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 5 Thu Jul 10 18:42:30 2008 MODEL 5 PARENT N/A ATOM 1 N SER 1 29.314 7.220 10.501 1.00 0.00 ATOM 2 CA SER 1 30.162 8.290 11.068 1.00 0.00 ATOM 3 CB SER 1 31.579 8.167 10.541 1.00 0.00 ATOM 4 OG SER 1 32.176 6.955 10.914 1.00 0.00 ATOM 5 O SER 1 29.484 10.519 11.643 1.00 0.00 ATOM 6 C SER 1 29.602 9.673 10.755 1.00 0.00 ATOM 7 N MET 2 29.257 9.902 9.492 1.00 0.00 ATOM 8 CA MET 2 28.708 11.187 9.080 1.00 0.00 ATOM 9 CB MET 2 28.664 11.279 7.557 1.00 0.00 ATOM 10 CG MET 2 30.032 11.346 6.890 1.00 0.00 ATOM 11 SD MET 2 31.000 12.768 7.432 1.00 0.00 ATOM 12 CE MET 2 30.050 14.112 6.730 1.00 0.00 ATOM 13 O MET 2 26.914 12.585 9.841 1.00 0.00 ATOM 14 C MET 2 27.315 11.437 9.645 1.00 0.00 ATOM 15 N GLN 3 26.579 10.361 9.905 1.00 0.00 ATOM 16 CA GLN 3 25.232 10.481 10.451 1.00 0.00 ATOM 17 CB GLN 3 24.554 9.110 10.514 1.00 0.00 ATOM 18 CG GLN 3 24.194 8.530 9.158 1.00 0.00 ATOM 19 CD GLN 3 23.644 7.120 9.259 1.00 0.00 ATOM 20 OE1 GLN 3 23.613 6.526 10.341 1.00 0.00 ATOM 21 NE2 GLN 3 23.210 6.572 8.130 1.00 0.00 ATOM 22 O GLN 3 24.522 12.028 12.166 1.00 0.00 ATOM 23 C GLN 3 25.298 11.123 11.858 1.00 0.00 ATOM 24 N GLU 4 26.219 10.650 12.691 1.00 0.00 ATOM 25 CA GLU 4 26.367 11.187 14.039 1.00 0.00 ATOM 26 CB GLU 4 27.361 10.346 14.844 1.00 0.00 ATOM 27 CG GLU 4 26.885 8.934 15.151 1.00 0.00 ATOM 28 CD GLU 4 27.096 8.019 13.977 1.00 0.00 ATOM 29 OE1 GLU 4 27.631 8.465 12.990 1.00 0.00 ATOM 30 OE2 GLU 4 26.826 6.848 14.106 1.00 0.00 ATOM 31 O GLU 4 26.291 13.483 14.760 1.00 0.00 ATOM 32 C GLU 4 26.818 12.646 14.015 1.00 0.00 ATOM 33 N GLU 5 27.763 12.950 13.123 1.00 0.00 ATOM 34 CA GLU 5 28.247 14.314 12.947 1.00 0.00 ATOM 35 CB GLU 5 29.468 14.336 12.025 1.00 0.00 ATOM 36 CG GLU 5 30.085 15.713 11.830 1.00 0.00 ATOM 37 CD GLU 5 31.308 15.646 10.959 1.00 0.00 ATOM 38 OE1 GLU 5 31.658 14.568 10.541 1.00 0.00 ATOM 39 OE2 GLU 5 31.828 16.682 10.619 1.00 0.00 ATOM 40 O GLU 5 26.902 16.272 12.952 1.00 0.00 ATOM 41 C GLU 5 27.148 15.156 12.403 1.00 0.00 ATOM 42 N ASP 6 26.338 14.716 11.465 1.00 0.00 ATOM 43 CA ASP 6 25.213 15.465 10.966 1.00 0.00 ATOM 44 CB ASP 6 24.441 14.687 9.913 1.00 0.00 ATOM 45 CG ASP 6 25.099 14.603 8.591 1.00 0.00 ATOM 46 OD1 ASP 6 26.060 