATOM 828 CA SER B 8 -4.962 -13.225 0.391 1.00 0.00 ATOM 829 CB SER B 8 -5.084 -13.979 1.709 1.00 0.00 ATOM 830 OG SER B 8 -3.799 -14.420 2.127 1.00 0.00 ATOM 831 O SER B 8 -4.750 -15.121 -1.055 1.00 0.00 ATOM 832 C SER B 8 -4.186 -14.174 -0.516 1.00 0.00 ATOM 833 N MET B 9 -2.933 -13.795 -0.808 1.00 0.00 ATOM 834 CA MET B 9 -2.046 -14.580 -1.685 1.00 0.00 ATOM 835 CB MET B 9 -1.427 -13.699 -2.772 1.00 0.00 ATOM 836 CG MET B 9 -2.434 -13.127 -3.756 1.00 0.00 ATOM 837 SD MET B 9 -3.284 -14.403 -4.705 1.00 0.00 ATOM 838 CE MET B 9 -1.966 -14.953 -5.787 1.00 0.00 ATOM 839 O MET B 9 -0.638 -14.811 0.246 1.00 0.00 ATOM 840 C MET B 9 -0.886 -15.190 -0.902 1.00 0.00 ATOM 841 N GLY B 10 -0.197 -16.132 -1.513 1.00 0.00 ATOM 842 CA GLY B 10 0.870 -16.865 -0.831 1.00 0.00 ATOM 843 O GLY B 10 2.366 -15.166 -1.623 1.00 0.00 ATOM 844 C GLY B 10 2.210 -16.150 -0.902 1.00 0.00 ATOM 845 N LEU B 11 3.182 -16.655 -0.140 1.00 0.00 ATOM 846 CA LEU B 11 4.505 -16.069 -0.110 1.00 0.00 ATOM 847 CB LEU B 11 5.367 -16.746 0.957 1.00 0.00 ATOM 848 CG LEU B 11 4.938 -16.535 2.410 1.00 0.00 ATOM 849 CD1 LEU B 11 5.799 -17.364 3.352 1.00 0.00 ATOM 850 CD2 LEU B 11 5.074 -15.072 2.804 1.00 0.00 ATOM 851 O LEU B 11 4.916 -17.350 -2.096 1.00 0.00 ATOM 852 C LEU B 11 5.086 -16.281 -1.501 1.00 0.00 ATOM 853 N ARG B 12 5.718 -15.265 -2.044 1.00 0.00 ATOM 854 CA ARG B 12 6.319 -15.335 -3.370 1.00 0.00 ATOM 855 CB ARG B 12 5.432 -14.495 -4.402 1.00 0.00 ATOM 856 CG ARG B 12 4.054 -15.209 -4.448 1.00 0.00 ATOM 857 CD ARG B 12 3.072 -14.618 -5.474 1.00 0.00 ATOM 858 NE ARG B 12 2.763 -13.207 -5.123 1.00 0.00 ATOM 859 CZ ARG B 12 2.466 -12.306 -6.028 1.00 0.00 ATOM 860 NH1 ARG B 12 2.345 -12.632 -7.280 1.00 0.00 ATOM 861 NH2 ARG B 12 2.298 -11.074 -5.661 1.00 0.00 ATOM 862 O ARG B 12 8.176 -14.043 -2.553 1.00 0.00 ATOM 863 C ARG B 12 7.773 -14.878 -3.369 1.00 0.00 ATOM 864 N THR B 13 8.560 -15.432 -4.283 1.00 0.00 ATOM 865 CA THR B 13 9.971 -15.087 -4.382 1.00 0.00 ATOM 866 CB THR B 13 10.853 -16.349 -4.338 1.00 0.00 ATOM 867 CG2 THR B 13 12.324 -15.974 -4.439 1.00 0.00 ATOM 868 OG1 THR B 13 10.635 -17.045 -3.105 1.00 0.00 ATOM 869 O THR B 13 9.877 -14.875 -6.771 1.00 0.00 ATOM 870 C THR B 13 10.198 -14.358 -5.706 1.00 0.00 ATOM 871 N VAL B 14 10.785 -13.170 -5.631 1.00 0.00 ATOM 872 CA VAL B 14 11.055 -12.381 -6.826 1.00 0.00 ATOM 873 CB VAL B 14 10.100 -11.175 -6.915 1.00 0.00 ATOM 874 CG1 VAL B 14 10.393 -10.354 -8.161 1.00 0.00 ATOM 875 CG2 VAL B 14 8.655 -11.643 -6.978 1.00 0.00 ATOM 876 O VAL B 14 12.924 -11.257 -5.841 1.00 0.00 ATOM 877 C VAL B 14 12.476 -11.843 -6.826 1.00 0.00 ATOM 878 N GLU B 15 13.186 -12.044 -7.929 1.00 0.00 ATOM 879 CA GLU B 15 14.546 -11.544 -8.036 1.00 0.00 ATOM 880 CB GLU B 15 15.438 -12.562 -8.749 1.00 0.00 ATOM 881 CG GLU B 15 16.881 -12.117 -8.914 1.00 0.00 ATOM 882 CD GLU B 15 17.730 -13.144 -9.636 1.00 0.00 ATOM 883 OE1 GLU B 15 17.186 -14.206 -10.011 1.00 0.00 ATOM 884 OE2 GLU B 15 18.937 -12.889 -9.828 1.00 0.00 ATOM 885 O GLU B 15 13.935 -10.149 -9.893 1.00 0.00 ATOM 886 C GLU B 15 14.541 -10.239 -8.823 1.00 0.00 ATOM 887 N MET B 16 15.067 -9.190 -8.201 1.00 0.00 ATOM 888 CA MET B 16 15.132 -7.875 -8.823 1.00 0.00 ATOM 889 CB MET B 16 14.658 -6.791 -7.852 1.00 0.00 ATOM 890 CG MET B 16 13.194 -6.904 -7.462 1.00 0.00 ATOM 891 SD MET B 16 12.661 -5.578 -6.363 1.00 0.00 ATOM 892 CE MET B 16 13.353 -6.130 -4.807 1.00 0.00 ATOM 893 O MET B 16 17.496 -7.971 -8.478 1.00 0.00 ATOM 894 C MET B 16 16.578 -7.628 -9.221 1.00 0.00 ATOM 895 N LYS B 17 16.792 -7.178 -10.453 1.00 0.00 ATOM 896 CA LYS B 17 18.143 -6.904 -10.920 1.00 0.00 ATOM 897 CB LYS B 17 18.471 -7.721 -12.169 1.00 0.00 ATOM 898 CG LYS B 17 18.487 -9.224 -11.943 1.00 0.00 ATOM 899 CD LYS B 17 18.857 -9.971 -13.216 1.00 0.00 ATOM 900 CE LYS B 17 18.910 -11.471 -12.981 1.00 0.00 ATOM 901 NZ LYS B 17 19.394 -12.206 -14.181 1.00 0.00 ATOM 902 O LYS B 17 17.642 -4.914 -12.206 1.00 0.00 ATOM 903 C LYS B 17 18.236 -5.417 -11.230 1.00 0.00 ATOM 904 N LYS B 18 18.961 -4.712 -10.270 1.00 0.00 ATOM 905 CA LYS B 18 19.080 -3.272 -10.384 1.00 0.00 ATOM 906 CB LYS B 18 18.610 -2.533 -9.128 1.00 0.00 ATOM 907 CG LYS B 18 19.339 -2.943 -7.858 1.00 0.00 ATOM 908 CD LYS B 18 18.851 -2.145 -6.661 1.00 0.00 ATOM 909 CE LYS B 18 19.594 -2.538 -5.396 1.00 0.00 ATOM 910 NZ LYS B 18 19.114 -1.778 -4.207 1.00 0.00 ATOM 911 O LYS B 18 21.463 -3.270 -10.002 1.00 0.00 ATOM 912 C LYS B 18 20.488 -2.732 -10.540 1.00 0.00 ATOM 913 N GLY B 19 20.611 -1.660 -11.352 1.00 0.00 ATOM 914 CA GLY B 19 21.855 -0.965 -11.569 1.00 