PFRMAT TS TARGET TR432 AUTHOR 4008-1775-0004 METHOD The SAM-T08 hand predictions use methods similar to SAM_T06 in CASP7. METHOD METHOD We start with a fully automated method (implemented as the SAM-T08-server): METHOD METHOD Use the SAM-T2K, SAM-T04, and SAM-T06 methods for finding homologs METHOD of the target and aligning them. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignments. These neural nets have been newly trained METHOD for CASP8 with an improved training protocol. The neural nets for METHOD the 3 different multiple sequence alignments are independently METHOD trained, so combining them should offer improved performance. METHOD METHOD We currently use 15 local-structure alphabets: METHOD STR2 an extended version of DSSP that splits the beta strands METHOD into multiple classes (parallel/antiparallel/mixed, METHOD edge/center) METHOD STR4 an attempt at an alphabet like STR2, but not requiring DSSP. METHOD This alphabet may be trying to make some irrelevant METHOD distinctions as well. 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 PB de Brevern's protein blocks METHOD METHOD N_NOTOR METHOD N_NOTOR2 METHOD O_NOTOR METHOD O_NOTOR2 alphabets based on the torsion angle of METHOD backbone hydrogen bonds METHOD METHOD N_SEP METHOD O_SEP alphabets based on the separation of donor and METHOD acceptor for backbone hydrogen bonds METHOD 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 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 METHOD We make 2-track HMMs with each alphabet with the amino-acid track METHOD having a weight of 1 and the local structure track having a weight METHOD of 0.1 (for backbone alphabets) or 0.3 (for burial alphabets). METHOD We use these HMMs to score a template library of about METHOD 14000 (t06), 16000 (t04), or 18000 (t2k) templates. METHOD The template libraries are expanded weekly, but old template HMMs METHOD are not rebuilt. The target HMMs are used to score consensus METHOD sequences for the templates, to get a cheap approximation of METHOD profile-profile scoring, which does not yet work in the SAM package. METHOD METHOD We also used single-track HMMs to score not just the template METHOD library, but a non-redundant copy of the entire PDB. This scoring METHOD is done with real sequences, not consensus sequences. METHOD METHOD All the target HMMs use a new calibration method the provides more METHOD accurate E-values than before, and can be used even with METHOD local-structure alphabets that used to give us trouble (such as METHOD protein blocks). METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence. Later this summer, we METHOD hope to be able to use multi-track template HMMs, but we have not METHOD had time to calibrate such models while keeping the code METHOD compatible with the old libraries, so the template libraries METHOD currently use old calibrations, with somewhat optimistic E-values. 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 settings on the SAM alignment software. 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. Two different neural net METHOD methods were used, and the results submitted separately. METHOD METHOD CB-CB constraints were extracted from the alignments and a METHOD combinatorial optimization done to choose a most-believable METHOD subset. METHOD METHOD Then the "undertaker" program (named because it originally METHOD optimized burial) is used to try to combine the alignments and the METHOD fragments into a consistent 3D model. No single alignment or METHOD parent template was used as a frozen core, though in many cases METHOD one had much more influence than the others. The alignment scores METHOD were not used by undertaker, but were used only to pick the set METHOD of alignments and fragments that undertaker would see. METHOD METHOD The cost functions used by undertaker rely heavily on the METHOD alignment constraints, on helix and strand constraints generated METHOD from the secondary-structure predictions, and on the neural-net METHOD predictions of local properties that undertaker can measure. METHOD The residue-residue contact predictions are also given to METHOD undertaker, but have less weight. There are also a number of METHOD built-in cost functions (breaks, clashes, burial, ...) that are METHOD included in the cost function. METHOD METHOD The automatic script runs the undertaker-optimized model through METHOD gromacs (to fix small clashes and breaks) and repacks the METHOD sidechains using Rosetta, but these post-undertaker optimizations METHOD are not included in the server predictions. They can be used in METHOD subsequent re-optimization. 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 We often do "polishing" runs, where all the current models are read in METHOD and optimization with undertaker's genetic algorithm is done with high METHOD crossover. METHOD METHOD Some improvements in undertaker include better communication with METHOD SCWRL for initial model building form alignments (now using the METHOD standard protocol that identical residues have fixed rotamers, rather METHOD than being reoptimized by SCWRL), more cost functions based on the METHOD neural net predictions, multiple constraint sets (for easier METHOD weighting of the importance of different constraints), and some new METHOD conformation-change operators (Backrub and BigBackrub). METHOD METHOD We also created model-quality-assessment methods for CASP8, which we METHOD are applying to the server predictions. We do two optimizations from the METHOD top 10 models with two of the MQA methods, and consider these models METHOD as possible alternatives to our natively-generated models. METHOD METHOD METHOD METHOD For this REFINEMENT model, we did a standard prediction for the METHOD residues included in the model, then tried optimizing both from the METHOD predicted model and from the provided starting point. Since we were METHOD directed to focus on Y85-G92, I also tried cutting and pasting that METHOD region from other models (particularly server models). This provided METHOD slightly different starting points and a bit more flexibility in METHOD rebuilding that loop. METHOD METHOD My tools are not optimized for fine-grain placement of atoms, so I'm METHOD not sure that I can make any improvement over a 1.34 Angstrom CA_RMSD METHOD model. METHOD METHOD All the models submitted have a disulfide constraint: C79-C101. The METHOD CYS residues seemed too close not to be interacting, though with this METHOD being part of a cytosolic human protein a disulfide somehow seems METHOD wrong. Since the cys are on the edge of the model, so I wonder if a METHOD metal-binding site in the protein has somehow been broken by taking METHOD out just this fragment. A disulfide here could correct for the METHOD missing metal. METHOD METHOD Model METHOD METHOD METHOD 1 TR432.try7-opt3.pdb # < chimera-try6-try5 METHOD # best undertaker score (with try3,try4,try7.costfcn) METHOD chimera-try6-try5: METHOD mostly from TR432.try6-opt3.gromacs0.repack-nonPC.pdb METHOD I111-R130 is from try5-opt3 METHOD chimera-try6-try5 was an attempt to use the tighter packing of METHOD the C-terminal helix in try5 with the more standard loop in try6. METHOD METHOD METHOD 2 TR432.try7-opt3.gromacs0.repack-nonPC.pdb # < chimera-try6-try5 METHOD # best rosetta energy METHOD Rosetta and undertaker disagree somewhat on clashes, so METHOD running an undertaker-produced model through gromacs energy METHOD minimization to relieve tiny clashes, then repacking the METHOD sidechains (except PRO and CYS) with Rosetta produces the best METHOD Rosetta energy scores, even though few atoms move much. METHOD METHOD 3 TR432.try6-opt3.pdb # < chimera-try4-MULTICOM METHOD chimera-try4-MULTICOM: METHOD mostly TR432.try4-opt3.repack-nonPC.pdb METHOD A82-L95 from MULTICOM-REFINE_TS2 METHOD This chimera was an attempt to get a slightly different