15.365 8.316 1.00 0.00 ATOM 47 OD2 ASP 6 24.674 13.760 7.748 1.00 0.00 ATOM 48 O ASP 6 23.629 16.783 12.260 1.00 0.00 ATOM 49 C ASP 6 24.229 15.717 12.101 1.00 0.00 ATOM 50 N THR 7 23.980 14.708 12.947 1.00 0.00 ATOM 51 CA THR 7 23.040 14.809 14.043 1.00 0.00 ATOM 52 CB THR 7 22.857 13.457 14.758 1.00 0.00 ATOM 53 CG2 THR 7 21.908 13.602 15.938 1.00 0.00 ATOM 54 OG1 THR 7 22.327 12.494 13.838 1.00 0.00 ATOM 55 O THR 7 22.722 16.691 15.498 1.00 0.00 ATOM 56 C THR 7 23.510 15.859 15.045 1.00 0.00 ATOM 57 N PHE 8 24.793 15.819 15.390 1.00 0.00 ATOM 58 CA PHE 8 25.344 16.772 16.332 1.00 0.00 ATOM 59 CB PHE 8 26.761 16.364 16.738 1.00 0.00 ATOM 60 CG PHE 8 26.806 15.245 17.739 1.00 0.00 ATOM 61 CD1 PHE 8 25.677 14.900 18.467 1.00 0.00 ATOM 62 CD2 PHE 8 27.978 14.535 17.956 1.00 0.00 ATOM 63 CE1 PHE 8 25.717 13.871 19.388 1.00 0.00 ATOM 64 CE2 PHE 8 28.021 13.505 18.876 1.00 0.00 ATOM 65 CZ PHE 8 26.889 13.173 19.593 1.00 0.00 ATOM 66 O PHE 8 25.036 19.146 16.475 1.00 0.00 ATOM 67 C PHE 8 25.360 18.189 15.771 1.00 0.00 ATOM 68 N ARG 9 25.735 18.322 14.502 1.00 0.00 ATOM 69 CA ARG 9 25.783 19.631 13.862 1.00 0.00 ATOM 70 CB ARG 9 26.432 19.574 12.487 1.00 0.00 ATOM 71 CG ARG 9 27.926 19.293 12.495 1.00 0.00 ATOM 72 CD ARG 9 28.553 19.271 11.149 1.00 0.00 ATOM 73 NE ARG 9 29.970 18.947 11.150 1.00 0.00 ATOM 74 CZ ARG 9 30.957 19.832 11.390 1.00 0.00 ATOM 75 NH1 ARG 9 30.690 21.100 11.612 1.00 0.00 ATOM 76 NH2 ARG 9 32.205 19.397 11.373 1.00 0.00 ATOM 77 O ARG 9 24.221 21.476 13.883 1.00 0.00 ATOM 78 C ARG 9 24.364 20.255 13.812 1.00 0.00 ATOM 79 N GLU 10 23.342 19.414 13.692 1.00 0.00 ATOM 80 CA GLU 10 21.968 19.899 13.639 1.00 0.00 ATOM 81 CB GLU 10 21.006 18.751 13.324 1.00 0.00 ATOM 82 CG GLU 10 19.548 19.170 13.191 1.00 0.00 ATOM 83 CD GLU 10 18.674 17.999 12.840 1.00 0.00 ATOM 84 OE1 GLU 10 19.190 16.917 12.701 1.00 0.00 ATOM 85 OE2 GLU 10 17.476 18.162 12.823 1.00 0.00 ATOM 86 O GLU 10 20.946 21.659 14.910 1.00 0.00 ATOM 87 C GLU 10 21.537 20.579 14.934 1.00 0.00 ATOM 88 N LEU 11 21.836 19.946 16.065 1.00 0.00 ATOM 89 CA LEU 11 21.479 20.501 17.329 1.00 0.00 ATOM 90 CB LEU 11 21.849 19.543 18.475 1.00 0.00 ATOM 91 CG LEU 11 21.530 20.028 19.858 1.00 0.00 ATOM 92 CD1 LEU 11 20.064 20.414 20.016 1.00 