0.00 ATOM 915 O GLY B 19 20.897 0.667 -10.097 1.00 0.00 ATOM 916 C GLY B 19 21.909 0.287 -10.689 1.00 0.00 ATOM 917 N PRO B 20 23.075 0.923 -10.596 1.00 0.00 ATOM 918 CA PRO B 20 23.213 2.129 -9.775 1.00 0.00 ATOM 919 CB PRO B 20 24.688 2.509 -9.924 1.00 0.00 ATOM 920 CG PRO B 20 25.385 1.214 -10.169 1.00 0.00 ATOM 921 CD PRO B 20 24.483 0.419 -11.070 1.00 0.00 ATOM 922 O PRO B 20 21.996 4.175 -9.502 1.00 0.00 ATOM 923 C PRO B 20 22.456 3.328 -10.302 1.00 0.00 ATOM 924 N THR B 21 22.249 3.453 -11.591 1.00 0.00 ATOM 925 CA THR B 21 21.518 4.594 -12.131 1.00 0.00 ATOM 926 CB THR B 21 21.676 4.722 -13.637 1.00 0.00 ATOM 927 CG2 THR B 21 23.135 5.010 -13.975 1.00 0.00 ATOM 928 OG1 THR B 21 21.263 3.509 -14.281 1.00 0.00 ATOM 929 O THR B 21 19.335 5.577 -11.937 1.00 0.00 ATOM 930 C THR B 21 20.024 4.563 -11.802 1.00 0.00 ATOM 931 N ASP B 22 19.447 3.374 -11.369 1.00 0.00 ATOM 932 CA ASP B 22 18.026 3.279 -11.083 1.00 0.00 ATOM 933 CB ASP B 22 17.274 2.470 -12.231 1.00 0.00 ATOM 934 CG ASP B 22 17.620 1.006 -12.269 1.00 0.00 ATOM 935 OD1 ASP B 22 18.578 0.602 -11.546 1.00 0.00 ATOM 936 OD2 ASP B 22 16.978 0.197 -13.013 1.00 0.00 ATOM 937 O ASP B 22 16.442 3.169 -9.305 1.00 0.00 ATOM 938 C ASP B 22 17.537 2.800 -9.730 1.00 0.00 ATOM 939 N SER B 23 18.325 1.976 -9.050 1.00 0.00 ATOM 940 CA SER B 23 17.892 1.473 -7.759 1.00 0.00 ATOM 941 CB SER B 23 17.284 2.647 -6.926 1.00 0.00 ATOM 942 OG SER B 23 17.206 2.310 -5.550 1.00 0.00 ATOM 943 O SER B 23 16.308 0.118 -8.937 1.00 0.00 ATOM 944 C SER B 23 16.711 0.521 -7.840 1.00 0.00 ATOM 945 N LEU B 24 16.151 0.169 -6.687 1.00 0.00 ATOM 946 CA LEU B 24 15.020 -0.749 -6.613 1.00 0.00 ATOM 947 CB LEU B 24 14.657 -1.040 -5.154 1.00 0.00 ATOM 948 CG LEU B 24 15.660 -1.884 -4.362 1.00 0.00 ATOM 949 CD1 LEU B 24 15.269 -1.941 -2.893 1.00 0.00 ATOM 950 CD2 LEU B 24 15.707 -3.304 -4.898 1.00 0.00 ATOM 951 O LEU B 24 13.074 -0.924 -8.012 1.00 0.00 ATOM 952 C LEU B 24 13.784 -0.198 -7.315 1.00 0.00 ATOM 953 N GLY B 25 13.525 1.091 -7.136 1.00 0.00 ATOM 954 CA GLY B 25 12.370 1.704 -7.766 1.00 0.00 ATOM 955 O GLY B 25 10.008 1.340 -7.574 1.00 0.00 ATOM 956 C GLY B 25 11.080 1.533 -6.988 1.00 0.00 ATOM 957 N ILE B 26 11.173 1.608 -5.662 1.00 0.00 ATOM 958 CA ILE B 26 10.001 1.474 -4.802 1.00 0.00 ATOM 959 CB ILE B 26 9.807 0.012 -4.324 1.00 0.00 ATOM 960 CG1 ILE B 26 11.038 -0.456 -3.541 1.00 0.00 ATOM 961 CG2 ILE B 26 9.561 -0.905 -5.522 1.00 0.00 ATOM 962 CD1 ILE B 26 10.825 -1.780 -2.808 1.00 0.00 ATOM 963 O ILE B 26 11.137 2.718 -3.092 1.00 0.00 ATOM 964 C ILE B 26 10.060 2.317 -3.531 1.00 0.00 ATOM 965 N SER B 27 8.894 2.601 -2.975 1.00 0.00 ATOM 966 CA SER B 27 8.796 3.393 -1.751 1.00 0.00 ATOM 967 CB SER B 27 8.000 4.632 -1.986 1.00 0.00 ATOM 968 OG SER B 27 8.774 5.374 -2.888 1.00 0.00 ATOM 969 O SER B 27 7.150 1.818 -1.000 1.00 0.00 ATOM 970 C SER B 27 8.127 2.508 -0.705 1.00 0.00 ATOM 971 N ILE B 28 8.624 2.511 0.536 1.00 0.00 ATOM 972 CA ILE B 28 8.052 1.671 1.575 1.00 0.00 ATOM 973 CB ILE B 28 9.213 1.123 2.420 1.00 0.00 ATOM 974 CG1 ILE B 28 10.049 0.166 1.564 1.00 0.00 ATOM 975 CG2 ILE B 28 8.672 0.443 3.670 1.00 0.00 ATOM 976 CD1 ILE B 28 9.315 -1.086 1.126 1.00 0.00 ATOM 977 O ILE B 28 7.597 3.654 2.875 1.00 0.00 ATOM 978 C ILE B 28 7.336 2.458 2.667 1.00 0.00 ATOM 979 N ALA B 29 6.396 1.789 3.327 1.00 0.00 ATOM 980 CA ALA B 29 5.763 2.255 4.555 1.00 0.00 ATOM 981 CB ALA B 29 4.315 2.645 4.301 1.00 0.00 ATOM 982 O ALA B 29 6.193 -0.023 5.194 1.00 0.00 ATOM 983 C ALA B 29 5.832 1.097 5.562 1.00 0.00 ATOM 984 N GLY B 30 5.570 1.404 6.825 1.00 0.00 ATOM 985 CA GLY B 30 5.513 0.360 7.892 1.00 0.00 ATOM 986 O GLY B 30 7.899 0.668 8.140 1.00 0.00 ATOM 987 C GLY B 30 6.844 0.147 8.582 1.00 0.00 ATOM 988 N GLY B 31 6.831 -0.640 9.649 1.00 0.00 ATOM 989 CA GLY B 31 8.047 -0.813 10.418 1.00 0.00 ATOM 990 O GLY B 31 6.496 -0.377 12.183 1.00 0.00 ATOM 991 C GLY B 31 7.569 -0.894 11.850 1.00 0.00 ATOM 992 N VAL B 32 8.382 -1.609 12.679 1.00 0.00 ATOM 993 CA VAL B 32 8.113 -1.613 14.105 1.00 0.00 ATOM 994 CB VAL B 32 9.146 -2.438 14.907 1.00 0.00 ATOM 995 CG1 VAL B 32 8.827 -2.371 16.399 1.00 0.00 ATOM 996 CG2 VAL B 32 9.126 -3.885 14.445 1.00 0.00 ATOM 997 O VAL B 32 9.104 0.528 14.559 1.00 0.00 ATOM 998 C VAL B 32 8.122 -0.203 14.701 1.00 0.00 ATOM 999 N GLY B 33 6.992 0.182 15.378 1.00 0.00 ATOM 1000 CA GLY B 33 6.905 1.507 15.973 1.00 0.00 ATOM 1001 O GLY B 33 6.854 3.791 15.236 1.00 0.00 ATOM 1002 C GLY B 33 6.654 2.601 14.945 1.00 0.00 ATOM 1003 N SER B 34 6.190 2.208 13.745 1.00 0.00 ATOM 1004 CA SER B 34 