loop METHOD as a starting point for further optimization. Sometimes doing METHOD this sort of cut-and-paste introduces breaks into the backbone METHOD and has slightly different shape to the fragments, kicking the METHOD optimization out of a local optimum and allowing it to find a METHOD different one. METHOD METHOD 4 TR432.try5-opt3.pdb # < try3-opt3 < try2-opt3.gromacs0.repack-nonPC < chimera-init-try1 METHOD chimera-init-try1: METHOD mostly TR432.pdb METHOD Y85-R97 from try1-opt3 METHOD try1-opt3 was the automatically generated prediction for TR432 METHOD It had a rather different idea of what the interesting loop should be. METHOD Initially I favored this model, but it looks like the loop now METHOD blocks access to the putative active site: Y43,N81,Y85,N86, so METHOD I downgraded the model. The try5 run had some extra METHOD constraints to try to pull the C-terminal helix in tighter, METHOD which were fairly successful, so I copied that portion of the METHOD model into chimera-try6-try5 to make the final model. METHOD METHOD 5 TR432.try4-opt3.repack-nonPC.pdb # < TR432 METHOD # optimized directly from provided model, using just undertaker. METHOD # helix constraints taken from the initial model and from try1-opt3 METHOD # disulfide C79-C101 METHOD REMARK 6 REMARK 6 TR432 model 4 Thu Jul 10 18:42:30 2008 MODEL 4 PARENT N/A ATOM 1 N SER 1 29.771 8.149 13.877 1.00 0.00 ATOM 2 CA SER 1 29.764 8.069 12.412 1.00 0.00 ATOM 3 CB SER 1 28.723 7.067 11.949 1.00 0.00 ATOM 4 OG SER 1 27.418 7.506 12.201 1.00 0.00 ATOM 5 O SER 1 29.032 10.348 12.577 1.00 0.00 ATOM 6 C SER 1 29.402 9.435 11.838 1.00 0.00 ATOM 7 N MET 2 29.510 9.573 10.520 1.00 0.00 ATOM 8 CA MET 2 29.190 10.833 9.865 1.00 0.00 ATOM 9 CB MET 2 29.453 10.656 8.349 1.00 0.00 ATOM 10 CG MET 2 29.130 11.887 7.493 1.00 0.00 ATOM 11 SD MET 2 28.700 11.514 5.768 1.00 0.00 ATOM 12 CE MET 2 26.970 11.052 5.931 1.00 0.00 ATOM 13 O MET 2 27.482 12.425 10.307 1.00 0.00 ATOM 14 C MET 2 27.789 11.238 10.188 1.00 0.00 ATOM 15 N GLN 3 26.915 10.248 10.344 1.00 0.00 ATOM 16 CA GLN 3 25.520 10.516 10.670 1.00 0.00 ATOM 17 CB GLN 3 24.709 9.219 10.707 1.00 0.00 ATOM 18 CG GLN 3 24.432 8.620 9.338 1.00 0.00 ATOM 19 CD GLN 3 23.736 7.276 9.423 1.00 0.00 ATOM 20 OE1 GLN 3 23.531 6.736 10.514 1.00 0.00 ATOM 21 NE2 GLN 3 23.373 6.723 8.271 1.00 0.00 ATOM 22 O GLN 3 24.779 12.265 12.136 1.00 0.00 ATOM 23 C GLN 3 25.439 11.230 12.015 1.00 0.00 ATOM 24 N GLU 4 26.144 10.707 13.012 1.00 0.00 ATOM 25 CA GLU 4 26.177 11.333 14.319 1.00 0.00 ATOM 26 CB GLU 4 26.969 10.416 15.247 1.00 0.00 ATOM 27 CG GLU 4 26.147 9.166 15.546 1.00 0.00 ATOM 28 CD GLU 4 26.920 8.036 16.216 1.00 0.00 ATOM 29 OE1 GLU 4 26.348 6.941 16.162 1.00 0.00 ATOM 30 OE2 GLU 4 28.089 8.196 16.618 1.00 0.00 ATOM 31 O GLU 4 26.308 13.673 14.880 1.00 0.00 ATOM 32 C GLU 4 26.796 12.740 14.239 1.00 0.00 ATOM 33 N GLU 5 27.856 12.878 13.456 1.00 0.00 ATOM 34 CA GLU 5 28.526 14.179 13.303 1.00 0.00 ATOM 35 CB GLU 5 29.775 13.997 12.439 1.00 0.00 ATOM 36 CG GLU 5 30.915 13.260 13.129 1.00 0.00 ATOM 37 CD GLU 5 32.051 13.001 12.178 1.00 0.00 ATOM 38 OE1 GLU 5 31.918 13.318 11.021 1.00 0.00 ATOM 39 OE2 GLU 5 33.095 12.592 12.631 1.00 0.00 ATOM 40 O GLU 5 27.459 16.320 13.172 1.00 0.00 ATOM 41 C GLU 5 27.590 15.199 12.676 1.00 0.00 ATOM 42 N ASP 6 26.928 14.809 11.592 1.00 0.00 ATOM 43 CA ASP 6 25.990 15.701 10.918 1.00 0.00 ATOM 44 CB ASP 6 25.472 15.060 9.626 1.00 0.00 ATOM 45 CG ASP 6 26.492 15.010 8.496 1.00 0.00 ATOM 46 OD1 ASP 6 27.503 15.661 8.608 1.00 0.00 ATOM 47 OD2 ASP 6 26.327 14.205 7.612 1.00 0.00 ATOM 48 O ASP 6 24.469 17.246 11.942 1.00 0.00 ATOM 49 C ASP 6 24.840 16.075 11.846 1.00 0.00 ATOM 50 N THR 7 24.302 15.089 12.557 1.00 0.00 ATOM 51 CA THR 7 23.255 15.345 13.485 1.00 0.00 ATOM 52 CB THR 7 22.650 14.039 13.983 1.00 0.00 ATOM 53 CG2 THR 7 21.523 14.338 14.994 1.00 0.00 ATOM 54 OG1 THR 7 22.160 13.309 12.848 1.00 0.00 ATOM 55 O THR 7 23.039 17.162 15.025 1.00 0.00 ATOM 56 C THR 7 23.750 16.253 14.593 1.00 0.00 ATOM 57 N PHE 8 24.990 16.042 15.023 1.00 0.00 ATOM 58 CA PHE 8 25.591 16.889 16.046 1.00 0.00 ATOM 59 CB PHE 8 26.980 16.364 16.417 1.00 0.00 ATOM 60 CG PHE 8 27.683 17.192 17.455 1.00 0.00 ATOM 61 CD1 PHE 8 27.355 17.070 18.796 1.00 0.00 ATOM 62 CD2 PHE 8 28.672 18.092 17.092 1.00 0.00 ATOM 63 CE1 PHE 8 28.002 17.831 19.752 1.00 0.00 ATOM 64 CE2 PHE 8 29.321 18.852 18.045 1.00 0.00 ATOM 65 CZ PHE 8 28.984 18.722 19.377 1.00 0.00 ATOM 66 O PHE 8 25.618 19.267 16.399 1.00 0.00 ATOM 67 C PHE 8 25.741 18.338 15.608 1.00 0.00 ATOM 68 N ARG 9 26.054 18.519 14.392 1.00 0.00 ATOM 69 CA ARG 9 26.289 19.814 13.749 1.00 0.00 ATOM 70 CB ARG 9 26.783 19.668 12.318 1.00 0.00 ATOM 71 CG ARG 9 28.213 19.167 12.181 1.00 0.00 ATOM 72 CD ARG 9 28.663 18.971 10.781 1.00 0.00 ATOM 73 NE ARG 9 30.017 18.461 10.648 1.00 0.00 ATOM 74 CZ ARG 9 30.608 18.149 9.477 1.00 0.00 ATOM 75 NH1 ARG 9 29.956 18.260 8.340 1.00 0.00 ATOM 76 NH2 ARG 9 31.852 17.708 9.503 1.00 0.00 ATOM 77 O ARG 9 25.121 21.901 14.070 1.00 0.00 ATOM 78 C ARG 9 25.028 20.699 13.798 1.00 0.00 ATOM 79 N GLU 10 23.856 20.113 13.515 1.00 0.00 ATOM 80 CA GLU 10 22.589 20.827 13.652 1.00 0.00 ATOM 81 CB GLU 10 21.421 19.913 13.195 1.00 0.00 ATOM 82 CG GLU 10 20.015 20.528 13.289 1.00 0.00 ATOM 83 CD GLU 10 19.846 21.856 12.555 1.00 0.00 ATOM 84 OE1 GLU 10 20.584 22.136 11.579 1.00 0.00 ATOM 85 OE2 GLU 10 18.939 22.613 12.964 1.00 0.00 ATOM 86 O GLU 10 22.002 22.530 15.238 1.00 0.00 ATOM 87 C GLU 10 22.434 21.390 15.062 1.00 0.00 ATOM 88 N LEU 11 22.789 20.592 16.062 1.00 0.00 ATOM 89 CA LEU 11 22.687 21.027 17.449 1.00 0.00 ATOM 90 CB LEU 11 22.970 19.891 18.430 1.00 0.00 ATOM 91 CG LEU 11 22.905 20.385 19.880 1.00 0.00 ATOM 92 CD1 LEU 11 21.500 20.895 20.232 1.00 0.00 ATOM 93 CD2 LEU 11 23.400 19.312 20.842 1.00 0.00 ATOM 94 O LEU 11 23.250 23.138 18.445 1.00 0.00 ATOM 95 C LEU 11 23.630 22.188 17.760 1.00 0.00 ATOM 96 N ARG 12 24.857 22.107 17.255 1.00 0.00 ATOM 97 CA ARG 12 25.840 23.160 17.487 1.00 0.00 ATOM 98 CB ARG 12 27.234 22.858 16.962 1.00 0.00 ATOM 99 CG ARG 12 28.279 23.915 17.280 1.00 0.00 ATOM 100 CD ARG 12 29.627 23.629 16.723 1.00 0.00 ATOM 101 NE ARG 12 29.695 23.630 15.271 1.00 0.00 ATOM 102 CZ ARG 12 29.737 24.740 14.509 1.00 0.00 ATOM 103 NH1 ARG 12 29.682 25.937 15.051 1.00 0.00 ATOM 104 NH2 ARG 12 29.811 24.594 13.197 1.00 0.00 ATOM 105 O ARG 12 25.344 25.503 17.627 1.00 0.00 ATOM 106 C ARG 12 25.310 24.481 16.940 1.00 0.00 ATOM 107 N ILE 13 24.822 24.458 15.704 1.00 0.00 ATOM 108 CA ILE 13 24.280 25.673 15.072 1.00 0.00 ATOM 109 CB ILE 13 24.065 25.390 13.544 1.00 0.00 ATOM 110 CG1 ILE 13 25.372 25.281 12.802 1.00 0.00 ATOM 111 CG2 ILE 13 23.139 26.433 12.840 1.00 0.00 ATOM 112 CD1 ILE 13 25.204 24.619 11.439 1.00 0.00 ATOM 113 O ILE 13 22.787 27.358 15.905 1.00 0.00 ATOM 114 C ILE 13 23.012 26.153 15.773 1.00 0.00 ATOM 115 N PHE 14 22.189 25.212 16.224 1.00 0.00 ATOM 116 CA PHE 14 20.950 25.558 16.911 1.00 0.00 ATOM 117 CB PHE 14 20.191 24.212 17.174 1.00 0.00 ATOM 118 CG PHE 14 19.124 24.296 18.231 1.00 0.00 ATOM 119 CD1 PHE 14 18.163 25.301 18.204 1.00 0.00 ATOM 120 CD2 PHE 14 19.063 23.334 19.238 1.00 0.00 ATOM 121 CE1 PHE 14 17.149 25.343 19.161 1.00 0.00 ATOM 122 CE2 PHE 14 18.058 23.367 20.199 1.00 0.00 ATOM 123 CZ PHE 14 17.099 24.375 20.158 1.00 0.00 ATOM 124 O PHE 14 20.602 27.375 18.439 1.00 0.00 ATOM 125 C PHE 14 21.215 26.335 18.197 1.00 0.00 ATOM 126 N LEU 15 22.130 25.831 19.018 1.00 0.00 ATOM 127 CA LEU 15 22.469 26.495 20.281 1.00 0.00 ATOM 128 CB LEU 15 23.557 25.691 21.003 1.00 0.00 ATOM 129 CG LEU 15 23.175 24.250 21.364 1.00 0.00 ATOM 130 CD1 LEU 15 24.387 23.506 21.904 1.00 0.00 ATOM 131 CD2 LEU 15 22.049 24.264 22.387 1.00 0.00 ATOM 132 O LEU 15 22.442 28.845 20.691 1.00 0.00 ATOM 133 C LEU 15 22.884 27.919 20.010 1.00 0.00 ATOM 134 N ARG 16 23.738 28.103 19.009 1.00 0.00 ATOM 135 CA ARG 16 24.208 29.437 18.653 1.00 0.00 ATOM 136 CB ARG 16 25.342 29.190 17.596 1.00 