0.00 ATOM 93 CD2 LEU 11 21.908 18.956 20.899 1.00 0.00 ATOM 94 O LEU 11 21.514 22.791 18.041 1.00 0.00 ATOM 95 C LEU 11 22.144 21.853 17.549 1.00 0.00 ATOM 96 N ARG 12 23.413 21.955 17.175 1.00 0.00 ATOM 97 CA ARG 12 24.174 23.191 17.328 1.00 0.00 ATOM 98 CB ARG 12 25.665 22.978 17.109 1.00 0.00 ATOM 99 CG ARG 12 26.406 22.379 18.294 1.00 0.00 ATOM 100 CD ARG 12 27.843 22.104 18.043 1.00 0.00 ATOM 101 NE ARG 12 28.552 21.519 19.169 1.00 0.00 ATOM 102 CZ ARG 12 29.829 21.092 19.132 1.00 0.00 ATOM 103 NH1 ARG 12 30.529 21.148 18.021 1.00 0.00 ATOM 104 NH2 ARG 12 30.354 20.593 20.238 1.00 0.00 ATOM 105 O ARG 12 23.690 25.478 16.825 1.00 0.00 ATOM 106 C ARG 12 23.656 24.311 16.438 1.00 0.00 ATOM 107 N ILE 13 23.165 23.974 15.250 1.00 0.00 ATOM 108 CA ILE 13 22.613 25.021 14.393 1.00 0.00 ATOM 109 CB ILE 13 22.113 24.450 13.054 1.00 0.00 ATOM 110 CG1 ILE 13 23.291 23.946 12.215 1.00 0.00 ATOM 111 CG2 ILE 13 21.322 25.501 12.289 1.00 0.00 ATOM 112 CD1 ILE 13 22.879 23.129 11.012 1.00 0.00 ATOM 113 O ILE 13 21.446 26.957 15.222 1.00 0.00 ATOM 114 C ILE 13 21.467 25.728 15.121 1.00 0.00 ATOM 115 N PHE 14 20.536 24.930 15.650 1.00 0.00 ATOM 116 CA PHE 14 19.384 25.479 16.373 1.00 0.00 ATOM 117 CB PHE 14 18.406 24.363 16.746 1.00 0.00 ATOM 118 CG PHE 14 17.537 23.914 15.607 1.00 0.00 ATOM 119 CD1 PHE 14 17.840 22.761 14.897 1.00 0.00 ATOM 120 CD2 PHE 14 16.415 24.642 15.240 1.00 0.00 ATOM 121 CE1 PHE 14 17.040 22.346 13.848 1.00 0.00 ATOM 122 CE2 PHE 14 15.614 24.230 14.194 1.00 0.00 ATOM 123 CZ PHE 14 15.928 23.081 13.497 1.00 0.00 ATOM 124 O PHE 14 19.305 27.354 17.857 1.00 0.00 ATOM 125 C PHE 14 19.781 26.239 17.635 1.00 0.00 ATOM 126 N LEU 15 20.680 25.682 18.457 1.00 0.00 ATOM 127 CA LEU 15 21.061 26.352 19.665 1.00 0.00 ATOM 128 CB LEU 15 21.959 25.444 20.514 1.00 0.00 ATOM 129 CG LEU 15 21.260 24.226 21.130 1.00 0.00 ATOM 130 CD1 LEU 15 22.284 23.314 21.790 1.00 0.00 ATOM 131 CD2 LEU 15 20.223 24.693 22.142 1.00 0.00 ATOM 132 O LEU 15 21.563 28.659 20.018 1.00 0.00 ATOM 133 C LEU 15 21.763 27.657 19.338 1.00 0.00 ATOM 134 N ARG 16 22.587 27.587 18.346 1.00 0.00 ATOM 135 CA ARG 16 23.282 28.816 17.945 1.00 0.00 ATOM 136 CB ARG 16 24.277 28.572 16.820 1.00 0.00 ATOM 137 CG ARG 16 25.503 27.765 17.213 