5.853 3.156 12.649 1.00 0.00 ATOM 1005 CB SER B 34 5.563 2.394 11.353 1.00 0.00 ATOM 1006 OG SER B 34 4.366 1.644 11.460 1.00 0.00 ATOM 1007 O SER B 34 3.868 3.597 13.924 1.00 0.00 ATOM 1008 C SER B 34 4.611 3.967 13.011 1.00 0.00 ATOM 1009 N PRO B 35 4.379 5.123 12.337 1.00 0.00 ATOM 1010 CA PRO B 35 3.198 5.940 12.638 1.00 0.00 ATOM 1011 CB PRO B 35 3.249 7.013 11.552 1.00 0.00 ATOM 1012 CG PRO B 35 4.721 7.209 11.367 1.00 0.00 ATOM 1013 CD PRO B 35 5.228 5.784 11.331 1.00 0.00 ATOM 1014 O PRO B 35 0.954 5.501 13.227 1.00 0.00 ATOM 1015 C PRO B 35 1.893 5.152 12.541 1.00 0.00 ATOM 1016 N LEU B 36 1.823 4.123 11.694 1.00 0.00 ATOM 1017 CA LEU B 36 0.613 3.311 11.539 1.00 0.00 ATOM 1018 CB LEU B 36 0.579 2.667 10.150 1.00 0.00 ATOM 1019 CG LEU B 36 0.545 3.627 8.959 1.00 0.00 ATOM 1020 CD1 LEU B 36 0.618 2.859 7.647 1.00 0.00 ATOM 1021 CD2 LEU B 36 -0.741 4.440 8.963 1.00 0.00 ATOM 1022 O LEU B 36 -0.590 1.577 12.670 1.00 0.00 ATOM 1023 C LEU B 36 0.471 2.187 12.584 1.00 0.00 ATOM 1024 N GLY B 37 1.513 1.957 13.392 1.00 0.00 ATOM 1025 CA GLY B 37 1.527 0.853 14.378 1.00 0.00 ATOM 1026 O GLY B 37 3.731 0.446 13.526 1.00 0.00 ATOM 1027 C GLY B 37 2.773 0.012 14.175 1.00 0.00 ATOM 1028 N ASP B 38 2.816 -1.170 14.730 1.00 0.00 ATOM 1029 CA ASP B 38 3.905 -2.126 14.546 1.00 0.00 ATOM 1030 CB ASP B 38 3.938 -3.094 15.712 1.00 0.00 ATOM 1031 CG ASP B 38 5.161 -4.000 15.639 1.00 0.00 ATOM 1032 OD1 ASP B 38 5.637 -4.331 14.522 1.00 0.00 ATOM 1033 OD2 ASP B 38 5.650 -4.390 16.711 1.00 0.00 ATOM 1034 O ASP B 38 2.702 -3.850 13.358 1.00 0.00 ATOM 1035 C ASP B 38 3.526 -2.935 13.292 1.00 0.00 ATOM 1036 N VAL B 39 4.118 -2.535 12.204 1.00 0.00 ATOM 1037 CA VAL B 39 3.863 -3.182 10.911 1.00 0.00 ATOM 1038 CB VAL B 39 3.094 -2.200 9.925 1.00 0.00 ATOM 1039 CG1 VAL B 39 1.810 -1.567 10.465 1.00 0.00 ATOM 1040 CG2 VAL B 39 4.037 -1.109 9.415 1.00 0.00 ATOM 1041 O VAL B 39 6.195 -3.294 10.511 1.00 0.00 ATOM 1042 C VAL B 39 5.092 -3.776 10.283 1.00 0.00 ATOM 1043 N PRO B 40 4.900 -4.800 9.452 1.00 0.00 ATOM 1044 CA PRO B 40 5.934 -5.244 8.542 1.00 0.00 ATOM 1045 CB PRO B 40 5.359 -6.387 7.803 1.00 0.00 ATOM 1046 CG PRO B 40 4.485 -7.027 8.837 1.00 0.00 ATOM 1047 CD PRO B 40 3.829 -5.846 9.499 1.00 0.00 ATOM 1048 O PRO B 40 5.405 -3.199 7.344 1.00 0.00 ATOM 1049 C PRO B 40 6.173 -4.191 7.455 1.00 0.00 ATOM 1050 N ILE B 41 7.220 -4.403 6.679 1.00 0.00 ATOM 1051 CA ILE B 41 7.591 -3.449 5.611 1.00 0.00 ATOM 1052 CB ILE B 41 9.105 -3.532 5.341 1.00 0.00 ATOM 1053 CG1 ILE B 41 9.888 -3.352 6.643 1.00 0.00 ATOM 1054 CG2 ILE B 41 9.532 -2.443 4.368 1.00 0.00 ATOM 1055 CD1 ILE B 41 9.630 -2.031 7.335 1.00 0.00 ATOM 1056 O ILE B 41 6.763 -4.875 3.881 1.00 0.00 ATOM 1057 C ILE B 41 6.767 -3.749 4.367 1.00 0.00 ATOM 1058 N PHE B 42 6.027 -2.743 3.848 1.00 0.00 ATOM 1059 CA PHE B 42 5.203 -2.932 2.669 1.00 0.00 ATOM 1060 CB PHE B 42 3.765 -2.490 2.917 1.00 0.00 ATOM 1061 CG PHE B 42 2.986 -3.439 3.782 1.00 0.00 ATOM 1062 CD1 PHE B 42 3.185 -3.480 5.159 1.00 0.00 ATOM 1063 CD2 PHE B 42 2.024 -4.274 3.219 1.00 0.00 ATOM 1064 CE1 PHE B 42 2.431 -4.336 5.964 1.00 0.00 ATOM 1065 CE2 PHE B 42 1.267 -5.129 4.013 1.00 0.00 ATOM 1066 CZ PHE B 42 1.469 -5.161 5.383 1.00 0.00 ATOM 1067 O PHE B 42 5.727 -0.793 1.841 1.00 0.00 ATOM 1068 C PHE B 42 5.653 -1.989 1.588 1.00 0.00 ATOM 1069 N ILE B 43 5.676 -2.482 0.360 1.00 0.00 ATOM 1070 CA ILE B 43 5.797 -1.605 -0.803 1.00 0.00 ATOM 1071 CB ILE B 43 6.200 -2.443 -2.062 1.00 0.00 ATOM 1072 CG1 ILE B 43 7.564 -3.114 -1.852 1.00 0.00 ATOM 1073 CG2 ILE B 43 6.210 -1.566 -3.301 1.00 0.00 ATOM 1074 CD1 ILE B 43 7.970 -4.080 -2.969 1.00 0.00 ATOM 1075 O ILE B 43 3.420 -1.265 -0.909 1.00 0.00 ATOM 1076 C ILE B 43 4.550 -0.764 -0.959 1.00 0.00 ATOM 1077 N ALA B 44 4.739 0.607 -1.097 1.00 0.00 ATOM 1078 CA ALA B 44 3.659 1.543 -1.195 1.00 0.00 ATOM 1079 CB ALA B 44 3.872 2.738 -0.277 1.00 0.00 ATOM 1080 O ALA B 44 2.401 2.176 -3.200 1.00 0.00 ATOM 1081 C ALA B 44 3.507 2.086 -2.640 1.00 0.00 ATOM 1082 N MET B 45 4.567 2.384 -3.288 1.00 0.00 ATOM 1083 CA MET B 45 4.504 2.876 -4.654 1.00 0.00 ATOM 1084 CB MET B 45 4.563 4.395 -4.667 1.00 0.00 ATOM 1085 CG MET B 45 3.344 5.074 -4.054 1.00 0.00 ATOM 1086 SD MET B 45 3.602 6.981 -3.755 1.00 0.00 ATOM 1087 CE MET B 45 4.557 6.872 -2.062 1.00 0.00 ATOM 1088 O MET B 45 6.736 2.054 -4.855 1.00 0.00 ATOM 1089 C MET B 45 5.641 2.207 -5.401 1.00 0.00 ATOM 1090 N MET B 46 5.419 1.886 -6.681 1.00 0.00 ATOM 1091 CA MET B 46 6.450 1.360 -7.573 1.00 0.00 ATOM 1092 CB MET B 46 6.044 0.080 -8.273 1.00 0.00 ATOM 1093 