0.00 ATOM 137 CG ARG 16 26.203 30.421 17.260 1.00 0.00 ATOM 138 CD ARG 16 25.532 31.532 16.426 1.00 0.00 ATOM 139 NE ARG 16 24.941 30.987 15.178 1.00 0.00 ATOM 140 CZ ARG 16 25.615 30.884 14.058 1.00 0.00 ATOM 141 NH1 ARG 16 26.868 31.317 13.927 1.00 0.00 ATOM 142 NH2 ARG 16 25.011 30.310 12.990 1.00 0.00 ATOM 143 O ARG 16 23.022 31.523 18.609 1.00 0.00 ATOM 144 C ARG 16 23.056 30.348 18.241 1.00 0.00 ATOM 145 N ASN 17 22.114 29.805 17.477 1.00 0.00 ATOM 146 CA ASN 17 20.961 30.584 17.024 1.00 0.00 ATOM 147 CB ASN 17 20.035 29.723 16.186 1.00 0.00 ATOM 148 CG ASN 17 20.552 29.447 14.802 1.00 0.00 ATOM 149 ND2 ASN 17 19.940 28.489 14.151 1.00 0.00 ATOM 150 OD1 ASN 17 21.447 30.137 14.302 1.00 0.00 ATOM 151 O ASN 17 19.869 32.337 18.243 1.00 0.00 ATOM 152 C ASN 17 20.190 31.149 18.211 1.00 0.00 ATOM 153 N VAL 18 19.894 30.296 19.188 1.00 0.00 ATOM 154 CA VAL 18 19.157 30.728 20.380 1.00 0.00 ATOM 155 CB VAL 18 18.957 29.681 21.410 1.00 0.00 ATOM 156 CG1 VAL 18 18.345 30.279 22.671 1.00 0.00 ATOM 157 CG2 VAL 18 18.071 28.595 20.844 1.00 0.00 ATOM 158 O VAL 18 19.405 32.911 21.414 1.00 0.00 ATOM 159 C VAL 18 19.960 31.852 21.115 1.00 0.00 ATOM 160 N THR 19 21.236 31.605 21.387 1.00 0.00 ATOM 161 CA THR 19 22.068 32.590 22.068 1.00 0.00 ATOM 162 CB THR 19 23.496 32.017 22.131 1.00 0.00 ATOM 163 CG2 THR 19 24.395 32.918 22.963 1.00 0.00 ATOM 164 OG1 THR 19 23.463 30.710 22.718 1.00 0.00 ATOM 165 O THR 19 22.202 34.970 21.820 1.00 0.00 ATOM 166 C THR 19 22.205 33.874 21.260 1.00 0.00 ATOM 167 N HIS 20 22.309 33.726 19.947 1.00 0.00 ATOM 168 CA HIS 20 22.445 34.893 19.087 1.00 0.00 ATOM 169 CB HIS 20 22.755 34.400 17.671 1.00 0.00 ATOM 170 CG HIS 20 22.916 35.502 16.672 1.00 0.00 ATOM 171 CD2 HIS 20 22.107 35.925 15.671 1.00 0.00 ATOM 172 ND1 HIS 20 24.028 36.319 16.638 1.00 0.00 ATOM 173 CE1 HIS 20 23.896 37.196 15.658 1.00 0.00 ATOM 174 NE2 HIS 20 22.740 36.977 15.057 1.00 0.00 ATOM 175 O HIS 20 21.305 36.993 19.242 1.00 0.00 ATOM 176 C HIS 20 21.201 35.773 19.117 1.00 0.00 ATOM 177 N ARG 21 19.999 35.161 18.999 1.00 0.00 ATOM 178 CA ARG 21 18.753 35.924 19.007 1.00 0.00 ATOM 179 CB ARG 21 17.521 35.063 18.775 1.00 0.00 ATOM 180 CG ARG 21 17.371 34.528 17.360 1.00 0.00 ATOM 181 CD ARG 21 16.196 33.641 17.161 1.00 0.00 ATOM 182 NE ARG 21 16.073 33.097 15.818 1.00 0.00 ATOM 183 CZ ARG 21 15.124 32.222 15.431 1.00 0.00 ATOM 184 NH1 ARG 21 14.240 31.760 16.288 1.00 0.00 ATOM 185 NH2 ARG 21 15.120 31.821 14.173 1.00 0.00 ATOM 186 O ARG 21 18.243 37.858 20.314 1.00 0.00 ATOM 187 C ARG 21 18.612 36.700 20.321 1.00 0.00 ATOM 188 N LEU 22 18.905 36.048 21.430 1.00 0.00 ATOM 189 CA LEU 22 18.822 36.712 22.730 1.00 0.00 ATOM 190 CB LEU 22 19.185 35.707 23.832 1.00 0.00 ATOM 191 CG LEU 22 18.247 34.499 23.950 1.00 0.00 ATOM 192 CD1 LEU 22 18.927 33.385 24.733 1.00 0.00 ATOM 193 CD2 LEU 22 16.953 34.924 24.629 1.00 0.00 ATOM 194 O LEU 22 19.309 39.047 22.707 1.00 0.00 ATOM 195 C LEU 22 19.765 37.909 22.753 1.00 0.00 ATOM 196 N ALA 23 21.052 37.609 22.535 1.00 0.00 ATOM 197 CA ALA 23 22.129 38.615 22.610 1.00 0.00 ATOM 198 CB ALA 23 23.483 38.020 22.231 1.00 0.00 ATOM 199 O ALA 23 22.166 40.945 22.057 1.00 0.00 ATOM 200 C ALA 23 21.937 39.796 21.679 1.00 0.00 ATOM 201 N ILE 24 21.533 39.513 20.443 1.00 0.00 ATOM 202 CA ILE 24 21.311 40.594 19.475 1.00 0.00 ATOM 203 CB ILE 24 20.870 40.063 18.111 1.00 0.00 ATOM 204 CG1 ILE 24 22.000 39.300 17.394 1.00 0.00 ATOM 205 CG2 ILE 24 20.364 41.203 17.234 1.00 0.00 ATOM 206 CD1 ILE 24 23.262 40.078 17.133 1.00 0.00 ATOM 207 O ILE 24 20.398 42.772 19.894 1.00 0.00 ATOM 208 C ILE 24 20.245 41.554 19.991 1.00 0.00 ATOM 209 N ASP 25 19.165 41.004 20.538 1.00 0.00 ATOM 210 CA ASP 25 18.102 41.820 21.057 1.00 0.00 ATOM 211 CB ASP 25 16.969 40.960 21.623 1.00 0.00 ATOM 212 CG ASP 25 15.749 41.748 22.080 1.00 0.00 ATOM 213 OD1 ASP 25 15.781 42.953 22.001 1.00 0.00 ATOM 214 OD2 ASP 25 14.742 41.140 22.354 1.00 0.00 ATOM 215 O ASP 25 19.401 42.366 23.015 1.00 0.00 ATOM 216 C ASP 25 18.675 42.778 22.116 1.00 0.00 ATOM 217 N LYS 26 18.339 44.049 22.011 1.00 0.00 ATOM 218 CA LYS 26 18.821 45.043 22.962 1.00 0.00 ATOM 219 CB LYS 26 18.259 46.413 22.580 1.00 0.00 ATOM 220 CG LYS 26 18.815 46.981 21.279 1.00 0.00 ATOM 221 CD LYS 26 18.214 48.342 20.967 1.00 0.00 ATOM 222 CE LYS 26 18.755 48.901 19.660 1.00 0.00 ATOM 223 NZ LYS 26 18.150 50.218 19.326 1.00 0.00 ATOM 224 O LYS 26 19.182 45.006 25.324 1.00 0.00 ATOM 225 C LYS 26 18.426 44.735 24.389 1.00 0.00 ATOM 226 N ARG 27 17.238 44.167 24.564 1.00 0.00 ATOM 227 CA ARG 27 16.753 43.822 25.895 1.00 0.00 ATOM 228 CB ARG 27 15.326 43.300 25.836 1.00 0.00 ATOM 229 CG ARG 27 14.272 44.349 25.520 1.00 0.00 ATOM 230 CD ARG 27 12.891 43.815 25.397 1.00 0.00 ATOM 231 NE ARG 27 11.886 44.811 25.068 1.00 0.00 ATOM 232 CZ ARG 27 10.586 44.541 24.835 1.00 0.00 ATOM 233 NH1 ARG 27 10.138 43.305 24.856 1.00 0.00 ATOM 234 NH2 ARG 27 9.779 45.549 24.561 1.00 0.00 ATOM 235 O ARG 27 17.904 42.896 27.805 1.00 0.00 ATOM 236 C ARG 27 17.676 42.801 26.599 1.00 0.00 ATOM 237 N PHE 28 18.195 41.842 25.839 1.00 0.00 ATOM 238 CA PHE 28 19.080 40.829 26.402 1.00 0.00 ATOM 239 CB PHE 28 18.934 39.561 25.558 1.00 0.00 ATOM 240 CG PHE 28 17.590 38.832 25.755 1.00 0.00 ATOM 241 CD1 PHE 28 17.368 38.146 26.933 1.00 0.00 ATOM 242 CD2 PHE 28 16.618 38.810 24.758 1.00 0.00 ATOM 243 CE1 PHE 28 16.184 37.440 27.137 1.00 0.00 ATOM 244 CE2 PHE 28 15.434 38.105 24.961 1.00 0.00 ATOM 245 CZ PHE 28 15.211 37.420 26.151 1.00 0.00 ATOM 246 O PHE 28 21.362 40.633 27.074 1.00 0.00 ATOM 247 C PHE 28 20.547 41.276 26.425 1.00 0.00 ATOM 248 N ARG 29 20.803 42.495 25.962 1.00 0.00 ATOM 249 CA ARG 29 22.184 42.983 25.759 1.00 0.00 ATOM 250 CB ARG 29 22.127 44.375 25.049 1.00 0.00 ATOM 251 CG ARG 29 23.472 44.827 24.481 1.00 0.00 ATOM 252 CD ARG 29 23.465 46.288 24.041 1.00 0.00 ATOM 253 NE ARG 29 23.231 47.197 25.164 1.00 0.00 ATOM 254 CZ ARG 29 22.093 47.858 25.365 1.00 0.00 ATOM 255 NH1 ARG 29 21.076 47.726 24.521 1.00 0.00 ATOM 256 NH2 ARG 29 21.967 48.655 26.417 1.00 0.00 ATOM 257 O ARG 29 24.225 42.694 27.029 1.00 0.00 ATOM 258 C ARG 29 23.014 42.987 27.050 1.00 0.00 ATOM 259 N VAL 30 22.363 43.362 28.167 1.00 0.00 ATOM 260 CA VAL 30 23.069 43.480 29.444 1.00 0.00 ATOM 261 CB VAL 30 22.156 43.840 30.597 1.00 0.00 ATOM 262 CG1 VAL 30 22.933 43.872 31.898 1.00 0.00 ATOM 263 CG2 VAL 30 21.493 45.237 30.359 1.00 0.00 ATOM 264 O VAL 30 25.035 42.381 30.105 1.00 0.00 ATOM 265 C VAL 30 23.878 42.222 29.743 1.00 0.00 ATOM 266 N PHE 31 23.281 41.065 29.446 1.00 0.00 ATOM 267 CA PHE 31 23.934 39.782 29.706 1.00 0.00 ATOM 268 CB PHE 31 22.915 38.667 29.899 1.00 0.00 ATOM 269 CG PHE 31 22.416 38.724 31.337 1.00 0.00 ATOM 270 CD1 PHE 31 23.256 38.303 32.356 1.00 0.00 ATOM 271 CD2 PHE 31 21.149 39.194 31.664 1.00 0.00 ATOM 272 CE1 PHE 31 22.862 38.332 33.690 1.00 0.00 ATOM 273 CE2 PHE 31 20.766 39.233 32.998 1.00 0.00 ATOM 274 CZ PHE 31 21.607 38.801 34.009 1.00 0.00 ATOM 275 O PHE 31 25.853 38.570 28.909 1.00 0.00 ATOM 276 C PHE 31 24.983 39.395 28.656 1.00 0.00 ATOM 277 N THR 32 24.934 40.076 27.512 1.00 0.00 ATOM 278 CA THR 32 25.850 39.834 26.387 1.00 0.00 ATOM 279 CB THR 32 25.442 40.708 25.189 1.00 0.00 ATOM 280 CG2 THR 32 26.396 40.581 23.989 1.00 0.00 ATOM 281 OG1 THR 32 24.119 40.327 24.818 1.00 0.00 ATOM 282 O THR 32 28.118 39.145 26.580 1.00 0.00 ATOM 283 C THR 32 27.310 40.029 26.814 1.00 0.00 ATOM 284 N LYS 33 27.621 41.155 27.450 1.00 0.00 ATOM 285 CA LYS 33 29.011 41.390 27.872 1.00 0.00 ATOM 286 CB LYS 33 29.306 42.891 27.897 1.00 0.00 ATOM 287 CG LYS 33 29.080 43.596 26.566 1.00 0.00 ATOM 288 CD LYS 33 30.045 43.095 25.502 1.00 0.00 ATOM 289 CE LYS 33 29.934 43.913 24.224 1.00 0.00 ATOM 290 NZ LYS 33 30.857 43.419 23.166 1.00 0.00 ATOM 291 O LYS 33 28.378 40.922 30.135 1.00 0.00 ATOM 292 C LYS 33 29.264 40.844 29.276 1.00 0.00 ATOM 293 N PRO 34 30.506 40.420 29.524 1.00 0.00 ATOM 294 CA PRO 34 30.950 40.185 30.900 1.00 0.00 ATOM 295 CB PRO 34 32.436 39.851 