1.00 0.00 ATOM 138 CD ARG 16 26.407 27.433 16.082 1.00 0.00 ATOM 139 NE ARG 16 27.045 28.583 15.462 1.00 0.00 ATOM 140 CZ ARG 16 27.686 28.556 14.278 1.00 0.00 ATOM 141 NH1 ARG 16 27.810 27.437 13.599 1.00 0.00 ATOM 142 NH2 ARG 16 28.210 29.682 13.825 1.00 0.00 ATOM 143 O ARG 16 22.471 31.080 17.926 1.00 0.00 ATOM 144 C ARG 16 22.279 29.918 17.587 1.00 0.00 ATOM 145 N ASN 17 21.244 29.508 16.935 1.00 0.00 ATOM 146 CA ASN 17 20.214 30.480 16.589 1.00 0.00 ATOM 147 CB ASN 17 19.087 29.837 15.802 1.00 0.00 ATOM 148 CG ASN 17 19.457 29.493 14.386 1.00 0.00 ATOM 149 ND2 ASN 17 18.640 28.678 13.771 1.00 0.00 ATOM 150 OD1 ASN 17 20.432 30.016 13.833 1.00 0.00 ATOM 151 O ASN 17 19.538 32.377 17.848 1.00 0.00 ATOM 152 C ASN 17 19.670 31.155 17.811 1.00 0.00 ATOM 153 N VAL 18 19.352 30.386 18.846 1.00 0.00 ATOM 154 CA VAL 18 18.780 30.926 20.048 1.00 0.00 ATOM 155 CB VAL 18 18.400 29.914 21.094 1.00 0.00 ATOM 156 CG1 VAL 18 17.808 30.554 22.324 1.00 0.00 ATOM 157 CG2 VAL 18 17.407 28.912 20.484 1.00 0.00 ATOM 158 O VAL 18 19.328 32.980 21.082 1.00 0.00 ATOM 159 C VAL 18 19.704 31.867 20.711 1.00 0.00 ATOM 160 N THR 19 20.949 31.435 20.878 1.00 0.00 ATOM 161 CA THR 19 21.959 32.269 21.518 1.00 0.00 ATOM 162 CB THR 19 23.460 31.601 21.100 1.00 0.00 ATOM 163 CG2 THR 19 24.612 31.873 22.069 1.00 0.00 ATOM 164 OG1 THR 19 23.379 30.192 20.852 1.00 0.00 ATOM 165 O THR 19 22.363 34.622 21.264 1.00 0.00 ATOM 166 C THR 19 22.212 33.534 20.705 1.00 0.00 ATOM 167 N HIS 20 22.235 33.334 19.429 1.00 0.00 ATOM 168 CA HIS 20 22.462 34.454 18.528 1.00 0.00 ATOM 169 CB HIS 20 22.422 33.991 17.068 1.00 0.00 ATOM 170 CG HIS 20 23.587 33.136 16.677 1.00 0.00 ATOM 171 CD2 HIS 20 24.757 32.881 17.307 1.00 0.00 ATOM 172 ND1 HIS 20 23.624 32.423 15.497 1.00 0.00 ATOM 173 CE1 HIS 20 24.767 31.765 15.419 1.00 0.00 ATOM 174 NE2 HIS 20 25.471 32.025 16.505 1.00 0.00 ATOM 175 O HIS 20 21.807 36.698 18.919 1.00 0.00 ATOM 176 C HIS 20 21.447 35.533 18.757 1.00 0.00 ATOM 177 N ARG 21 20.153 35.176 18.827 1.00 0.00 ATOM 178 CA ARG 21 19.152 36.194 18.974 1.00 0.00 ATOM 179 CB ARG 21 17.741 35.630 18.881 1.00 0.00 ATOM 180 CG ARG 21 17.327 35.171 17.491 1.00 0.00 ATOM 181 CD ARG 21 15.974 34.561 17.426 1.00 0.00 ATOM 182 NE ARG 21 15.585 34.097 