CG MET B 46 5.609 -1.005 -7.317 1.00 0.00 ATOM 1094 SD MET B 46 5.246 -2.563 -8.122 1.00 0.00 ATOM 1095 CE MET B 46 6.933 -3.121 -8.480 1.00 0.00 ATOM 1096 O MET B 46 5.704 2.697 -9.415 1.00 0.00 ATOM 1097 C MET B 46 6.658 2.315 -8.739 1.00 0.00 ATOM 1098 N HIS B 47 7.905 2.665 -8.937 1.00 0.00 ATOM 1099 CA HIS B 47 8.257 3.569 -10.029 1.00 0.00 ATOM 1100 CB HIS B 47 9.642 4.207 -9.896 1.00 0.00 ATOM 1101 CG HIS B 47 9.849 4.995 -8.646 1.00 0.00 ATOM 1102 CD2 HIS B 47 8.979 5.469 -7.722 1.00 0.00 ATOM 1103 ND1 HIS B 47 11.083 5.458 -8.275 1.00 0.00 ATOM 1104 CE1 HIS B 47 10.984 6.138 -7.151 1.00 0.00 ATOM 1105 NE2 HIS B 47 9.713 6.169 -6.797 1.00 0.00 ATOM 1106 O HIS B 47 8.743 1.777 -11.561 1.00 0.00 ATOM 1107 C HIS B 47 8.207 2.873 -11.378 1.00 0.00 ATOM 1108 N PRO B 48 7.545 3.534 -12.317 1.00 0.00 ATOM 1109 CA PRO B 48 7.381 3.032 -13.671 1.00 0.00 ATOM 1110 CB PRO B 48 6.585 4.130 -14.378 1.00 0.00 ATOM 1111 CG PRO B 48 5.777 4.764 -13.294 1.00 0.00 ATOM 1112 CD PRO B 48 6.661 4.793 -12.080 1.00 0.00 ATOM 1113 O PRO B 48 9.657 3.677 -14.224 1.00 0.00 ATOM 1114 C PRO B 48 8.760 2.819 -14.355 1.00 0.00 ATOM 1115 N THR B 49 8.854 1.679 -14.983 1.00 0.00 ATOM 1116 CA THR B 49 10.089 1.279 -15.679 1.00 0.00 ATOM 1117 CB THR B 49 10.275 2.215 -16.879 1.00 0.00 ATOM 1118 CG2 THR B 49 9.091 2.082 -17.827 1.00 0.00 ATOM 1119 OG1 THR B 49 10.373 3.572 -16.429 1.00 0.00 ATOM 1120 O THR B 49 12.469 1.124 -15.423 1.00 0.00 ATOM 1121 C THR B 49 11.367 1.073 -14.872 1.00 0.00 ATOM 1122 N GLY B 50 11.278 0.875 -13.604 1.00 0.00 ATOM 1123 CA GLY B 50 12.444 0.671 -12.767 1.00 0.00 ATOM 1124 O GLY B 50 11.904 -1.613 -13.177 1.00 0.00 ATOM 1125 C GLY B 50 12.594 -0.827 -12.541 1.00 0.00 ATOM 1126 N VAL B 51 13.447 -1.218 -11.570 1.00 0.00 ATOM 1127 CA VAL B 51 13.674 -2.648 -11.327 1.00 0.00 ATOM 1128 CB VAL B 51 14.820 -2.847 -10.327 1.00 0.00 ATOM 1129 CG1 VAL B 51 15.001 -4.286 -9.881 1.00 0.00 ATOM 1130 CG2 VAL B 51 16.143 -2.329 -10.915 1.00 0.00 ATOM 1131 O VAL B 51 12.107 -4.436 -11.344 1.00 0.00 ATOM 1132 C VAL B 51 12.447 -3.372 -10.829 1.00 0.00 ATOM 1133 N ALA B 52 11.752 -2.826 -9.812 1.00 0.00 ATOM 1134 CA ALA B 52 10.600 -3.486 -9.229 1.00 0.00 ATOM 1135 CB ALA B 52 10.033 -2.666 -8.079 1.00 0.00 ATOM 1136 O ALA B 52 8.975 -4.776 -10.393 1.00 0.00 ATOM 1137 C ALA B 52 9.527 -3.683 -10.280 1.00 0.00 ATOM 1138 N ALA B 53 9.231 -2.629 -11.033 1.00 0.00 ATOM 1139 CA ALA B 53 8.193 -2.670 -12.063 1.00 0.00 ATOM 1140 CB ALA B 53 8.059 -1.308 -12.730 1.00 0.00 ATOM 1141 O ALA B 53 7.677 -4.347 -13.706 1.00 0.00 ATOM 1142 C ALA B 53 8.552 -3.691 -13.141 1.00 0.00 ATOM 1143 N GLN B 54 9.845 -3.817 -13.430 1.00 0.00 ATOM 1144 CA GLN B 54 10.303 -4.751 -14.453 1.00 0.00 ATOM 1145 CB GLN B 54 11.818 -4.650 -14.632 1.00 0.00 ATOM 1146 CG GLN B 54 12.282 -3.364 -15.296 1.00 0.00 ATOM 1147 CD GLN B 54 13.791 -3.283 -15.421 1.00 0.00 ATOM 1148 OE1 GLN B 54 14.504 -4.216 -15.051 1.00 0.00 ATOM 1149 NE2 GLN B 54 14.279 -2.167 -15.946 1.00 0.00 ATOM 1150 O GLN B 54 9.774 -7.008 -15.042 1.00 0.00 ATOM 1151 C GLN B 54 9.961 -6.206 -14.134 1.00 0.00 ATOM 1152 N THR B 55 9.858 -6.552 -12.854 1.00 0.00 ATOM 1153 CA THR B 55 9.536 -7.934 -12.489 1.00 0.00 ATOM 1154 CB THR B 55 9.654 -8.206 -10.984 1.00 0.00 ATOM 1155 CG2 THR B 55 11.052 -7.903 -10.492 1.00 0.00 ATOM 1156 OG1 THR B 55 8.589 -7.587 -10.250 1.00 0.00 ATOM 1157 O THR B 55 7.845 -9.567 -12.963 1.00 0.00 ATOM 1158 C THR B 55 8.114 -8.367 -12.840 1.00 0.00 ATOM 1159 N GLN B 56 7.217 -7.399 -13.023 1.00 0.00 ATOM 1160 CA GLN B 56 5.809 -7.699 -13.304 1.00 0.00 ATOM 1161 CB GLN B 56 5.924 -8.057 -14.973 1.00 0.00 ATOM 1162 CG GLN B 56 7.175 -7.566 -15.616 1.00 0.00 ATOM 1163 CD GLN B 56 7.665 -8.517 -16.658 1.00 0.00 ATOM 1164 OE1 GLN B 56 8.283 -9.556 -16.358 1.00 0.00 ATOM 1165 NE2 GLN B 56 7.375 -8.186 -17.915 1.00 0.00 ATOM 1166 O GLN B 56 4.176 -9.212 -12.417 1.00 0.00 ATOM 1167 C GLN B 56 5.202 -8.560 -12.183 1.00 0.00 ATOM 1168 N LYS B 57 5.891 -8.617 -11.048 1.00 0.00 ATOM 1169 CA LYS B 57 5.460 -9.506 -9.977 1.00 0.00 ATOM 1170 CB LYS B 57 6.513 -10.608 -9.846 1.00 0.00 ATOM 1171 CG LYS B 57 6.626 -11.506 -11.068 1.00 0.00 ATOM 1172 CD LYS B 57 7.686 -12.578 -10.871 1.00 0.00 ATOM 1173 CE LYS B 57 7.918 -13.368 -12.148 1.00 0.00 ATOM 1174 NZ LYS B 57 8.899 -14.468 -11.949 1.00 0.00 ATOM 1175 O LYS B 57 4.381 -9.303 -7.844 1.00 0.00 ATOM 1176 C LYS B 57 5.092 -8.769 -8.701 1.00 0.00 ATOM 1177 N LEU B 58 5.732 -7.668 -8.495 1.00 0.00 ATOM 1178 CA LEU B 58 5.514 -6.933 -7.263 1.00 0.00 ATOM 1179 CB