30.801 1.00 0.00 ATOM 296 CG PRO 34 32.906 40.586 29.550 1.00 0.00 ATOM 297 CD PRO 34 31.708 40.465 28.614 1.00 0.00 ATOM 298 O PRO 34 30.876 42.584 31.204 1.00 0.00 ATOM 299 C PRO 34 30.706 41.463 31.712 1.00 0.00 ATOM 300 N VAL 35 30.233 41.289 32.933 1.00 0.00 ATOM 301 CA VAL 35 30.083 42.446 33.829 1.00 0.00 ATOM 302 CB VAL 35 29.540 42.027 35.207 1.00 0.00 ATOM 303 CG1 VAL 35 29.509 43.218 36.153 1.00 0.00 ATOM 304 CG2 VAL 35 28.153 41.420 35.073 1.00 0.00 ATOM 305 O VAL 35 32.414 42.414 34.351 1.00 0.00 ATOM 306 C VAL 35 31.467 43.098 33.953 1.00 0.00 ATOM 307 N ASP 36 31.492 44.381 33.623 1.00 0.00 ATOM 308 CA ASP 36 32.737 45.137 33.715 1.00 0.00 ATOM 309 CB ASP 36 32.505 46.584 33.223 1.00 0.00 ATOM 310 CG ASP 36 33.842 47.300 33.062 1.00 0.00 ATOM 311 OD1 ASP 36 34.506 47.537 34.090 1.00 0.00 ATOM 312 OD2 ASP 36 34.218 47.580 31.910 1.00 0.00 ATOM 313 O ASP 36 32.443 45.577 36.067 1.00 0.00 ATOM 314 C ASP 36 33.214 45.214 35.168 1.00 0.00 ATOM 315 N PRO 37 34.432 44.725 35.393 1.00 0.00 ATOM 316 CA PRO 37 35.079 44.801 36.696 1.00 0.00 ATOM 317 CB PRO 37 36.480 44.218 36.394 1.00 0.00 ATOM 318 CG PRO 37 36.197 43.229 35.310 1.00 0.00 ATOM 319 CD PRO 37 35.209 43.962 34.423 1.00 0.00 ATOM 320 O PRO 37 35.177 46.388 38.493 1.00 0.00 ATOM 321 C PRO 37 35.267 46.197 37.279 1.00 0.00 ATOM 322 N ASP 38 35.528 47.172 36.414 1.00 0.00 ATOM 323 CA ASP 38 35.719 48.528 36.859 1.00 0.00 ATOM 324 CB ASP 38 36.278 49.457 35.778 1.00 0.00 ATOM 325 CG ASP 38 37.759 49.259 35.483 1.00 0.00 ATOM 326 OD1 ASP 38 38.413 48.591 36.248 1.00 0.00 ATOM 327 OD2 ASP 38 38.189 49.642 34.421 1.00 0.00 ATOM 328 O ASP 38 34.299 49.412 38.523 1.00 0.00 ATOM 329 C ASP 38 34.368 49.055 37.360 1.00 0.00 ATOM 330 N GLU 39 33.276 48.696 36.686 1.00 0.00 ATOM 331 CA GLU 39 31.933 49.079 37.152 1.00 0.00 ATOM 332 CB GLU 39 30.868 48.758 36.242 1.00 0.00 ATOM 333 CG GLU 39 31.017 49.673 35.013 1.00 0.00 ATOM 334 CD GLU 39 30.687 51.121 35.366 1.00 0.00 ATOM 335 OE1 GLU 39 29.529 51.318 35.788 1.00 0.00 ATOM 336 OE2 GLU 39 31.549 51.999 35.293 1.00 0.00 ATOM 337 O GLU 39 31.210 48.978 39.451 1.00 0.00 ATOM 338 C GLU 39 31.635 48.377 38.475 1.00 0.00 ATOM 339 N VAL 40 31.958 47.089 38.534 1.00 0.00 ATOM 340 CA VAL 40 31.709 46.285 39.741 1.00 0.00 ATOM 341 CB VAL 40 30.697 45.161 39.448 1.00 0.00 ATOM 342 CG1 VAL 40 30.445 44.331 40.697 1.00 0.00 ATOM 343 CG2 VAL 40 29.393 45.743 38.923 1.00 0.00 ATOM 344 O VAL 40 33.510 44.704 39.682 1.00 0.00 ATOM 345 C VAL 40 33.048 45.713 40.214 1.00 0.00 ATOM 346 N PRO 41 33.589 46.320 41.280 1.00 0.00 ATOM 347 CA PRO 41 34.908 45.951 41.781 1.00 0.00 ATOM 348 CB PRO 41 35.128 46.997 42.895 1.00 0.00 ATOM 349 CG PRO 41 34.253 48.136 42.462 1.00 0.00 ATOM 350 CD PRO 41 33.013 47.446 41.984 1.00 0.00 ATOM 351 O PRO 41 36.052 43.884 42.131 1.00 0.00 ATOM 352 C PRO 41 35.033 44.552 42.330 1.00 0.00 ATOM 353 N ASP 42 34.036 44.051 43.070 1.00 0.00 ATOM 354 CA ASP 42 34.142 42.773 43.704 1.00 0.00 ATOM 355 CB ASP 42 33.812 42.928 45.190 1.00 0.00 ATOM 356 CG ASP 42 32.409 43.447 45.473 1.00 0.00 ATOM 357 OD1 ASP 42 31.729 43.804 44.540 1.00 0.00 ATOM 358 OD2 ASP 42 31.971 43.337 46.593 1.00 0.00 ATOM 359 O ASP 42 32.967 40.682 43.659 1.00 0.00 ATOM 360 C ASP 42 33.295 41.694 43.038 1.00 0.00 ATOM 361 N TYR 43 32.941 41.911 41.775 1.00 0.00 ATOM 362 CA TYR 43 32.144 40.953 41.054 1.00 0.00 ATOM 363 CB TYR 43 31.824 41.491 39.679 1.00 0.00 ATOM 364 CG TYR 43 31.026 40.550 38.856 1.00 0.00 ATOM 365 CD1 TYR 43 29.688 40.247 39.161 1.00 0.00 ATOM 366 CD2 TYR 43 31.617 39.896 37.729 1.00 0.00 ATOM 367 CE1 TYR 43 28.973 39.372 38.389 1.00 0.00 ATOM 368 CE2 TYR 43 30.906 38.996 36.983 1.00 0.00 ATOM 369 CZ TYR 43 29.598 38.732 37.306 1.00 0.00 ATOM 370 OH TYR 43 28.952 37.760 36.607 1.00 0.00 ATOM 371 O TYR 43 32.230 38.562 41.140 1.00 0.00 ATOM 372 C TYR 43 32.844 39.610 40.938 1.00 0.00 ATOM 373 N VAL 44 34.134 39.638 40.615 1.00 0.00 ATOM 374 CA VAL 44 34.907 38.410 40.479 1.00 0.00 ATOM 375 CB VAL 44 36.323 38.702 39.949 1.00 0.00 ATOM 376 CG1 VAL 44 37.176 37.442 39.988 1.00 0.00 ATOM 377 CG2 VAL 44 36.261 39.256 38.534 1.00 0.00 ATOM 378 O VAL 44 34.970 36.427 41.829 1.00 0.00 ATOM 379 C VAL 44 35.022 37.657 41.801 1.00 0.00 ATOM 380 N THR 45 35.179 38.398 42.893 1.00 0.00 ATOM 381 CA THR 45 35.299 37.783 44.217 1.00 0.00 ATOM 382 CB THR 45 35.537 38.789 45.358 1.00 0.00 ATOM 383 CG2 THR 45 35.611 38.070 46.696 1.00 0.00 ATOM 384 OG1 THR 45 36.763 39.495 45.130 1.00 0.00 ATOM 385 O THR 45 34.139 35.876 45.103 1.00 0.00 ATOM 386 C THR 45 34.046 36.981 44.566 1.00 0.00 ATOM 387 N VAL 46 32.879 37.538 44.259 1.00 0.00 ATOM 388 CA VAL 46 31.620 36.860 44.546 1.00 0.00 ATOM 389 CB VAL 46 30.397 37.800 44.463 1.00 0.00 ATOM 390 CG1 VAL 46 29.111 36.986 44.609 1.00 0.00 ATOM 391 CG2 VAL 46 30.491 38.873 45.577 1.00 0.00 ATOM 392 O VAL 46 31.140 34.589 43.958 1.00 0.00 ATOM 393 C VAL 46 31.382 35.728 43.566 1.00 0.00 ATOM 394 N ILE 47 31.464 36.040 42.286 1.00 0.00 ATOM 395 CA ILE 47 31.097 35.020 41.304 1.00 0.00 ATOM 396 CB ILE 47 30.434 35.662 40.072 1.00 0.00 ATOM 397 CG1 ILE 47 29.149 36.387 40.475 1.00 0.00 ATOM 398 CG2 ILE 47 30.145 34.608 39.015 1.00 0.00 ATOM 399 CD1 ILE 47 28.187 35.532 41.267 1.00 0.00 ATOM 400 O ILE 47 33.157 34.723 40.119 1.00 0.00 ATOM 401 C ILE 47 32.334 34.241 40.891 1.00 0.00 ATOM 402 N LYS 48 32.338 32.992 41.318 1.00 0.00 ATOM 403 CA LYS 48 33.426 32.092 40.923 1.00 0.00 ATOM 404 CB LYS 48 33.360 30.790 41.723 1.00 0.00 ATOM 405 CG LYS 48 34.489 29.812 41.429 1.00 0.00 ATOM 406 CD LYS 48 34.405 28.583 42.321 1.00 0.00 ATOM 407 CE LYS 48 35.514 27.591 42.006 1.00 0.00 ATOM 408 NZ LYS 48 35.423 26.367 42.847 1.00 0.00 ATOM 409 O LYS 48 34.416 31.847 38.751 1.00 0.00 ATOM 410 C LYS 48 33.391 31.781 39.430 1.00 0.00 ATOM 411 N GLN 49 32.209 31.447 38.921 1.00 0.00 ATOM 412 CA GLN 49 32.060 31.133 37.509 1.00 0.00 ATOM 413 CB GLN 49 31.397 29.761 37.370 1.00 0.00 ATOM 414 CG GLN 49 32.197 28.619 37.971 1.00 0.00 ATOM 415 CD GLN 49 31.530 27.272 37.765 1.00 0.00 ATOM 416 OE1 GLN 49 31.636 26.669 36.693 1.00 0.00 ATOM 417 NE2 GLN 49 30.833 26.795 38.790 1.00 0.00 ATOM 418 O GLN 49 30.010 32.109 36.729 1.00 0.00 ATOM 419 C GLN 49 31.235 32.198 36.785 1.00 0.00 ATOM 420 N PRO 50 31.913 33.238 36.311 1.00 0.00 ATOM 421 CA PRO 50 31.232 34.268 35.527 1.00 0.00 ATOM 422 CB PRO 50 32.316 35.325 35.329 1.00 0.00 ATOM 423 CG PRO 50 33.607 34.498 35.243 1.00 0.00 ATOM 424 CD PRO 50 33.388 33.362 36.220 1.00 0.00 ATOM 425 O PRO 50 31.346 32.628 33.765 1.00 0.00 ATOM 426 C PRO 50 30.758 33.604 34.233 1.00 0.00 ATOM 427 N MET 51 29.635 34.068 33.721 1.00 0.00 ATOM 428 CA MET 51 29.115 33.591 32.442 1.00 0.00 ATOM 429 CB MET 51 28.156 32.416 32.621 1.00 0.00 ATOM 430 CG MET 51 27.861 31.641 31.345 1.00 0.00 ATOM 431 SD MET 51 29.141 30.432 30.955 1.00 0.00 ATOM 432 CE MET 51 30.132 31.351 29.782 1.00 0.00 ATOM 433 O MET 51 27.871 35.626 32.367 1.00 0.00 ATOM 434 C MET 51 28.433 34.738 31.736 1.00 0.00 ATOM 435 N ASP 52 28.506 34.728 30.438 1.00 0.00 ATOM 436 CA ASP 52 27.980 35.812 29.611 1.00 0.00 ATOM 437 CB ASP 52 28.893 37.037 29.540 1.00 0.00 ATOM 438 CG ASP 52 30.314 36.738 29.080 1.00 0.00 ATOM 439 OD1 ASP 52 30.534 36.686 27.893 1.00 0.00 ATOM 440 OD2 ASP 52 31.193 36.722 29.907 1.00 0.00 ATOM 441 O ASP 52 28.247 34.171 27.880 1.00 0.00 ATOM 442 C ASP 52 27.692 35.211 28.239 1.00 0.00 ATOM 443 N LEU 53 26.826 35.868 27.473 1.00 0.00 ATOM 444 CA LEU 53 26.490 35.389 26.164 1.00 0.00 ATOM 445 CB LEU 53 25.411 36.253 25.517 1.00 0.00 ATOM 446 CG LEU 53 24.076 36.179 26.269 1.00 0.00 ATOM 447 CD1 LEU 53 23.011 36.995 25.537 1.00 0.00 ATOM 448 CD2 LEU 53 23.582 34.740 26.443 1.00 0.00 ATOM 449 O LEU 53 27.841 34.415 24.445 1.00 0.00 ATOM 450 C LEU 53 27.708 35.336 25.248 1.00 0.00 ATOM 451 N SER 54 28.593 36.298 25.364 1.00 0.00 ATOM 452 CA SER 54 29.794 36.321 24.536 1.00 0.00 ATOM 453 CB SER 54 30.664 37.449 24.805 1.00 0.00 ATOM 454 OG SER 54 31.133 37.719 