16.105 1.00 0.00 ATOM 183 CZ ARG 21 14.436 33.449 15.828 1.00 0.00 ATOM 184 NH1 ARG 21 13.580 33.152 16.781 1.00 0.00 ATOM 185 NH2 ARG 21 14.204 33.097 14.576 1.00 0.00 ATOM 186 O ARG 21 19.240 38.169 20.280 1.00 0.00 ATOM 187 C ARG 21 19.378 36.946 20.244 1.00 0.00 ATOM 188 N LEU 22 19.732 36.229 21.325 1.00 0.00 ATOM 189 CA LEU 22 19.846 36.860 22.607 1.00 0.00 ATOM 190 CB LEU 22 20.099 35.809 23.695 1.00 0.00 ATOM 191 CG LEU 22 18.837 35.175 24.296 1.00 0.00 ATOM 192 CD1 LEU 22 17.655 35.373 23.357 1.00 0.00 ATOM 193 CD2 LEU 22 19.082 33.695 24.548 1.00 0.00 ATOM 194 O LEU 22 20.750 39.045 22.840 1.00 0.00 ATOM 195 C LEU 22 20.947 37.867 22.541 1.00 0.00 ATOM 196 N ALA 23 22.127 37.430 22.077 1.00 0.00 ATOM 197 CA ALA 23 23.295 38.262 22.085 1.00 0.00 ATOM 198 CB ALA 23 24.544 37.534 21.564 1.00 0.00 ATOM 199 O ALA 23 23.420 40.597 21.550 1.00 0.00 ATOM 200 C ALA 23 23.090 39.470 21.181 1.00 0.00 ATOM 201 N ILE 24 22.514 39.221 20.004 1.00 0.00 ATOM 202 CA ILE 24 22.284 40.290 19.039 1.00 0.00 ATOM 203 CB ILE 24 21.862 39.732 17.668 1.00 0.00 ATOM 204 CG1 ILE 24 23.020 38.962 17.026 1.00 0.00 ATOM 205 CG2 ILE 24 21.397 40.857 16.756 1.00 0.00 ATOM 206 CD1 ILE 24 22.620 38.161 15.809 1.00 0.00 ATOM 207 O ILE 24 21.431 42.440 19.512 1.00 0.00 ATOM 208 C ILE 24 21.251 41.222 19.522 1.00 0.00 ATOM 209 N ASP 25 20.128 40.664 19.963 1.00 0.00 ATOM 210 CA ASP 25 19.028 41.477 20.471 1.00 0.00 ATOM 211 CB ASP 25 17.923 40.586 21.044 1.00 0.00 ATOM 212 CG ASP 25 16.652 41.331 21.432 1.00 0.00 ATOM 213 OD1 ASP 25 16.622 42.530 21.285 1.00 0.00 ATOM 214 OD2 ASP 25 15.673 40.684 21.719 1.00 0.00 ATOM 215 O ASP 25 20.262 42.107 22.418 1.00 0.00 ATOM 216 C ASP 25 19.489 42.458 21.525 1.00 0.00 ATOM 217 N LYS 26 19.015 43.696 21.427 1.00 0.00 ATOM 218 CA LYS 26 19.389 44.726 22.389 1.00 0.00 ATOM 219 CB LYS 26 18.800 46.078 21.983 1.00 0.00 ATOM 220 CG LYS 26 19.438 46.694 20.744 1.00 0.00 ATOM 221 CD LYS 26 18.801 48.034 20.404 1.00 0.00 ATOM 222 CE LYS 26 19.422 48.641 19.154 1.00 0.00 ATOM 223 NZ LYS 26 18.789 49.937 18.790 1.00 0.00 ATOM 224 O LYS 26 19.659 44.581 24.746 1.00 0.00 ATOM 225 C LYS 26 18.943 44.367 23.769 1.00 0.00 ATOM 226 N ARG 27 17.756 43.755 23.878 1.00 0.00 ATOM 227 CA ARG 27 17.191 