LEU B 58 6.802 -6.177 -6.926 1.00 0.00 ATOM 1180 CG LEU B 58 8.068 -7.024 -6.791 1.00 0.00 ATOM 1181 CD1 LEU B 58 9.286 -6.139 -6.579 1.00 0.00 ATOM 1182 CD2 LEU B 58 7.958 -7.974 -5.609 1.00 0.00 ATOM 1183 O LEU B 58 3.903 -5.591 -8.578 1.00 0.00 ATOM 1184 C LEU B 58 4.284 -6.030 -7.452 1.00 0.00 ATOM 1185 N ARG B 59 3.691 -5.698 -6.281 1.00 0.00 ATOM 1186 CA ARG B 59 2.545 -4.851 -6.212 1.00 0.00 ATOM 1187 CB ARG B 59 1.256 -5.708 -6.120 1.00 0.00 ATOM 1188 CG ARG B 59 -0.052 -4.978 -5.795 1.00 0.00 ATOM 1189 CD ARG B 59 -0.589 -4.187 -6.976 1.00 0.00 ATOM 1190 NE ARG B 59 -2.033 -3.972 -6.889 1.00 0.00 ATOM 1191 CZ ARG B 59 -2.948 -4.829 -7.337 1.00 0.00 ATOM 1192 NH1 ARG B 59 -2.581 -5.974 -7.900 1.00 0.00 ATOM 1193 NH2 ARG B 59 -4.233 -4.518 -7.286 1.00 0.00 ATOM 1194 O ARG B 59 3.021 -4.416 -3.908 1.00 0.00 ATOM 1195 C ARG B 59 2.476 -4.029 -4.939 1.00 0.00 ATOM 1196 N VAL B 60 1.864 -2.855 -5.044 1.00 0.00 ATOM 1197 CA VAL B 60 1.671 -1.991 -3.892 1.00 0.00 ATOM 1198 CB VAL B 60 0.992 -0.681 -4.313 1.00 0.00 ATOM 1199 CG1 VAL B 60 0.663 0.127 -3.100 1.00 0.00 ATOM 1200 CG2 VAL B 60 1.920 0.106 -5.228 1.00 0.00 ATOM 1201 O VAL B 60 -0.130 -3.509 -3.421 1.00 0.00 ATOM 1202 C VAL B 60 0.783 -2.812 -2.965 1.00 0.00 ATOM 1203 N GLY B 61 1.080 -2.774 -1.672 1.00 0.00 ATOM 1204 CA GLY B 61 0.305 -3.536 -0.711 1.00 0.00 ATOM 1205 O GLY B 61 0.784 -5.325 0.809 1.00 0.00 ATOM 1206 C GLY B 61 1.042 -4.794 -0.272 1.00 0.00 ATOM 1207 N ASP B 62 2.035 -5.222 -1.069 1.00 0.00 ATOM 1208 CA ASP B 62 2.813 -6.412 -0.706 1.00 0.00 ATOM 1209 CB ASP B 62 3.732 -6.794 -1.870 1.00 0.00 ATOM 1210 CG ASP B 62 2.970 -7.345 -3.057 1.00 0.00 ATOM 1211 OD1 ASP B 62 1.768 -7.648 -2.905 1.00 0.00 ATOM 1212 OD2 ASP B 62 3.574 -7.477 -4.142 1.00 0.00 ATOM 1213 O ASP B 62 4.242 -5.012 0.632 1.00 0.00 ATOM 1214 C ASP B 62 3.665 -6.106 0.517 1.00 0.00 ATOM 1215 N ARG B 63 3.742 -7.076 1.406 1.00 0.00 ATOM 1216 CA ARG B 63 4.573 -6.945 2.604 1.00 0.00 ATOM 1217 CB ARG B 63 4.039 -7.802 3.705 1.00 0.00 ATOM 1218 CG ARG B 63 4.994 -7.980 4.865 1.00 0.00 ATOM 1219 CD ARG B 63 4.520 -8.896 5.953 1.00 0.00 ATOM 1220 NE ARG B 63 3.236 -8.453 6.468 1.00 0.00 ATOM 1221 CZ ARG B 63 2.367 -9.218 7.089 1.00 0.00 ATOM 1222 NH1 ARG B 63 2.601 -10.485 7.343 1.00 0.00 ATOM 1223 NH2 ARG B 63 1.213 -8.675 7.460 1.00 0.00 ATOM 1224 O ARG B 63 5.910 -8.657 1.588 1.00 0.00 ATOM 1225 C ARG B 63 5.895 -7.604 2.223 1.00 0.00 ATOM 1226 N ILE B 64 7.016 -6.970 2.566 1.00 0.00 ATOM 1227 CA ILE B 64 8.321 -7.530 2.274 1.00 0.00 ATOM 1228 CB ILE B 64 9.364 -6.432 1.992 1.00 0.00 ATOM 1229 CG1 ILE B 64 8.952 -5.607 0.772 1.00 0.00 ATOM 1230 CG2 ILE B 64 10.728 -7.050 1.719 1.00 0.00 ATOM 1231 CD1 ILE B 64 9.798 -4.371 0.557 1.00 0.00 ATOM 1232 O ILE B 64 8.648 -7.779 4.636 1.00 0.00 ATOM 1233 C ILE B 64 8.649 -8.326 3.533 1.00 0.00 ATOM 1234 N VAL B 65 8.857 -9.628 3.377 1.00 0.00 ATOM 1235 CA VAL B 65 9.128 -10.489 4.524 1.00 0.00 ATOM 1236 CB VAL B 65 8.268 -11.755 4.533 1.00 0.00 ATOM 1237 CG1 VAL B 65 6.837 -11.407 4.697 1.00 0.00 ATOM 1238 CG2 VAL B 65 8.391 -12.514 3.264 1.00 0.00 ATOM 1239 O VAL B 65 11.062 -11.197 5.720 1.00 0.00 ATOM 1240 C VAL B 65 10.589 -10.904 4.631 1.00 0.00 ATOM 1241 N THR B 66 11.277 -10.971 3.516 1.00 0.00 ATOM 1242 CA THR B 66 12.691 -11.331 3.545 1.00 0.00 ATOM 1243 CB THR B 66 12.836 -12.861 3.437 1.00 0.00 ATOM 1244 CG2 THR B 66 14.297 -13.267 3.558 1.00 0.00 ATOM 1245 OG1 THR B 66 12.091 -13.489 4.486 1.00 0.00 ATOM 1246 O THR B 66 12.955 -10.729 1.239 1.00 0.00 ATOM 1247 C THR B 66 13.444 -10.675 2.383 1.00 0.00 ATOM 1248 N ILE B 67 14.649 -10.258 2.652 1.00 0.00 ATOM 1249 CA ILE B 67 15.569 -9.747 1.611 1.00 0.00 ATOM 1250 CB ILE B 67 15.856 -8.264 1.906 1.00 0.00 ATOM 1251 CG1 ILE B 67 14.551 -7.464 1.937 1.00 0.00 ATOM 1252 CG2 ILE B 67 16.758 -7.673 0.834 1.00 0.00 ATOM 1253 CD1 ILE B 67 14.728 -6.026 2.372 1.00 0.00 ATOM 1254 O ILE B 67 17.632 -10.432 2.576 1.00 0.00 ATOM 1255 C ILE B 67 16.865 -10.543 1.617 1.00 0.00 ATOM 1256 N CYS B 68 17.157 -11.275 0.569 1.00 0.00 ATOM 1257 CA CYS B 68 18.357 -12.088 0.512 1.00 0.00 ATOM 1258 CB CYS B 68 19.610 -11.218 0.392 1.00 0.00 ATOM 1259 SG CYS B 68 19.689 -10.229 -1.120 1.00 0.00 ATOM 1260 O CYS B 68 19.634 -13.205 2.222 1.00 0.00 ATOM 1261 C CYS B 68 18.526 -13.012 1.721 1.00 0.00 ATOM 1262 N GLY B 69 17.419 -13.565 2.200 1.00 0.00 ATOM 1263 CA GLY B 69 17.478 -14.482 3.328 1.00 0.00 ATOM 1264 O GLY B 69 17.193 -14.460 5.700 1.00 0.00 ATOM 1265 C GLY B 69 17.345 -13.796 4.672 1.00 0.00 ATOM 1266 N THR B 70 