26.035 1.00 0.00 ATOM 455 O SER 54 31.083 34.415 23.856 1.00 0.00 ATOM 456 C SER 54 30.657 35.084 24.795 1.00 0.00 ATOM 457 N SER 55 30.919 34.770 26.054 1.00 0.00 ATOM 458 CA SER 55 31.715 33.602 26.417 1.00 0.00 ATOM 459 CB SER 55 31.949 33.582 27.916 1.00 0.00 ATOM 460 OG SER 55 32.747 34.653 28.338 1.00 0.00 ATOM 461 O SER 55 31.647 31.396 25.475 1.00 0.00 ATOM 462 C SER 55 31.008 32.331 25.961 1.00 0.00 ATOM 463 N VAL 56 29.688 32.297 26.117 1.00 0.00 ATOM 464 CA VAL 56 28.891 31.118 25.709 1.00 0.00 ATOM 465 CB VAL 56 27.395 31.314 26.011 1.00 0.00 ATOM 466 CG1 VAL 56 26.562 30.272 25.281 1.00 0.00 ATOM 467 CG2 VAL 56 27.141 31.245 27.509 1.00 0.00 ATOM 468 O VAL 56 29.268 29.723 23.781 1.00 0.00 ATOM 469 C VAL 56 29.074 30.864 24.202 1.00 0.00 ATOM 470 N ILE 57 29.011 31.925 23.406 1.00 0.00 ATOM 471 CA ILE 57 29.174 31.797 21.962 1.00 0.00 ATOM 472 CB ILE 57 28.966 33.167 21.288 1.00 0.00 ATOM 473 CG1 ILE 57 27.508 33.615 21.428 1.00 0.00 ATOM 474 CG2 ILE 57 29.368 33.106 19.822 1.00 0.00 ATOM 475 CD1 ILE 57 27.272 35.055 21.038 1.00 0.00 ATOM 476 O ILE 57 30.761 30.410 20.790 1.00 0.00 ATOM 477 C ILE 57 30.592 31.281 21.646 1.00 0.00 ATOM 478 N SER 58 31.593 31.817 22.336 1.00 0.00 ATOM 479 CA SER 58 32.972 31.397 22.118 1.00 0.00 ATOM 480 CB SER 58 33.926 32.172 23.004 1.00 0.00 ATOM 481 OG SER 58 33.982 33.529 22.656 1.00 0.00 ATOM 482 O SER 58 33.796 29.178 21.733 1.00 0.00 ATOM 483 C SER 58 33.074 29.906 22.416 1.00 0.00 ATOM 484 N LYS 59 32.352 29.453 23.436 1.00 0.00 ATOM 485 CA LYS 59 32.369 28.028 23.817 1.00 0.00 ATOM 486 CB LYS 59 31.543 27.765 25.041 1.00 0.00 ATOM 487 CG LYS 59 32.107 28.437 26.290 1.00 0.00 ATOM 488 CD LYS 59 33.340 27.778 26.813 1.00 0.00 ATOM 489 CE LYS 59 33.801 28.472 28.072 1.00 0.00 ATOM 490 NZ LYS 59 34.983 27.775 28.639 1.00 0.00 ATOM 491 O LYS 59 32.341 26.103 22.361 1.00 0.00 ATOM 492 C LYS 59 31.798 27.165 22.669 1.00 0.00 ATOM 493 N ILE 60 30.715 27.627 22.053 1.00 0.00 ATOM 494 CA ILE 60 30.099 26.891 20.955 1.00 0.00 ATOM 495 CB ILE 60 28.870 27.654 20.427 1.00 0.00 ATOM 496 CG1 ILE 60 27.748 27.639 21.469 1.00 0.00 ATOM 497 CG2 ILE 60 28.391 27.048 19.117 1.00 0.00 ATOM 498 CD1 ILE 60 26.609 28.582 21.153 1.00 0.00 ATOM 499 O ILE 60 31.404 25.574 19.427 1.00 0.00 ATOM 500 C ILE 60 31.177 26.696 19.881 1.00 0.00 ATOM 501 N ASP 61 31.860 27.796 19.552 1.00 0.00 ATOM 502 CA ASP 61 32.983 27.748 18.595 1.00 0.00 ATOM 503 CB ASP 61 33.544 29.152 18.357 1.00 0.00 ATOM 504 CG ASP 61 32.633 30.065 17.546 1.00 0.00 ATOM 505 OD1 ASP 61 31.693 29.573 16.971 1.00 0.00 ATOM 506 OD2 ASP 61 32.792 31.258 17.635 1.00 0.00 ATOM 507 O ASP 61 34.771 26.177 18.287 1.00 0.00 ATOM 508 C ASP 61 34.097 26.816 19.087 1.00 0.00 ATOM 509 N LEU 62 34.241 26.727 20.390 1.00 0.00 ATOM 510 CA LEU 62 35.253 25.846 20.978 1.00 0.00 ATOM 511 CB LEU 62 35.685 26.425 22.325 1.00 0.00 ATOM 512 CG LEU 62 36.430 27.741 22.177 1.00 0.00 ATOM 513 CD1 LEU 62 36.601 28.240 23.595 1.00 0.00 ATOM 514 CD2 LEU 62 37.776 27.588 21.458 1.00 0.00 ATOM 515 O LEU 62 35.459 23.600 21.805 1.00 0.00 ATOM 516 C LEU 62 34.788 24.399 21.161 1.00 0.00 ATOM 517 N HIS 63 33.602 24.083 20.630 1.00 0.00 ATOM 518 CA HIS 63 33.062 22.705 20.614 1.00 0.00 ATOM 519 CB HIS 63 34.036 21.761 19.959 1.00 0.00 ATOM 520 CG HIS 63 34.219 22.057 18.506 1.00 0.00 ATOM 521 CD2 HIS 63 33.460 21.740 17.431 1.00 0.00 ATOM 522 ND1 HIS 63 35.266 22.815 18.026 1.00 0.00 ATOM 523 CE1 HIS 63 35.143 22.953 16.718 1.00 0.00 ATOM 524 NE2 HIS 63 34.055 22.310 16.332 1.00 0.00 ATOM 525 O HIS 63 32.764 20.994 22.301 1.00 0.00 ATOM 526 C HIS 63 32.844 22.192 22.050 1.00 0.00 ATOM 527 N LYS 64 32.673 23.132 22.984 1.00 0.00 ATOM 528 CA LYS 64 32.494 22.803 24.409 1.00 0.00 ATOM 529 CB LYS 64 32.549 24.069 25.265 1.00 0.00 ATOM 530 CG LYS 64 33.929 24.708 25.355 1.00 0.00 ATOM 531 CD LYS 64 34.904 23.816 26.111 1.00 0.00 ATOM 532 CE LYS 64 36.273 24.470 26.233 1.00 0.00 ATOM 533 NZ LYS 64 37.243 23.599 26.949 1.00 0.00 ATOM 534 O LYS 64 31.130 21.173 25.509 1.00 0.00 ATOM 535 C LYS 64 31.173 22.077 24.691 1.00 0.00 ATOM 536 N TYR 65 30.123 22.459 23.950 1.00 0.00 ATOM 537 CA TYR 65 28.786 21.883 24.264 1.00 0.00 ATOM 538 CB TYR 65 27.636 22.863 24.022 1.00 0.00 ATOM 539 CG TYR 65 27.828 24.138 24.824 1.00 0.00 ATOM 540 CD1 TYR 65 27.559 24.171 26.182 1.00 0.00 ATOM 541 CD2 TYR 65 28.267 25.268 24.163 1.00 0.00 ATOM 542 CE1 TYR 65 27.735 25.347 26.900 1.00 0.00 ATOM 543 CE2 TYR 65 28.436 26.444 24.859 1.00 0.00 ATOM 544 CZ TYR 65 28.165 26.486 26.217 1.00 0.00 ATOM 545 OH TYR 65 28.331 27.656 26.862 1.00 0.00 ATOM 546 O TYR 65 28.373 20.691 22.200 1.00 0.00 ATOM 547 C TYR 65 28.536 20.634 23.415 1.00 0.00 ATOM 548 N LEU 66 28.498 19.505 24.116 1.00 0.00 ATOM 549 CA LEU 66 28.164 18.220 23.478 1.00 0.00 ATOM 550 CB LEU 66 29.208 17.129 23.943 1.00 0.00 ATOM 551 CG LEU 66 30.659 17.462 23.555 1.00 0.00 ATOM 552 CD1 LEU 66 31.579 16.467 24.268 1.00 0.00 ATOM 553 CD2 LEU 66 30.853 17.357 22.058 1.00 0.00 ATOM 554 O LEU 66 26.247 16.811 23.171 1.00 0.00 ATOM 555 C LEU 66 26.702 17.840 23.674 1.00 0.00 ATOM 556 N THR 67 25.964 18.672 24.404 1.00 0.00 ATOM 557 CA THR 67 24.564 18.409 24.649 1.00 0.00 ATOM 558 CB THR 67 24.332 17.587 25.951 1.00 0.00 ATOM 559 CG2 THR 67 24.906 16.197 25.822 1.00 0.00 ATOM 560 OG1 THR 67 24.971 18.260 27.043 1.00 0.00 ATOM 561 O THR 67 24.384 20.689 25.371 1.00 0.00 ATOM 562 C THR 67 23.798 19.679 24.981 1.00 0.00 ATOM 563 N VAL 68 22.488 19.577 24.871 1.00 0.00 ATOM 564 CA VAL 68 21.636 20.717 25.170 1.00 0.00 ATOM 565 CB VAL 68 20.034 20.035 24.971 1.00 0.00 ATOM 566 CG1 VAL 68 18.893 21.013 24.869 1.00 0.00 ATOM 567 CG2 VAL 68 19.950 18.982 23.868 1.00 0.00 ATOM 568 O VAL 68 21.451 22.199 27.080 1.00 0.00 ATOM 569 C VAL 68 21.647 21.046 26.693 1.00 0.00 ATOM 570 N LYS 69 21.876 20.036 27.527 1.00 0.00 ATOM 571 CA LYS 69 21.910 20.241 28.971 1.00 0.00 ATOM 572 CB LYS 69 22.084 18.882 29.651 1.00 0.00 ATOM 573 CG LYS 69 20.858 17.982 29.586 1.00 0.00 ATOM 574 CD LYS 69 21.101 16.661 30.299 1.00 0.00 ATOM 575 CE LYS 69 19.876 15.763 30.235 1.00 0.00 ATOM 576 NZ LYS 69 20.116 14.446 30.887 1.00 0.00 ATOM 577 O LYS 69 22.865 22.094 30.165 1.00 0.00 ATOM 578 C LYS 69 23.053 21.175 29.364 1.00 0.00 ATOM 579 N ASP 70 24.261 20.955 28.813 1.00 0.00 ATOM 580 CA ASP 70 25.415 21.795 29.124 1.00 0.00 ATOM 581 CB ASP 70 26.659 21.251 28.416 1.00 0.00 ATOM 582 CG ASP 70 27.206 19.960 29.011 1.00 0.00 ATOM 583 OD1 ASP 70 26.792 19.602 30.089 1.00 0.00 ATOM 584 OD2 ASP 70 27.913 19.265 28.320 1.00 0.00 ATOM 585 O ASP 70 25.404 24.178 29.456 1.00 0.00 ATOM 586 C ASP 70 25.097 23.232 28.723 1.00 0.00 ATOM 587 N TYR 71 24.470 23.371 27.565 1.00 0.00 ATOM 588 CA TYR 71 24.114 24.696 27.073 1.00 0.00 ATOM 589 CB TYR 71 23.443 24.628 25.695 1.00 0.00 ATOM 590 CG TYR 71 22.871 25.960 25.239 1.00 0.00 ATOM 591 CD1 TYR 71 21.515 26.254 25.397 1.00 0.00 ATOM 592 CD2 TYR 71 23.690 26.933 24.671 1.00 0.00 ATOM 593 CE1 TYR 71 20.991 27.479 24.999 1.00 0.00 ATOM 594 CE2 TYR 71 23.175 28.164 24.270 1.00 0.00 ATOM 595 CZ TYR 71 21.825 28.429 24.434 1.00 0.00 ATOM 596 OH TYR 71 21.312 29.637 24.001 1.00 0.00 ATOM 597 O TYR 71 23.385 26.522 28.448 1.00 0.00 ATOM 598 C TYR 71 23.155 25.383 28.039 1.00 0.00 ATOM 599 N LEU 72 22.082 24.689 28.404 1.00 0.00 ATOM 600 CA LEU 72 21.107 25.246 29.319 1.00 0.00 ATOM 601 CB LEU 72 19.854 24.342 29.398 1.00 0.00 ATOM 602 CG LEU 72 19.082 24.068 28.104 1.00 0.00 ATOM 603 CD1 LEU 72 18.071 22.952 28.329 1.00 0.00 ATOM 604 CD2 LEU 72 18.393 25.325 27.562 1.00 0.00 ATOM 605 O LEU 72 21.260 26.458 31.414 1.00 0.00 ATOM 606 C LEU 72 21.687 25.519 30.742 1.00 0.00 ATOM 607 N ARG 73 22.643 24.700 31.172 1.00 0.00 ATOM 608 CA ARG 73 23.251 24.874 32.486 1.00 0.00 ATOM 609 CB ARG 73 24.216 23.697 32.684 1.00 0.00 ATOM 610 CG ARG 73 24.822 23.664 34.082 1.00 0.00 ATOM 611 CD ARG 73 25.621 22.398 34.301 1.00 0.00 ATOM 612 NE ARG 73 26.749 22.328 33.395 1.00 0.00 ATOM 613 CZ ARG 73 27.321 