43.502 25.169 1.00 0.00 ATOM 228 CB ARG 27 15.734 43.074 25.083 1.00 0.00 ATOM 229 CG ARG 27 15.049 42.867 26.425 1.00 0.00 ATOM 230 CD ARG 27 13.591 42.593 26.332 1.00 0.00 ATOM 231 NE ARG 27 12.938 42.369 27.612 1.00 0.00 ATOM 232 CZ ARG 27 11.646 42.015 27.759 1.00 0.00 ATOM 233 NH1 ARG 27 10.857 41.883 26.717 1.00 0.00 ATOM 234 NH2 ARG 27 11.186 41.830 28.985 1.00 0.00 ATOM 235 O ARG 27 18.136 42.592 27.175 1.00 0.00 ATOM 236 C ARG 27 18.025 42.487 25.952 1.00 0.00 ATOM 237 N PHE 28 18.578 41.564 25.225 1.00 0.00 ATOM 238 CA PHE 28 19.422 40.534 25.846 1.00 0.00 ATOM 239 CB PHE 28 18.947 39.106 25.286 1.00 0.00 ATOM 240 CG PHE 28 17.507 38.759 25.547 1.00 0.00 ATOM 241 CD1 PHE 28 17.104 38.301 26.798 1.00 0.00 ATOM 242 CD2 PHE 28 16.568 38.849 24.527 1.00 0.00 ATOM 243 CE1 PHE 28 15.777 37.975 27.026 1.00 0.00 ATOM 244 CE2 PHE 28 15.236 38.521 24.736 1.00 0.00 ATOM 245 CZ PHE 28 14.849 38.066 25.991 1.00 0.00 ATOM 246 O PHE 28 21.669 40.317 26.693 1.00 0.00 ATOM 247 C PHE 28 20.858 41.032 26.081 1.00 0.00 ATOM 248 N ARG 29 21.097 42.277 25.573 1.00 0.00 ATOM 249 CA ARG 29 22.517 42.676 25.514 1.00 0.00 ATOM 250 CB ARG 29 22.719 43.967 24.732 1.00 0.00 ATOM 251 CG ARG 29 24.170 44.378 24.543 1.00 0.00 ATOM 252 CD ARG 29 24.364 45.531 23.626 1.00 0.00 ATOM 253 NE ARG 29 25.735 46.010 23.543 1.00 0.00 ATOM 254 CZ ARG 29 26.138 47.043 22.777 1.00 0.00 ATOM 255 NH1 ARG 29 25.292 47.682 22.002 1.00 0.00 ATOM 256 NH2 ARG 29 27.415 47.382 22.809 1.00 0.00 ATOM 257 O ARG 29 24.359 42.644 26.988 1.00 0.00 ATOM 258 C ARG 29 23.143 42.776 26.876 1.00 0.00 ATOM 259 N VAL 30 22.380 43.017 27.952 1.00 0.00 ATOM 260 CA VAL 30 22.999 43.168 29.246 1.00 0.00 ATOM 261 CB VAL 30 21.951 43.420 30.346 1.00 0.00 ATOM 262 CG1 VAL 30 22.603 43.376 31.721 1.00 0.00 ATOM 263 CG2 VAL 30 21.262 44.759 30.130 1.00 0.00 ATOM 264 O VAL 30 24.865 42.064 30.232 1.00 0.00 ATOM 265 C VAL 30 23.809 41.955 29.609 1.00 0.00 ATOM 266 N PHE 31 23.316 40.762 29.252 1.00 0.00 ATOM 267 CA PHE 31 23.977 39.516 29.521 1.00 0.00 ATOM 268 CB PHE 31 22.848 38.337 28.960 1.00 0.00 ATOM 269 CG PHE 31 21.402 38.362 29.341 1.00 0.00 ATOM 270 CD1 PHE 31 20.498 39.167 28.657 1.00 0.00 ATOM 271 CD2 PHE 31 20.944 37.592 30.398 1.00 0.00 ATOM 272 CE1 