17.399 -12.472 4.676 1.00 0.00 ATOM 1267 CA THR B 70 17.277 -11.730 5.919 1.00 0.00 ATOM 1268 CB THR B 70 17.994 -10.371 5.841 1.00 0.00 ATOM 1269 CG2 THR B 70 17.827 -9.607 7.145 1.00 0.00 ATOM 1270 OG1 THR B 70 19.390 -10.577 5.597 1.00 0.00 ATOM 1271 O THR B 70 15.108 -10.798 5.471 1.00 0.00 ATOM 1272 C THR B 70 15.810 -11.463 6.232 1.00 0.00 ATOM 1273 N SER B 71 15.359 -11.977 7.367 1.00 0.00 ATOM 1274 CA SER B 71 13.976 -11.818 7.793 1.00 0.00 ATOM 1275 CB SER B 71 13.654 -12.785 8.944 1.00 0.00 ATOM 1276 OG SER B 71 13.840 -14.141 8.534 1.00 0.00 ATOM 1277 O SER B 71 14.291 -9.795 9.051 1.00 0.00 ATOM 1278 C SER B 71 13.626 -10.390 8.205 1.00 0.00 ATOM 1279 N THR B 72 12.565 -9.847 7.616 1.00 0.00 ATOM 1280 CA THR B 72 12.124 -8.491 7.926 1.00 0.00 ATOM 1281 CB THR B 72 12.172 -7.583 6.684 1.00 0.00 ATOM 1282 CG2 THR B 72 13.597 -7.459 6.169 1.00 0.00 ATOM 1283 OG1 THR B 72 11.351 -8.140 5.651 1.00 0.00 ATOM 1284 O THR B 72 10.066 -7.421 8.509 1.00 0.00 ATOM 1285 C THR B 72 10.687 -8.480 8.437 1.00 0.00 ATOM 1286 N GLU B 73 10.155 -9.651 8.778 1.00 0.00 ATOM 1287 CA GLU B 73 8.774 -9.745 9.245 1.00 0.00 ATOM 1288 CB GLU B 73 8.414 -11.199 9.557 1.00 0.00 ATOM 1289 CG GLU B 73 8.269 -12.081 8.327 1.00 0.00 ATOM 1290 CD GLU B 73 7.997 -13.530 8.678 1.00 0.00 ATOM 1291 OE1 GLU B 73 8.012 -13.862 9.882 1.00 0.00 ATOM 1292 OE2 GLU B 73 7.774 -14.334 7.748 1.00 0.00 ATOM 1293 O GLU B 73 7.334 -8.646 10.809 1.00 0.00 ATOM 1294 C GLU B 73 8.487 -8.942 10.512 1.00 0.00 ATOM 1295 N GLY B 74 9.524 -8.608 11.271 1.00 0.00 ATOM 1296 CA GLY B 74 9.320 -7.827 12.489 1.00 0.00 ATOM 1297 O GLY B 74 10.712 -6.246 13.650 1.00 0.00 ATOM 1298 C GLY B 74 10.333 -6.689 12.569 1.00 0.00 ATOM 1299 N MET B 75 10.794 -6.243 11.406 1.00 0.00 ATOM 1300 CA MET B 75 11.774 -5.169 11.340 1.00 0.00 ATOM 1301 CB MET B 75 12.455 -5.154 9.971 1.00 0.00 ATOM 1302 CG MET B 75 13.263 -6.405 9.666 1.00 0.00 ATOM 1303 SD MET B 75 14.698 -6.587 10.741 1.00 0.00 ATOM 1304 CE MET B 75 14.109 -7.832 11.887 1.00 0.00 ATOM 1305 O MET B 75 10.004 -3.549 11.232 1.00 0.00 ATOM 1306 C MET B 75 11.179 -3.785 11.533 1.00 0.00 ATOM 1307 N THR B 76 11.990 -2.883 12.077 1.00 0.00 ATOM 1308 CA THR B 76 11.582 -1.497 12.268 1.00 0.00 ATOM 1309 CB THR B 76 12.453 -0.800 13.331 1.00 0.00 ATOM 1310 CG2 THR B 76 12.402 -1.564 14.645 1.00 0.00 ATOM 1311 OG1 THR B 76 13.812 -0.747 12.879 1.00 0.00 ATOM 1312 O THR B 76 12.379 -1.463 9.984 1.00 0.00 ATOM 1313 C THR B 76 11.703 -0.913 10.867 1.00 0.00 ATOM 1314 N HIS B 77 11.140 0.279 10.642 1.00 0.00 ATOM 1315 CA HIS B 77 11.334 0.937 9.360 1.00 0.00 ATOM 1316 CB HIS B 77 10.619 2.318 9.490 1.00 0.00 ATOM 1317 CG HIS B 77 10.711 3.178 8.268 1.00 0.00 ATOM 1318 CD2 HIS B 77 11.715 3.964 7.809 1.00 0.00 ATOM 1319 ND1 HIS B 77 9.674 3.318 7.379 1.00 0.00 ATOM 1320 CE1 HIS B 77 10.028 4.184 6.428 1.00 0.00 ATOM 1321 NE2 HIS B 77 11.274 4.586 6.662 1.00 0.00 ATOM 1322 O HIS B 77 13.237 0.832 7.880 1.00 0.00 ATOM 1323 C HIS B 77 12.826 1.062 9.021 1.00 0.00 ATOM 1324 N THR B 78 13.614 1.521 9.986 1.00 0.00 ATOM 1325 CA THR B 78 15.048 1.699 9.776 1.00 0.00 ATOM 1326 CB THR B 78 15.744 2.212 11.050 1.00 0.00 ATOM 1327 CG2 THR B 78 17.242 2.350 10.816 1.00 0.00 ATOM 1328 OG1 THR B 78 15.211 3.494 11.406 1.00 0.00 ATOM 1329 O THR B 78 16.618 0.413 8.516 1.00 0.00 ATOM 1330 C THR B 78 15.784 0.412 9.413 1.00 0.00 ATOM 1331 N GLN B 79 15.505 -0.689 10.122 1.00 0.00 ATOM 1332 CA GLN B 79 16.158 -1.962 9.821 1.00 0.00 ATOM 1333 CB GLN B 79 15.656 -3.073 10.704 1.00 0.00 ATOM 1334 CG GLN B 79 16.072 -2.901 12.154 1.00 0.00 ATOM 1335 CD GLN B 79 15.425 -3.902 13.072 1.00 0.00 ATOM 1336 OE1 GLN B 79 14.289 -3.727 13.491 1.00 0.00 ATOM 1337 NE2 GLN B 79 16.150 -4.961 13.404 1.00 0.00 ATOM 1338 O GLN B 79 16.680 -2.921 7.680 1.00 0.00 ATOM 1339 C GLN B 79 15.825 -2.406 8.397 1.00 0.00 ATOM 1340 N ALA B 80 14.583 -2.188 7.978 1.00 0.00 ATOM 1341 CA ALA B 80 14.159 -2.560 6.633 1.00 0.00 ATOM 1342 CB ALA B 80 12.745 -2.199 6.365 1.00 0.00 ATOM 1343 O ALA B 80 15.316 -2.256 4.555 1.00 0.00 ATOM 1344 C ALA B 80 14.905 -1.736 5.590 1.00 0.00 ATOM 1345 N VAL B 81 15.053 -0.443 5.852 1.00 0.00 ATOM 1346 CA VAL B 81 15.744 0.438 4.923 1.00 0.00 ATOM 1347 CB VAL B 81 15.712 1.895 5.419 1.00 0.00 ATOM 1348 CG1 VAL B 81 16.622 2.768 4.568 1.00 0.00 ATOM 1349 CG2 VAL B 81 14.298 2.454 5.341 1.00 0.00 ATOM 1350 O VAL B 81 17.746 0.001 3.675 1.00 0.00 ATOM 1351 C VAL B 81 17.210 0.033 4.780 1.00 0.00 ATOM 1352 N ASN B 82 17.846 -0.310 5.896 1.00 0.00 ATOM 1353 CA ASN B 82 19.249 -0.703 