21.236 32.896 1.00 0.00 ATOM 614 NH1 ARG 73 26.887 20.029 33.190 1.00 0.00 ATOM 615 NH2 ARG 73 28.349 21.412 32.080 1.00 0.00 ATOM 616 O ARG 73 23.814 26.941 33.560 1.00 0.00 ATOM 617 C ARG 73 23.963 26.230 32.581 1.00 0.00 ATOM 618 N ASP 74 24.596 26.617 31.474 1.00 0.00 ATOM 619 CA ASP 74 25.336 27.900 31.416 1.00 0.00 ATOM 620 CB ASP 74 26.160 27.988 30.129 1.00 0.00 ATOM 621 CG ASP 74 27.339 27.027 30.070 1.00 0.00 ATOM 622 OD1 ASP 74 27.152 25.869 30.361 1.00 0.00 ATOM 623 OD2 ASP 74 28.377 27.417 29.588 1.00 0.00 ATOM 624 O ASP 74 24.677 30.098 32.108 1.00 0.00 ATOM 625 C ASP 74 24.401 29.101 31.459 1.00 0.00 ATOM 626 N ILE 75 23.212 28.888 30.902 1.00 0.00 ATOM 627 CA ILE 75 22.170 29.917 30.959 1.00 0.00 ATOM 628 CB ILE 75 21.069 29.750 29.930 1.00 0.00 ATOM 629 CG1 ILE 75 21.680 29.533 28.532 1.00 0.00 ATOM 630 CG2 ILE 75 20.143 30.959 29.950 1.00 0.00 ATOM 631 CD1 ILE 75 22.643 30.602 28.075 1.00 0.00 ATOM 632 O ILE 75 21.445 31.151 32.887 1.00 0.00 ATOM 633 C ILE 75 21.640 30.038 32.387 1.00 0.00 ATOM 634 N ASP 76 21.515 28.881 33.032 1.00 0.00 ATOM 635 CA ASP 76 21.054 28.852 34.417 1.00 0.00 ATOM 636 CB ASP 76 20.807 27.412 34.873 1.00 0.00 ATOM 637 CG ASP 76 20.189 27.289 36.260 1.00 0.00 ATOM 638 OD1 ASP 76 19.099 27.775 36.448 1.00 0.00 ATOM 639 OD2 ASP 76 20.736 26.579 37.069 1.00 0.00 ATOM 640 O ASP 76 21.726 30.147 36.326 1.00 0.00 ATOM 641 C ASP 76 22.085 29.518 35.330 1.00 0.00 ATOM 642 N LEU 77 23.362 29.376 34.989 1.00 0.00 ATOM 643 CA LEU 77 24.428 29.970 35.787 1.00 0.00 ATOM 644 CB LEU 77 25.781 29.564 35.188 1.00 0.00 ATOM 645 CG LEU 77 27.009 29.992 36.001 1.00 0.00 ATOM 646 CD1 LEU 77 26.978 29.338 37.376 1.00 0.00 ATOM 647 CD2 LEU 77 28.276 29.608 35.250 1.00 0.00 ATOM 648 O LEU 77 24.501 32.121 36.848 1.00 0.00 ATOM 649 C LEU 77 24.308 31.491 35.808 1.00 0.00 ATOM 650 N ILE 78 23.987 32.077 34.659 1.00 0.00 ATOM 651 CA ILE 78 23.841 33.530 34.562 1.00 0.00 ATOM 652 CB ILE 78 23.494 33.912 33.116 1.00 0.00 ATOM 653 CG1 ILE 78 24.717 33.757 32.215 1.00 0.00 ATOM 654 CG2 ILE 78 22.968 35.332 33.035 1.00 0.00 ATOM 655 CD1 ILE 78 24.383 33.774 30.720 1.00 0.00 ATOM 656 O ILE 78 22.939 34.885 36.343 1.00 0.00 ATOM 657 C ILE 78 22.737 33.966 35.547 1.00 0.00 ATOM 658 N CYS 79 21.584 33.306 35.486 1.00 0.00 ATOM 659 CA CYS 79 20.476 33.637 36.374 1.00 0.00 ATOM 660 CB CYS 79 19.190 32.848 36.081 1.00 0.00 ATOM 661 SG CYS 79 17.767 32.968 37.252 1.00 0.00 ATOM 662 O CYS 79 20.505 34.270 38.683 1.00 0.00 ATOM 663 C CYS 79 20.832 33.433 37.841 1.00 0.00 ATOM 664 N SER 80 21.537 32.352 38.155 1.00 0.00 ATOM 665 CA SER 80 21.901 32.079 39.541 1.00 0.00 ATOM 666 CB SER 80 22.560 30.697 39.667 1.00 0.00 ATOM 667 OG SER 80 21.631 29.699 39.261 1.00 0.00 ATOM 668 O SER 80 22.743 33.562 41.215 1.00 0.00 ATOM 669 C SER 80 22.905 33.060 40.103 1.00 0.00 ATOM 670 N ASN 81 23.953 33.337 39.333 1.00 0.00 ATOM 671 CA ASN 81 24.985 34.272 39.770 1.00 0.00 ATOM 672 CB ASN 81 26.073 34.372 38.718 1.00 0.00 ATOM 673 CG ASN 81 26.959 33.159 38.645 1.00 0.00 ATOM 674 ND2 ASN 81 27.686 33.055 37.563 1.00 0.00 ATOM 675 OD1 ASN 81 27.037 32.365 39.590 1.00 0.00 ATOM 676 O ASN 81 24.696 36.286 41.057 1.00 0.00 ATOM 677 C ASN 81 24.370 35.636 40.057 1.00 0.00 ATOM 678 N ALA 82 23.455 36.055 39.197 1.00 0.00 ATOM 679 CA ALA 82 22.787 37.343 39.378 1.00 0.00 ATOM 680 CB ALA 82 21.830 37.575 38.279 1.00 0.00 ATOM 681 O ALA 82 22.145 38.266 41.497 1.00 0.00 ATOM 682 C ALA 82 22.014 37.343 40.693 1.00 0.00 ATOM 683 N LEU 83 21.209 36.308 40.908 1.00 0.00 ATOM 684 CA LEU 83 20.404 36.194 42.156 1.00 0.00 ATOM 685 CB LEU 83 19.578 34.868 42.083 1.00 0.00 ATOM 686 CG LEU 83 18.788 34.483 43.338 1.00 0.00 ATOM 687 CD1 LEU 83 17.744 35.550 43.647 1.00 0.00 ATOM 688 CD2 LEU 83 18.125 33.132 43.120 1.00 0.00 ATOM 689 O LEU 83 20.952 36.816 44.428 1.00 0.00 ATOM 690 C LEU 83 21.276 36.158 43.438 1.00 0.00 ATOM 691 N GLU 84 22.364 35.396 43.404 1.00 0.00 ATOM 692 CA GLU 84 23.252 35.294 44.556 1.00 0.00 ATOM 693 CB GLU 84 24.126 34.047 44.394 1.00 0.00 ATOM 694 CG GLU 84 23.371 32.731 44.527 1.00 0.00 ATOM 695 CD GLU 84 24.273 31.557 44.262 1.00 0.00 ATOM 696 OE1 GLU 84 25.417 31.771 43.943 1.00 0.00 ATOM 697 OE2 GLU 84 23.849 30.447 44.485 1.00 0.00 ATOM 698 O GLU 84 24.026 37.225 45.819 1.00 0.00 ATOM 699 C GLU 84 24.047 36.566 44.769 1.00 0.00 ATOM 700 N TYR 85 24.884 37.028 43.787 1.00 0.00 ATOM 701 CA TYR 85 25.718 38.196 43.958 1.00 0.00 ATOM 702 CB TYR 85 26.712 38.496 42.826 1.00 0.00 ATOM 703 CG TYR 85 27.451 39.825 43.024 1.00 0.00 ATOM 704 CD1 TYR 85 28.067 40.189 44.216 1.00 0.00 ATOM 705 CD2 TYR 85 27.369 40.754 42.013 1.00 0.00 ATOM 706 CE1 TYR 85 28.641 41.441 44.389 1.00 0.00 ATOM 707 CE2 TYR 85 27.924 42.016 42.172 1.00 0.00 ATOM 708 CZ TYR 85 28.562 42.358 43.349 1.00 0.00 ATOM 709 OH TYR 85 29.058 43.610 43.510 1.00 0.00 ATOM 710 O TYR 85 25.131 40.242 45.064 1.00 0.00 ATOM 711 C TYR 85 24.876 39.451 44.155 1.00 0.00 ATOM 712 N ASN 86 23.869 39.630 43.304 1.00 0.00 ATOM 713 CA ASN 86 22.999 40.791 43.402 1.00 0.00 ATOM 714 CB ASN 86 22.371 41.118 42.043 1.00 0.00 ATOM 715 CG ASN 86 23.454 41.261 40.978 1.00 0.00 ATOM 716 ND2 ASN 86 23.225 40.661 39.830 1.00 0.00 ATOM 717 OD1 ASN 86 24.421 41.968 41.155 1.00 0.00 ATOM 718 O ASN 86 21.403 39.554 44.722 1.00 0.00 ATOM 719 C ASN 86 21.901 40.654 44.448 1.00 0.00 ATOM 720 N PRO 87 21.441 41.810 44.923 1.00 0.00 ATOM 721 CA PRO 87 20.310 41.887 45.852 1.00 0.00 ATOM 722 CB PRO 87 20.240 43.334 46.304 1.00 0.00 ATOM 723 CG PRO 87 21.678 43.809 46.140 1.00 0.00 ATOM 724 CD PRO 87 22.125 43.117 44.858 1.00 0.00 ATOM 725 O PRO 87 18.927 41.402 43.918 1.00 0.00 ATOM 726 C PRO 87 19.040 41.407 45.145 1.00 0.00 ATOM 727 N ASP 88 18.079 41.018 45.969 1.00 0.00 ATOM 728 CA ASP 88 16.791 40.477 45.532 1.00 0.00 ATOM 729 CB ASP 88 15.937 40.083 46.739 1.00 0.00 ATOM 730 CG ASP 88 16.410 38.830 47.463 1.00 0.00 ATOM 731 OD1 ASP 88 17.250 38.143 46.932 1.00 0.00 ATOM 732 OD2 ASP 88 16.049 38.655 48.604 1.00 0.00 ATOM 733 O ASP 88 15.177 41.120 43.833 1.00 0.00 ATOM 734 C ASP 88 16.029 41.490 44.652 1.00 0.00 ATOM 735 N ARG 89 16.461 42.741 44.750 1.00 0.00 ATOM 736 CA ARG 89 15.846 43.909 44.077 1.00 0.00 ATOM 737 CB ARG 89 15.250 44.890 45.107 1.00 0.00 ATOM 738 CG ARG 89 13.992 44.372 45.789 1.00 0.00 ATOM 739 CD ARG 89 13.364 45.431 46.734 1.00 0.00 ATOM 740 NE ARG 89 13.032 46.658 46.014 1.00 0.00 ATOM 741 CZ ARG 89 11.989 46.807 45.198 1.00 0.00 ATOM 742 NH1 ARG 89 11.147 45.807 44.983 1.00 0.00 ATOM 743 NH2 ARG 89 11.795 47.965 44.587 1.00 0.00 ATOM 744 O ARG 89 16.431 45.688 42.617 1.00 0.00 ATOM 745 C ARG 89 16.718 44.545 42.995 1.00 0.00 ATOM 746 N ASP 90 17.671 43.803 42.431 1.00 0.00 ATOM 747 CA ASP 90 18.516 44.492 41.452 1.00 0.00 ATOM 748 CB ASP 90 20.020 44.265 41.499 1.00 0.00 ATOM 749 CG ASP 90 20.556 45.307 42.501 1.00 0.00 ATOM 750 OD1 ASP 90 19.783 45.842 43.342 1.00 0.00 ATOM 751 OD2 ASP 90 21.787 45.516 42.489 1.00 0.00 ATOM 752 O ASP 90 16.960 44.193 39.632 1.00 0.00 ATOM 753 C ASP 90 17.748 44.949 40.205 1.00 0.00 ATOM 754 N PRO 91 17.975 46.155 39.780 1.00 0.00 ATOM 755 CA PRO 91 17.281 46.655 38.590 1.00 0.00 ATOM 756 CB PRO 91 17.437 48.166 38.718 1.00 0.00 ATOM 757 CG PRO 91 18.725 48.343 39.423 1.00 0.00 ATOM 758 CD PRO 91 18.808 47.200 40.399 1.00 0.00 ATOM 759 O PRO 91 19.155 45.819 37.322 1.00 0.00 ATOM 760 C PRO 91 17.994 46.224 37.316 1.00 0.00 ATOM 761 N GLY 92 17.236 46.324 36.195 1.00 0.00 ATOM 762 CA GLY 92 17.733 45.835 34.904 1.00 0.00 ATOM 763 O GLY 92 19.873 45.940 33.795 1.00 0.00 ATOM 764 C GLY 92 19.005 46.545 34.424 1.00 0.00 ATOM 765 N ASP 93 19.124 47.789 34.840 1.00 0.00 ATOM 766 CA ASP 93 20.244 48.639 34.376 1.00 0.00 ATOM 767 CB ASP 93 20.021 50.047 34.810 1.00 0.00 ATOM 768 CG ASP 93 19.061 50.904 34.048 1.00 0.00 ATOM 769 OD1 ASP 93 18.981 50.733 32.790 1.00 0.00 ATOM 770 OD2 ASP 93 18.402 51.792 34.553 1.00 0.00 ATOM 771 O ASP 93 22.627 48.404 34.297 1.00 0.00 ATOM 772 C ASP 93 21.592 