PHE 31 19.158 39.198 29.026 1.00 0.00 ATOM 273 CE2 PHE 31 19.612 37.616 30.774 1.00 0.00 ATOM 274 CZ PHE 31 18.715 38.423 30.084 1.00 0.00 ATOM 275 O PHE 31 26.080 38.600 28.913 1.00 0.00 ATOM 276 C PHE 31 25.143 39.329 28.591 1.00 0.00 ATOM 277 N THR 32 25.112 39.960 27.401 1.00 0.00 ATOM 278 CA THR 32 26.079 39.678 26.372 1.00 0.00 ATOM 279 CB THR 32 25.849 40.553 25.125 1.00 0.00 ATOM 280 CG2 THR 32 26.911 40.271 24.074 1.00 0.00 ATOM 281 OG1 THR 32 24.554 40.277 24.577 1.00 0.00 ATOM 282 O THR 32 28.339 39.034 26.630 1.00 0.00 ATOM 283 C THR 32 27.482 39.887 26.851 1.00 0.00 ATOM 284 N LYS 33 27.780 41.008 27.519 1.00 0.00 ATOM 285 CA LYS 33 29.144 41.211 27.899 1.00 0.00 ATOM 286 CB LYS 33 29.523 42.687 27.769 1.00 0.00 ATOM 287 CG LYS 33 29.376 43.252 26.362 1.00 0.00 ATOM 288 CD LYS 33 30.340 42.584 25.394 1.00 0.00 ATOM 289 CE LYS 33 30.350 43.290 24.046 1.00 0.00 ATOM 290 NZ LYS 33 31.233 42.603 23.064 1.00 0.00 ATOM 291 O LYS 33 28.391 40.509 30.045 1.00 0.00 ATOM 292 C LYS 33 29.336 40.727 29.287 1.00 0.00 ATOM 293 N PRO 34 30.575 40.542 29.622 1.00 0.00 ATOM 294 CA PRO 34 30.897 40.183 30.963 1.00 0.00 ATOM 295 CB PRO 34 32.389 39.994 30.962 1.00 0.00 ATOM 296 CG PRO 34 32.857 40.788 29.792 1.00 0.00 ATOM 297 CD PRO 34 31.812 40.543 28.741 1.00 0.00 ATOM 298 O PRO 34 30.661 42.493 31.254 1.00 0.00 ATOM 299 C PRO 34 30.602 41.387 31.788 1.00 0.00 ATOM 300 N VAL 35 30.248 41.208 33.071 1.00 0.00 ATOM 301 CA VAL 35 29.975 42.361 33.870 1.00 0.00 ATOM 302 CB VAL 35 29.421 41.973 35.253 1.00 0.00 ATOM 303 CG1 VAL 35 29.268 43.206 36.131 1.00 0.00 ATOM 304 CG2 VAL 35 28.088 41.253 35.112 1.00 0.00 ATOM 305 O VAL 35 32.363 42.433 34.153 1.00 0.00 ATOM 306 C VAL 35 31.339 43.067 33.933 1.00 0.00 ATOM 307 N ASP 36 31.333 44.305 33.717 1.00 0.00 ATOM 308 CA ASP 36 32.582 45.051 33.854 1.00 0.00 ATOM 309 CB ASP 36 32.451 46.438 33.221 1.00 0.00 ATOM 310 CG ASP 36 33.739 47.250 33.214 1.00 0.00 ATOM 311 OD1 ASP 36 34.719 46.778 33.740 1.00 0.00 ATOM 312 OD2 ASP 36 33.777 48.260 32.553 1.00 0.00 ATOM 313 O ASP 36 32.211 45.586 36.148 1.00 0.00 ATOM 314 C ASP 36 32.992 45.184 35.284 1.00 0.00 ATOM 315 N PRO 37 34.215 44.814 35.541 1.00 0.00 ATOM 316 CA PRO 37 34.745 44.898 36.871 1.00 0.00 ATOM 317 CB