5.866 1.00 0.00 ATOM 1354 CB ASN B 82 19.830 -0.795 7.255 1.00 0.00 ATOM 1355 CG ASN B 82 19.851 0.558 7.943 1.00 0.00 ATOM 1356 ND2 ASN B 82 19.985 0.561 9.256 1.00 0.00 ATOM 1357 OD1 ASN B 82 19.760 1.594 7.283 1.00 0.00 ATOM 1358 O ASN B 82 20.367 -2.141 4.314 1.00 0.00 ATOM 1359 C ASN B 82 19.446 -2.010 5.104 1.00 0.00 ATOM 1360 N LEU B 83 18.550 -2.958 5.331 1.00 0.00 ATOM 1361 CA LEU B 83 18.622 -4.251 4.647 1.00 0.00 ATOM 1362 CB LEU B 83 17.520 -5.188 5.142 1.00 0.00 ATOM 1363 CG LEU B 83 17.657 -5.697 6.579 1.00 0.00 ATOM 1364 CD1 LEU B 83 16.413 -6.463 7.000 1.00 0.00 ATOM 1365 CD2 LEU B 83 18.854 -6.624 6.708 1.00 0.00 ATOM 1366 O LEU B 83 19.261 -4.543 2.348 1.00 0.00 ATOM 1367 C LEU B 83 18.467 -4.034 3.147 1.00 0.00 ATOM 1368 N LEU B 84 17.464 -3.252 2.748 1.00 0.00 ATOM 1369 CA LEU B 84 17.256 -3.005 1.321 1.00 0.00 ATOM 1370 CB LEU B 84 15.956 -2.231 1.054 1.00 0.00 ATOM 1371 CG LEU B 84 14.723 -3.130 1.081 1.00 0.00 ATOM 1372 CD1 LEU B 84 13.462 -2.335 1.272 1.00 0.00 ATOM 1373 CD2 LEU B 84 14.636 -3.974 -0.244 1.00 0.00 ATOM 1374 O LEU B 84 18.816 -2.475 -0.426 1.00 0.00 ATOM 1375 C LEU B 84 18.376 -2.187 0.687 1.00 0.00 ATOM 1376 N LYS B 85 18.897 -1.225 1.435 1.00 0.00 ATOM 1377 CA LYS B 85 19.969 -0.367 0.942 1.00 0.00 ATOM 1378 CB LYS B 85 20.302 0.718 1.968 1.00 0.00 ATOM 1379 CG LYS B 85 21.352 1.711 1.501 1.00 0.00 ATOM 1380 CD LYS B 85 21.562 2.813 2.527 1.00 0.00 ATOM 1381 CE LYS B 85 22.607 3.813 2.058 1.00 0.00 ATOM 1382 NZ LYS B 85 22.812 4.910 3.045 1.00 0.00 ATOM 1383 O LYS B 85 22.007 -0.781 -0.247 1.00 0.00 ATOM 1384 C LYS B 85 21.267 -1.119 0.681 1.00 0.00 ATOM 1385 N ASN B 86 21.506 -2.210 1.418 1.00 0.00 ATOM 1386 CA ASN B 86 22.727 -2.986 1.259 1.00 0.00 ATOM 1387 CB ASN B 86 23.149 -3.596 2.598 1.00 0.00 ATOM 1388 CG ASN B 86 23.662 -2.558 3.576 1.00 0.00 ATOM 1389 ND2 ASN B 86 23.550 -2.857 4.866 1.00 0.00 ATOM 1390 OD1 ASN B 86 24.150 -1.503 3.176 1.00 0.00 ATOM 1391 O ASN B 86 23.744 -4.720 -0.049 1.00 0.00 ATOM 1392 C ASN B 86 22.733 -4.052 0.172 1.00 0.00 ATOM 1393 N ALA B 87 21.617 -4.209 -0.524 1.00 0.00 ATOM 1394 CA ALA B 87 21.491 -5.218 -1.571 1.00 0.00 ATOM 1395 CB ALA B 87 20.029 -5.383 -1.954 1.00 0.00 ATOM 1396 O ALA B 87 22.616 -3.789 -3.148 1.00 0.00 ATOM 1397 C ALA B 87 22.298 -4.941 -2.840 1.00 0.00 ATOM 1398 N SER B 88 22.624 -6.006 -3.564 1.00 0.00 ATOM 1399 CA SER B 88 23.385 -5.869 -4.793 1.00 0.00 ATOM 1400 CB SER B 88 24.373 -7.025 -4.951 1.00 0.00 ATOM 1401 OG SER B 88 23.693 -8.262 -5.084 1.00 0.00 ATOM 1402 O SER B 88 21.339 -5.651 -5.987 1.00 0.00 ATOM 1403 C SER B 88 22.539 -5.896 -6.038 1.00 0.00 ATOM 1404 N GLY B 89 23.192 -6.052 -7.182 1.00 0.00 ATOM 1405 CA GLY B 89 22.460 -6.096 -8.433 1.00 0.00 ATOM 1406 O GLY B 89 20.292 -6.950 -9.004 1.00 0.00 ATOM 1407 C GLY B 89 21.348 -7.134 -8.398 1.00 0.00 ATOM 1408 N SER B 90 21.674 -8.259 -7.619 1.00 0.00 ATOM 1409 CA SER B 90 20.740 -9.372 -7.522 1.00 0.00 ATOM 1410 CB SER B 90 21.449 -10.688 -7.831 1.00 0.00 ATOM 1411 OG SER B 90 20.562 -11.775 -7.614 1.00 0.00 ATOM 1412 O SER B 90 20.693 -9.758 -5.154 1.00 0.00 ATOM 1413 C SER B 90 20.070 -9.398 -6.153 1.00 0.00 ATOM 1414 N ILE B 91 18.809 -8.982 -6.110 1.00 0.00 ATOM 1415 CA ILE B 91 18.060 -8.930 -4.859 1.00 0.00 ATOM 1416 CB ILE B 91 17.571 -7.497 -4.526 1.00 0.00 ATOM 1417 CG1 ILE B 91 18.646 -6.458 -4.739 1.00 0.00 ATOM 1418 CG2 ILE B 91 17.142 -7.410 -3.055 1.00 0.00 ATOM 1419 CD1 ILE B 91 18.083 -5.065 -4.493 1.00 0.00 ATOM 1420 O ILE B 91 15.901 -9.698 -5.582 1.00 0.00 ATOM 1421 C ILE B 91 16.877 -9.892 -4.847 1.00 0.00 ATOM 1422 N GLU B 92 16.956 -10.929 -4.005 1.00 0.00 ATOM 1423 CA GLU B 92 15.884 -11.911 -3.893 1.00 0.00 ATOM 1424 CB GLU B 92 16.469 -13.303 -3.645 1.00 0.00 ATOM 1425 CG GLU B 92 15.426 -14.401 -3.517 1.00 0.00 ATOM 1426 CD GLU B 92 16.041 -15.762 -3.259 1.00 0.00 ATOM 1427 OE1 GLU B 92 17.285 -15.845 -3.178 1.00 0.00 ATOM 1428 OE2 GLU B 92 15.280 -16.745 -3.137 1.00 0.00 ATOM 1429 O GLU B 92 15.376 -11.496 -1.584 1.00 0.00 ATOM 1430 C GLU B 92 14.958 -11.551 -2.736 1.00 0.00 ATOM 1431 N MET B 93 13.699 -11.278 -3.051 1.00 0.00 ATOM 1432 CA MET B 93 12.736 -10.905 -2.026 1.00 0.00 ATOM 1433 CB MET B 93 11.995 -9.636 -2.437 1.00 0.00 ATOM 1434 CG MET B 93 12.893 -8.461 -2.810 1.00 0.00 ATOM 1435 SD MET B 93 13.822 -7.760 -1.428 1.00 0.00 ATOM 1436 CE MET B 93 12.660 -6.535 -0.833 1.00 0.00 ATOM 1437 O MET B 93 11.080 -12.443 -2.801 1.00 0.00 ATOM 1438 C MET B 93 11.635 -11.928 -1.831 1.00 0.00 ATOM 1439 N GLN B 94 11.258 -12.136 -0.575 1.00 