48.213 34.936 1.00 0.00 ATOM 773 N ARG 94 21.578 47.632 36.131 1.00 0.00 ATOM 774 CA ARG 94 22.811 47.180 36.764 1.00 0.00 ATOM 775 CB ARG 94 23.370 48.241 37.706 1.00 0.00 ATOM 776 CG ARG 94 24.768 47.916 38.187 1.00 0.00 ATOM 777 CD ARG 94 25.227 48.935 39.180 1.00 0.00 ATOM 778 NE ARG 94 26.586 48.627 39.625 1.00 0.00 ATOM 779 CZ ARG 94 27.273 49.400 40.454 1.00 0.00 ATOM 780 NH1 ARG 94 28.501 49.052 40.823 1.00 0.00 ATOM 781 NH2 ARG 94 26.726 50.518 40.918 1.00 0.00 ATOM 782 O ARG 94 21.500 45.856 38.306 1.00 0.00 ATOM 783 C ARG 94 22.552 45.990 37.685 1.00 0.00 ATOM 784 N LEU 95 23.726 45.222 37.676 1.00 0.00 ATOM 785 CA LEU 95 23.779 44.046 38.531 1.00 0.00 ATOM 786 CB LEU 95 23.896 44.524 40.007 1.00 0.00 ATOM 787 CG LEU 95 25.131 45.426 40.210 1.00 0.00 ATOM 788 CD1 LEU 95 25.286 45.921 41.639 1.00 0.00 ATOM 789 CD2 LEU 95 26.440 44.756 39.794 1.00 0.00 ATOM 790 O LEU 95 23.594 42.042 37.379 1.00 0.00 ATOM 791 C LEU 95 22.934 42.897 37.942 1.00 0.00 ATOM 792 N ILE 96 21.630 43.025 37.646 1.00 0.00 ATOM 793 CA ILE 96 20.816 42.178 36.731 1.00 0.00 ATOM 794 CB ILE 96 21.005 42.627 35.255 1.00 0.00 ATOM 795 CG1 ILE 96 19.708 42.475 34.456 1.00 0.00 ATOM 796 CG2 ILE 96 22.219 41.942 34.587 1.00 0.00 ATOM 797 CD1 ILE 96 19.807 42.968 33.012 1.00 0.00 ATOM 798 O ILE 96 20.564 39.757 36.388 1.00 0.00 ATOM 799 C ILE 96 20.485 40.720 37.158 1.00 0.00 ATOM 800 N ARG 97 19.609 40.672 38.174 1.00 0.00 ATOM 801 CA ARG 97 18.978 39.418 38.648 1.00 0.00 ATOM 802 CB ARG 97 18.702 39.542 40.188 1.00 0.00 ATOM 803 CG ARG 97 18.220 38.278 40.839 1.00 0.00 ATOM 804 CD ARG 97 17.652 38.474 42.223 1.00 0.00 ATOM 805 NE ARG 97 16.360 39.162 42.126 1.00 0.00 ATOM 806 CZ ARG 97 15.216 38.594 41.804 1.00 0.00 ATOM 807 NH1 ARG 97 15.110 37.304 41.610 1.00 0.00 ATOM 808 NH2 ARG 97 14.139 39.354 41.680 1.00 0.00 ATOM 809 O ARG 97 17.497 37.848 37.537 1.00 0.00 ATOM 810 C ARG 97 17.734 39.030 37.811 1.00 0.00 ATOM 811 N HIS 98 16.959 40.026 37.361 1.00 0.00 ATOM 812 CA HIS 98 15.698 39.797 36.617 1.00 0.00 ATOM 813 CB HIS 98 14.854 41.074 36.576 1.00 0.00 ATOM 814 CG HIS 98 13.577 40.927 35.809 1.00 0.00 ATOM 815 CD2 HIS 98 13.206 41.404 34.598 1.00 0.00 ATOM 816 ND1 HIS 98 12.500 40.212 36.287 1.00 0.00 ATOM 817 CE1 HIS 98 11.520 40.254 35.402 1.00 0.00 ATOM 818 NE2 HIS 98 11.922 40.970 34.367 1.00 0.00 ATOM 819 O HIS 98 15.346 38.313 34.760 1.00 0.00 ATOM 820 C HIS 98 15.923 39.320 35.183 1.00 0.00 ATOM 821 N ARG 99 16.729 40.046 34.401 1.00 0.00 ATOM 822 CA ARG 99 16.979 39.662 33.018 1.00 0.00 ATOM 823 CB ARG 99 17.800 40.714 32.288 1.00 0.00 ATOM 824 CG ARG 99 18.170 40.360 30.858 1.00 0.00 ATOM 825 CD ARG 99 17.008 40.194 29.948 1.00 0.00 ATOM 826 NE ARG 99 16.284 41.424 29.668 1.00 0.00 ATOM 827 CZ ARG 99 15.077 41.482 29.073 1.00 0.00 ATOM 828 NH1 ARG 99 14.472 40.391 28.660 1.00 0.00 ATOM 829 NH2 ARG 99 14.525 42.670 28.893 1.00 0.00 ATOM 830 O ARG 99 17.305 37.556 31.946 1.00 0.00 ATOM 831 C ARG 99 17.629 38.281 32.882 1.00 0.00 ATOM 832 N ALA 100 18.445 37.923 33.872 1.00 0.00 ATOM 833 CA ALA 100 19.179 36.648 33.901 1.00 0.00 ATOM 834 CB ALA 100 19.643 36.733 35.600 1.00 0.00 ATOM 835 O ALA 100 18.388 34.566 33.011 1.00 0.00 ATOM 836 C ALA 100 18.211 35.473 33.826 1.00 0.00 ATOM 837 N CYS 101 17.188 35.489 34.675 1.00 0.00 ATOM 838 CA CYS 101 16.217 34.430 34.684 1.00 0.00 ATOM 839 CB CYS 101 15.455 34.522 35.993 1.00 0.00 ATOM 840 SG CYS 101 16.691 34.418 37.340 1.00 0.00 ATOM 841 O CYS 101 15.071 33.317 32.894 1.00 0.00 ATOM 842 C CYS 101 15.382 34.392 33.409 1.00 0.00 ATOM 843 N ALA 102 15.022 35.565 32.900 1.00 0.00 ATOM 844 CA ALA 102 14.228 35.646 31.687 1.00 0.00 ATOM 845 CB ALA 102 13.938 37.102 31.325 1.00 0.00 ATOM 846 O ALA 102 14.403 34.246 29.747 1.00 0.00 ATOM 847 C ALA 102 14.982 35.000 30.531 1.00 0.00 ATOM 848 N LEU 103 16.274 35.293 30.426 1.00 0.00 ATOM 849 CA LEU 103 17.095 34.729 29.359 1.00 0.00 ATOM 850 CB LEU 103 18.518 35.292 29.451 1.00 0.00 ATOM 851 CG LEU 103 19.509 34.738 28.417 1.00 0.00 ATOM 852 CD1 LEU 103 19.153 35.251 27.028 1.00 0.00 ATOM 853 CD2 LEU 103 20.924 35.148 28.799 1.00 0.00 ATOM 854 O LEU 103 16.990 32.484 28.517 1.00 0.00 ATOM 855 C LEU 103 17.139 33.211 29.501 1.00 0.00 ATOM 856 N ARG 104 17.343 32.734 30.724 1.00 0.00 ATOM 857 CA ARG 104 17.401 31.299 30.976 1.00 0.00 ATOM 858 CB ARG 104 17.648 31.085 32.481 1.00 0.00 ATOM 859 CG ARG 104 17.616 29.608 32.868 1.00 0.00 ATOM 860 CD ARG 104 17.356 29.385 34.299 1.00 0.00 ATOM 861 NE ARG 104 15.985 29.781 34.628 1.00 0.00 ATOM 862 CZ ARG 104 15.536 29.851 35.866 1.00 0.00 ATOM 863 NH1 ARG 104 16.318 29.520 36.900 1.00 0.00 ATOM 864 NH2 ARG 104 14.289 30.232 36.097 1.00 0.00 ATOM 865 O ARG 104 16.148 29.587 29.850 1.00 0.00 ATOM 866 C ARG 104 16.114 30.620 30.518 1.00 0.00 ATOM 867 N ASP 105 14.990 31.206 30.896 1.00 0.00 ATOM 868 CA ASP 105 13.697 30.647 30.528 1.00 0.00 ATOM 869 CB ASP 105 12.574 31.419 31.192 1.00 0.00 ATOM 870 CG ASP 105 12.581 31.207 32.704 1.00 0.00 ATOM 871 OD1 ASP 105 13.271 30.299 33.214 1.00 0.00 ATOM 872 OD2 ASP 105 11.846 31.970 33.345 1.00 0.00 ATOM 873 O ASP 105 13.214 29.625 28.428 1.00 0.00 ATOM 874 C ASP 105 13.502 30.657 29.029 1.00 0.00 ATOM 875 N THR 106 13.933 31.749 28.398 1.00 0.00 ATOM 876 CA THR 106 13.700 31.906 26.946 1.00 0.00 ATOM 877 CB THR 106 13.987 33.350 26.524 1.00 0.00 ATOM 878 CG2 THR 106 13.877 33.473 25.007 1.00 0.00 ATOM 879 OG1 THR 106 13.022 34.222 27.164 1.00 0.00 ATOM 880 O THR 106 14.051 30.266 25.231 1.00 0.00 ATOM 881 C THR 106 14.548 30.924 26.146 1.00 0.00 ATOM 882 N ALA 107 15.828 30.825 26.491 1.00 0.00 ATOM 883 CA ALA 107 16.693 29.941 25.809 1.00 0.00 ATOM 884 CB ALA 107 18.144 30.103 26.236 1.00 0.00 ATOM 885 O ALA 107 16.254 27.677 25.076 1.00 0.00 ATOM 886 C ALA 107 16.265 28.478 26.027 1.00 0.00 ATOM 887 N TYR 108 15.906 28.103 27.276 1.00 0.00 ATOM 888 CA TYR 108 15.447 26.730 27.543 1.00 0.00 ATOM 889 CB TYR 108 15.083 26.647 29.027 1.00 0.00 ATOM 890 CG TYR 108 14.513 25.310 29.445 1.00 0.00 ATOM 891 CD1 TYR 108 15.341 24.217 29.660 1.00 0.00 ATOM 892 CD2 TYR 108 13.148 25.144 29.623 1.00 0.00 ATOM 893 CE1 TYR 108 14.825 22.994 30.040 1.00 0.00 ATOM 894 CE2 TYR 108 12.621 23.925 30.005 1.00 0.00 ATOM 895 CZ TYR 108 13.463 22.851 30.212 1.00 0.00 ATOM 896 OH TYR 108 12.943 21.635 30.593 1.00 0.00 ATOM 897 O TYR 108 14.045 25.272 26.289 1.00 0.00 ATOM 898 C TYR 108 14.230 26.407 26.731 1.00 0.00 ATOM 899 N ALA 109 13.379 27.408 26.525 1.00 0.00 ATOM 900 CA ALA 109 12.161 27.217 25.746 1.00 0.00 ATOM 901 CB ALA 109 11.321 28.448 25.816 1.00 0.00 ATOM 902 O ALA 109 11.972 25.994 23.691 1.00 0.00 ATOM 903 C ALA 109 12.519 26.919 24.294 1.00 0.00 ATOM 904 N ILE 110 13.435 27.702 23.736 1.00 0.00 ATOM 905 CA ILE 110 13.830 27.502 22.406 1.00 0.00 ATOM 906 CB ILE 110 14.854 28.564 21.958 1.00 0.00 ATOM 907 CG1 ILE 110 14.300 29.996 22.101 1.00 0.00 ATOM 908 CG2 ILE 110 15.177 28.277 20.492 1.00 0.00 ATOM 909 CD1 ILE 110 15.271 31.126 21.727 1.00 0.00 ATOM 910 O ILE 110 14.089 25.397 21.295 1.00 0.00 ATOM 911 C ILE 110 14.393 26.100 22.259 1.00 0.00 ATOM 912 N ILE 111 15.178 25.709 23.238 1.00 0.00 ATOM 913 CA ILE 111 15.762 24.372 23.237 1.00 0.00 ATOM 914 CB ILE 111 16.601 23.981 24.386 1.00 0.00 ATOM 915 CG1 ILE 111 17.801 24.916 24.507 1.00 0.00 ATOM 916 CG2 ILE 111 17.014 22.510 24.256 1.00 0.00 ATOM 917 CD1 ILE 111 18.663 25.039 23.277 1.00 0.00 ATOM 918 O ILE 111 14.512 22.591 22.332 1.00 0.00 ATOM 919 C ILE 111 14.616 23.379 23.260 1.00 0.00 ATOM 920 N LYS 112 13.780 23.415 24.286 1.00 0.00 ATOM 921 CA LYS 112 12.746 22.385 24.388 1.00 0.00 ATOM 922 CB LYS 112 11.836 22.660 25.586 1.00 0.00 ATOM 923 CG LYS 112 10.766 21.603 25.820 1.00 0.00 ATOM 924 CD LYS 112 9.953 21.906 27.068 1.00 0.00 ATOM 925 CE LYS 112 8.858 20.869 27.283 1.00 0.00 ATOM 926 NZ LYS 112 8.048 21.157 28.497 1.00 0.00 ATOM 927 O LYS 112 11.681 21.075 22.680 1.00 0.00 ATOM 928 C LYS 112 11.906 22.202 23.128 1.00 0.00 ATOM 929 N GLU 113 11.459 