0.00 ATOM 1440 CA GLN B 94 10.150 -13.015 -0.243 1.00 0.00 ATOM 1441 CB GLN B 94 10.509 -14.107 0.735 1.00 0.00 ATOM 1442 CG GLN B 94 9.468 -15.219 0.545 1.00 0.00 ATOM 1443 CD GLN B 94 10.111 -16.597 0.396 1.00 0.00 ATOM 1444 OE1 GLN B 94 9.493 -17.526 -0.141 1.00 0.00 ATOM 1445 NE2 GLN B 94 11.365 -16.705 0.808 1.00 0.00 ATOM 1446 O GLN B 94 9.318 -11.219 1.099 1.00 0.00 ATOM 1447 C GLN B 94 9.076 -12.049 0.221 1.00 0.00 ATOM 1448 N VAL B 95 7.919 -12.086 -0.420 1.00 0.00 ATOM 1449 CA VAL B 95 6.877 -11.098 -0.184 1.00 0.00 ATOM 1450 CB VAL B 95 6.707 -10.048 -1.297 1.00 0.00 ATOM 1451 CG1 VAL B 95 7.971 -9.210 -1.436 1.00 0.00 ATOM 1452 CG2 VAL B 95 6.431 -10.724 -2.631 1.00 0.00 ATOM 1453 O VAL B 95 5.418 -12.975 -0.458 1.00 0.00 ATOM 1454 C VAL B 95 5.538 -11.806 -0.095 1.00 0.00 ATOM 1455 N VAL B 96 4.547 -11.105 0.444 1.00 0.00 ATOM 1456 CA VAL B 96 3.218 -11.668 0.602 1.00 0.00 ATOM 1457 CB VAL B 96 3.106 -12.366 1.969 1.00 0.00 ATOM 1458 CG1 VAL B 96 3.348 -11.375 3.096 1.00 0.00 ATOM 1459 CG2 VAL B 96 1.718 -12.965 2.150 1.00 0.00 ATOM 1460 O VAL B 96 2.350 -9.461 0.963 1.00 0.00 ATOM 1461 C VAL B 96 2.147 -10.586 0.507 1.00 0.00 ATOM 1462 N ALA B 97 1.044 -10.906 -0.157 1.00 0.00 ATOM 1463 CA ALA B 97 -0.051 -9.956 -0.319 1.00 0.00 ATOM 1464 CB ALA B 97 -0.976 -10.387 -1.412 1.00 0.00 ATOM 1465 O ALA B 97 -2.077 -9.557 0.947 1.00 0.00 ATOM 1466 C ALA B 97 -0.854 -9.425 0.841 1.00 0.00 ATOM 1467 N GLY B 98 -0.314 -8.719 1.710 1.00 0.00 ATOM 1468 CA GLY B 98 -0.888 -8.136 2.913 1.00 0.00 ATOM 1469 O GLY B 98 -1.925 -8.708 4.979 1.00 0.00 ATOM 1470 C GLY B 98 -1.417 -9.115 3.950 1.00 0.00 ATOM 1471 N GLY B 99 -1.442 -10.379 3.621 1.00 0.00 ATOM 1472 CA GLY B 99 -1.802 -11.393 4.594 1.00 0.00 ATOM 1473 O GLY B 99 -4.062 -11.708 3.863 1.00 0.00 ATOM 1474 C GLY B 99 -3.066 -12.204 4.386 1.00 0.00 ATOM 1475 N ASP B 100 -3.023 -13.501 4.893 1.00 0.00 ATOM 1476 CA ASP B 100 -4.182 -14.377 4.776 1.00 0.00 ATOM 1477 CB ASP B 100 -5.090 -14.392 3.850 1.00 0.00 ATOM 1478 CG ASP B 100 -6.281 -13.654 4.421 1.00 0.00 ATOM 1479 OD1 ASP B 100 -6.315 -13.349 5.633 1.00 0.00 ATOM 1480 OD2 ASP B 100 -7.209 -13.373 3.634 1.00 0.00 ATOM 1481 O ASP B 100 -2.933 -16.467 5.025 1.00 0.00 ATOM 1482 C ASP B 100 -3.928 -15.790 5.297 1.00 0.00 ATOM 1483 N VAL B 101 -4.977 -16.235 5.980 1.00 0.00 ATOM 1484 CA VAL B 101 -4.993 -17.562 6.586 1.00 0.00 ATOM 1485 CB VAL B 101 -6.309 -17.807 7.392 1.00 0.00 ATOM 1486 CG1 VAL B 101 -6.319 -19.229 7.984 1.00 0.00 ATOM 1487 CG2 VAL B 101 -6.410 -16.781 8.534 1.00 0.00 ATOM 1488 O VAL B 101 -3.882 -19.504 5.762 1.00 0.00 ATOM 1489 C VAL B 101 -4.779 -18.683 5.591 1.00 0.00 ATOM 1490 N SER B 102 -5.568 -18.680 4.528 1.00 0.00 ATOM 1491 CA SER B 102 -5.453 -19.701 3.485 1.00 0.00 ATOM 1492 CB SER B 102 -6.561 -19.517 2.458 1.00 0.00 ATOM 1493 OG SER B 102 -6.408 -18.300 1.737 1.00 0.00 ATOM 1494 O SER B 102 -3.697 -20.707 2.196 1.00 0.00 ATOM 1495 C SER B 102 -4.112 -19.688 2.751 1.00 0.00 ATOM 1496 N GLU B 103 -3.399 -18.565 2.829 1.00 0.00 ATOM 1497 CA GLU B 103 -2.118 -18.435 2.153 1.00 0.00 ATOM 1498 CB GLU B 103 -2.357 -17.353 0.974 1.00 0.00 ATOM 1499 CG GLU B 103 -3.269 -17.809 -0.167 1.00 0.00 ATOM 1500 CD GLU B 103 -2.842 -19.136 -0.774 1.00 0.00 ATOM 1501 OE1 GLU B 103 -1.626 -19.362 -0.934 1.00 0.00 ATOM 1502 OE2 GLU B 103 -3.725 -19.953 -1.107 1.00 0.00 ATOM 1503 O GLU B 103 0.257 -18.475 2.615 1.00 0.00 ATOM 1504 C GLU B 103 -0.903 -18.279 3.055 1.00 0.00 ATOM 1505 N THR B 104 -1.151 -17.843 4.305 1.00 0.00 ATOM 1506 CA THR B 104 -0.083 -17.583 5.240 1.00 0.00 ATOM 1507 CB THR B 104 0.668 -16.289 4.909 1.00 0.00 ATOM 1508 CG2 THR B 104 -0.272 -15.088 4.874 1.00 0.00 ATOM 1509 OG1 THR B 104 1.697 -16.031 5.879 1.00 0.00 ATOM 1510 O THR B 104 -1.917 -17.196 6.693 1.00 0.00 ATOM 1511 C THR B 104 -0.727 -17.462 6.604 1.00 0.00 ATOM 1512 N SER B 105 0.054 -17.565 7.662 1.00 0.00 ATOM 1513 CA SER B 105 -0.471 -17.363 9.005 1.00 0.00 ATOM 1514 CB SER B 105 0.573 -17.808 10.024 1.00 0.00 ATOM 1515 OG SER B 105 1.771 -17.061 9.862 1.00 0.00 ATOM 1516 O SER B 105 -1.641 -15.633 10.211 1.00 0.00 ATOM 1517 C SER B 105 -0.916 -15.914 9.251 1.00 0.00 ATOM 1518 N VAL B 106 -0.448 -14.996 8.411 1.00 0.00 ATOM 1519 CA VAL B 106 -0.798 -13.578 8.515 1.00 0.00 ATOM 1520 CB VAL B 106 0.423 -12.704 8.888 1.00 0.00 ATOM 1521 CG1 VAL B 106 0.804 -12.933 10.346 1.00 0.00 ATOM 1522 CG2 VAL B 106 1.592 -13.001 7.981 1.00 0.00 ATOM 1523 O VAL B 106 -0.666 -13.425 6.174 1.00 0.00 ATOM 1524 C VAL B 106 -1.364 -13.172 7.157 1.00 0.00 TER END