23.313 22.575 1.00 0.00 ATOM 930 CA GLU 113 10.631 23.234 21.381 1.00 0.00 ATOM 931 CB GLU 113 10.074 24.604 20.989 1.00 0.00 ATOM 932 CG GLU 113 9.022 25.152 21.944 1.00 0.00 ATOM 933 CD GLU 113 8.625 26.552 21.573 1.00 0.00 ATOM 934 OE1 GLU 113 9.202 27.092 20.660 1.00 0.00 ATOM 935 OE2 GLU 113 7.670 27.045 22.127 1.00 0.00 ATOM 936 O GLU 113 11.092 21.536 19.741 1.00 0.00 ATOM 937 C GLU 113 11.429 22.612 20.235 1.00 0.00 ATOM 938 N GLU 114 12.569 23.216 19.977 1.00 0.00 ATOM 939 CA GLU 114 13.355 22.866 18.796 1.00 0.00 ATOM 940 CB GLU 114 14.039 24.148 18.253 1.00 0.00 ATOM 941 CG GLU 114 13.069 25.174 17.695 1.00 0.00 ATOM 942 CD GLU 114 13.776 26.344 17.050 1.00 0.00 ATOM 943 OE1 GLU 114 14.621 26.103 16.162 1.00 0.00 ATOM 944 OE2 GLU 114 13.487 27.499 17.426 1.00 0.00 ATOM 945 O GLU 114 14.688 21.009 17.981 1.00 0.00 ATOM 946 C GLU 114 14.256 21.623 18.960 1.00 0.00 ATOM 947 N LEU 115 14.563 21.231 20.165 1.00 0.00 ATOM 948 CA LEU 115 15.561 20.189 20.388 1.00 0.00 ATOM 949 CB LEU 115 15.858 20.036 21.885 1.00 0.00 ATOM 950 CG LEU 115 16.850 18.923 22.244 1.00 0.00 ATOM 951 CD1 LEU 115 18.200 19.199 21.597 1.00 0.00 ATOM 952 CD2 LEU 115 16.985 18.831 23.757 1.00 0.00 ATOM 953 O LEU 115 15.908 18.203 19.173 1.00 0.00 ATOM 954 C LEU 115 15.101 18.847 19.826 1.00 0.00 ATOM 955 N ASP 116 13.883 18.445 20.177 1.00 0.00 ATOM 956 CA ASP 116 13.357 17.111 19.850 1.00 0.00 ATOM 957 CB ASP 116 13.624 16.799 18.371 1.00 0.00 ATOM 958 CG ASP 116 12.870 15.579 17.877 1.00 0.00 ATOM 959 OD1 ASP 116 13.156 14.462 18.354 1.00 0.00 ATOM 960 OD2 ASP 116 11.984 15.742 17.012 1.00 0.00 ATOM 961 O ASP 116 15.229 16.137 20.993 1.00 0.00 ATOM 962 C ASP 116 14.020 16.084 20.764 1.00 0.00 ATOM 963 N GLU 117 13.227 15.152 21.282 1.00 0.00 ATOM 964 CA GLU 117 13.750 14.152 22.141 1.00 0.00 ATOM 965 CB GLU 117 12.552 13.351 22.655 1.00 0.00 ATOM 966 CG GLU 117 11.674 14.098 23.647 1.00 0.00 ATOM 967 CD GLU 117 10.460 13.292 24.019 1.00 0.00 ATOM 968 OE1 GLU 117 10.281 12.235 23.466 1.00 0.00 ATOM 969 OE2 GLU 117 9.772 13.680 24.933 1.00 0.00 ATOM 970 O GLU 117 15.805 12.906 22.001 1.00 0.00 ATOM 971 C GLU 117 14.762 13.237 21.435 1.00 0.00 ATOM 972 N ASP 118 14.449 12.836 20.207 1.00 0.00 ATOM 973 CA ASP 118 15.341 11.968 19.446 1.00 0.00 ATOM 974 CB ASP 118 14.913 11.602 18.099 1.00 0.00 ATOM 975 CG ASP 118 13.850 10.506 18.162 1.00 0.00 ATOM 976 OD1 ASP 118 13.778 9.798 19.169 1.00 0.00 ATOM 977 OD2 ASP 118 13.089 10.266 17.238 1.00 0.00 ATOM 978 O ASP 118 17.738 11.972 19.359 1.00 0.00 ATOM 979 C ASP 118 16.700 12.619 19.215 1.00 0.00 ATOM 980 N PHE 119 16.692 13.900 18.857 1.00 0.00 ATOM 981 CA PHE 119 17.912 14.600 18.620 1.00 0.00 ATOM 982 CB PHE 119 17.722 16.049 18.286 1.00 0.00 ATOM 983 CG PHE 119 17.546 16.279 16.806 1.00 0.00 ATOM 984 CD1 PHE 119 16.342 16.755 16.294 1.00 0.00 ATOM 985 CD2 PHE 119 18.581 15.991 15.921 1.00 0.00 ATOM 986 CE1 PHE 119 16.172 16.941 14.918 1.00 0.00 ATOM 987 CE2 PHE 119 18.423 16.172 14.544 1.00 0.00 ATOM 988 CZ PHE 119 17.215 16.646 14.042 1.00 0.00 ATOM 989 O PHE 119 20.025 14.461 19.778 1.00 0.00 ATOM 990 C PHE 119 18.804 14.617 19.864 1.00 0.00 ATOM 991 N GLU 120 18.188 14.888 21.016 1.00 0.00 ATOM 992 CA GLU 120 18.904 14.948 22.285 1.00 0.00 ATOM 993 CB GLU 120 17.954 15.221 23.453 1.00 0.00 ATOM 994 CG GLU 120 18.641 15.345 24.806 1.00 0.00 ATOM 995 CD GLU 120 17.651 15.661 25.893 1.00 0.00 ATOM 996 OE1 GLU 120 16.490 15.793 25.592 1.00 0.00 ATOM 997 OE2 GLU 120 18.036 15.658 27.039 1.00 0.00 ATOM 998 O GLU 120 20.811 13.618 22.913 1.00 0.00 ATOM 999 C GLU 120 19.654 13.638 22.508 1.00 0.00 ATOM 1000 N GLN 121 18.974 12.513 22.269 1.00 0.00 ATOM 1001 CA GLN 121 19.595 11.197 22.407 1.00 0.00 ATOM 1002 CB GLN 121 18.549 10.105 22.163 1.00 0.00 ATOM 1003 CG GLN 121 17.522 9.969 23.274 1.00 0.00 ATOM 1004 CD GLN 121 16.449 8.949 22.948 1.00 0.00 ATOM 1005 OE1 GLN 121 16.420 8.386 21.849 1.00 0.00 ATOM 1006 NE2 GLN 121 15.554 8.707 23.899 1.00 0.00 ATOM 1007 O GLN 121 21.792 10.443 21.805 1.00 0.00 ATOM 1008 C GLN 121 20.770 11.033 21.450 1.00 0.00 ATOM 1009 N LEU 122 20.626 11.554 20.235 1.00 0.00 ATOM 1010 CA LEU 122 21.696 11.476 19.233 1.00 0.00 ATOM 1011 CB LEU 122 21.202 12.043 17.897 1.00 0.00 ATOM 1012 CG LEU 122 20.154 11.190 17.171 1.00 0.00 ATOM 1013 CD1 LEU 122 19.614 11.941 15.963 1.00 0.00 ATOM 1014 CD2 LEU 122 20.778 9.868 16.749 1.00 0.00 ATOM 1015 O LEU 122 24.044 11.730 19.750 1.00 0.00 ATOM 1016 C LEU 122 22.927 12.245 19.754 1.00 0.00 ATOM 1017 N CYS 123 22.673 13.422 20.323 1.00 0.00 ATOM 1018 CA CYS 123 23.726 14.210 20.981 1.00 0.00 ATOM 1019 CB CYS 123 23.258 15.598 21.261 1.00 0.00 ATOM 1020 SG CYS 123 22.715 16.340 19.689 1.00 0.00 ATOM 1021 O CYS 123 25.561 13.472 22.382 1.00 0.00 ATOM 1022 C CYS 123 24.351 13.413 22.165 1.00 0.00 ATOM 1023 N GLU 124 23.521 12.683 22.904 1.00 0.00 ATOM 1024 CA GLU 124 24.006 11.900 24.034 1.00 0.00 ATOM 1025 CB GLU 124 22.830 11.196 24.715 1.00 0.00 ATOM 1026 CG GLU 124 21.944 12.114 25.547 1.00 0.00 ATOM 1027 CD GLU 124 20.747 11.377 26.083 1.00 0.00 ATOM 1028 OE1 GLU 124 20.581 10.230 25.749 1.00 0.00 ATOM 1029 OE2 GLU 124 20.060 11.927 26.911 1.00 0.00 ATOM 1030 O GLU 124 26.169 10.896 24.018 1.00 0.00 ATOM 1031 C GLU 124 25.025 10.875 23.555 1.00 0.00 ATOM 1032 N GLU 125 24.661 10.200 22.472 1.00 0.00 ATOM 1033 CA GLU 125 25.526 9.195 21.847 1.00 0.00 ATOM 1034 CB GLU 125 24.750 8.407 20.788 1.00 0.00 ATOM 1035 CG GLU 125 23.683 7.481 21.353 1.00 0.00 ATOM 1036 CD GLU 125 22.890 6.828 20.253 1.00 0.00 ATOM 1037 OE1 GLU 125 23.123 7.143 19.111 1.00 0.00 ATOM 1038 OE2 GLU 125 22.133 5.933 20.546 1.00 0.00 ATOM 1039 O GLU 125 27.873 9.331 21.366 1.00 0.00 ATOM 1040 C GLU 125 26.764 9.855 21.250 1.00 0.00 ATOM 1041 N ILE 126 26.574 11.006 20.612 1.00 0.00 ATOM 1042 CA ILE 126 27.697 11.738 19.997 1.00 0.00 ATOM 1043 CB ILE 126 27.313 13.105 19.461 1.00 0.00 ATOM 1044 CG1 ILE 126 26.315 12.882 18.323 1.00 0.00 ATOM 1045 CG2 ILE 126 28.537 13.860 18.960 1.00 0.00 ATOM 1046 CD1 ILE 126 25.584 14.154 17.872 1.00 0.00 ATOM 1047 O ILE 126 29.941 11.886 20.834 1.00 0.00 ATOM 1048 C ILE 126 28.733 12.058 21.051 1.00 0.00 ATOM 1049 N GLN 127 28.328 12.630 22.186 1.00 0.00 ATOM 1050 CA GLN 127 29.241 13.028 23.240 1.00 0.00 ATOM 1051 CB GLN 127 28.433 13.660 24.378 1.00 0.00 ATOM 1052 CG GLN 127 29.283 14.305 25.459 1.00 0.00 ATOM 1053 CD GLN 127 29.836 13.292 26.444 1.00 0.00 ATOM 1054 OE1 GLN 127 29.174 12.303 26.776 1.00 0.00 ATOM 1055 NE2 GLN 127 31.051 13.533 26.921 1.00 0.00 ATOM 1056 O GLN 127 31.191 11.890 23.993 1.00 0.00 ATOM 1057 C GLN 127 29.985 11.822 23.780 1.00 0.00 ATOM 1058 N GLU 128 29.292 10.699 24.006 1.00 0.00 ATOM 1059 CA GLU 128 29.950 9.488 24.478 1.00 0.00 ATOM 1060 CB GLU 128 28.942 8.431 24.909 1.00 0.00 ATOM 1061 CG GLU 128 29.613 7.260 25.623 1.00 0.00 ATOM 1062 CD GLU 128 30.215 7.628 26.973 1.00 0.00 ATOM 1063 OE1 GLU 128 29.702 8.516 27.673 1.00 0.00 ATOM 1064 OE2 GLU 128 31.206 6.975 27.354 1.00 0.00 ATOM 1065 O GLU 128 32.078 8.550 23.785 1.00 0.00 ATOM 1066 C GLU 128 30.955 8.960 23.439 1.00 0.00 ATOM 1067 N SER 129 30.586 9.018 22.182 1.00 0.00 ATOM 1068 CA SER 129 31.498 8.501 21.146 1.00 0.00 ATOM 1069 CB SER 129 30.873 8.490 19.792 1.00 0.00 ATOM 1070 OG SER 129 29.749 7.644 19.754 1.00 0.00 ATOM 1071 O SER 129 33.829 8.813 20.967 1.00 0.00 ATOM 1072 C SER 129 32.739 9.385 21.051 1.00 0.00 ATOM 1073 N ARG 130 32.651 10.710 21.041 1.00 0.00 ATOM 1074 CA ARG 130 33.824 11.580 20.953 1.00 0.00 ATOM 1075 CB ARG 130 33.570 12.884 20.317 1.00 0.00 ATOM 1076 CG ARG 130 33.625 12.726 18.805 1.00 0.00 ATOM 1077 CD ARG 130 33.088 13.907 18.043 1.00 0.00 ATOM 1078 NE ARG 130 33.742 15.145 18.434 1.00 0.00 ATOM 1079 CZ ARG 130 33.433 16.339 17.952 1.00 0.00 ATOM 1080 NH1 ARG 130 32.470 16.447 17.057 1.00 0.00 ATOM 1081 NH2 ARG 130 34.072 17.404 18.376 1.00 0.00 ATOM 1082 O ARG 130 33.931 10.899 23.251 1.00 0.00 ATOM 1083 C ARG 130 34.409 11.669 22.386 1.00 0.00 TER END