PRO 37 36.050 44.104 36.850 1.00 0.00 ATOM 318 CG PRO 37 35.820 43.063 35.740 1.00 0.00 ATOM 319 CD PRO 37 34.840 43.749 34.772 1.00 0.00 ATOM 320 O PRO 37 34.786 46.500 38.580 1.00 0.00 ATOM 321 C PRO 37 34.893 46.301 37.371 1.00 0.00 ATOM 322 N ASP 38 35.162 47.291 36.494 1.00 0.00 ATOM 323 CA ASP 38 35.307 48.596 37.066 1.00 0.00 ATOM 324 CB ASP 38 35.850 49.579 36.026 1.00 0.00 ATOM 325 CG ASP 38 37.322 49.385 35.686 1.00 0.00 ATOM 326 OD1 ASP 38 37.988 48.672 36.399 1.00 0.00 ATOM 327 OD2 ASP 38 37.732 49.822 34.637 1.00 0.00 ATOM 328 O ASP 38 33.850 49.676 38.636 1.00 0.00 ATOM 329 C ASP 38 33.943 49.022 37.597 1.00 0.00 ATOM 330 N GLU 39 32.884 48.651 36.882 1.00 0.00 ATOM 331 CA GLU 39 31.584 48.996 37.293 1.00 0.00 ATOM 332 CB GLU 39 30.557 48.557 36.247 1.00 0.00 ATOM 333 CG GLU 39 29.120 48.931 36.582 1.00 0.00 ATOM 334 CD GLU 39 28.173 48.481 35.504 1.00 0.00 ATOM 335 OE1 GLU 39 28.628 47.915 34.538 1.00 0.00 ATOM 336 OE2 GLU 39 26.986 48.601 35.695 1.00 0.00 ATOM 337 O GLU 39 30.929 49.022 39.578 1.00 0.00 ATOM 338 C GLU 39 31.328 48.358 38.621 1.00 0.00 ATOM 339 N VAL 40 31.556 47.050 38.694 1.00 0.00 ATOM 340 CA VAL 40 31.345 46.316 39.936 1.00 0.00 ATOM 341 CB VAL 40 30.330 45.171 39.751 1.00 0.00 ATOM 342 CG1 VAL 40 30.145 44.409 41.054 1.00 0.00 ATOM 343 CG2 VAL 40 28.997 45.716 39.260 1.00 0.00 ATOM 344 O VAL 40 33.210 44.846 39.819 1.00 0.00 ATOM 345 C VAL 40 32.661 45.779 40.402 1.00 0.00 ATOM 346 N PRO 41 33.189 46.355 41.440 1.00 0.00 ATOM 347 CA PRO 41 34.476 45.919 41.906 1.00 0.00 ATOM 348 CB PRO 41 34.808 46.862 43.082 1.00 0.00 ATOM 349 CG PRO 41 33.532 47.595 43.395 1.00 0.00 ATOM 350 CD PRO 41 32.602 47.462 42.252 1.00 0.00 ATOM 351 O PRO 41 35.547 43.852 42.196 1.00 0.00 ATOM 352 C PRO 41 34.569 44.543 42.474 1.00 0.00 ATOM 353 N ASP 42 33.589 44.094 43.268 1.00 0.00 ATOM 354 CA ASP 42 33.811 42.801 43.834 1.00 0.00 ATOM 355 CB ASP 42 33.529 42.819 45.338 1.00 0.00 ATOM 356 CG ASP 42 34.436 43.746 46.137 1.00 0.00 ATOM 357 OD1 ASP 42 35.628 43.678 45.958 1.00 0.00 ATOM 358 OD2 ASP 42 33.924 44.619 46.798 1.00 0.00 ATOM 359 O ASP 42 32.605 40.775 43.815 1.00 0.00 ATOM 360 C ASP 42 32.989 41.765 43.193 1.00 0.00 ATOM 361 N TYR 43 32.697 41.972 41.914 1.00 0.00 ATOM 362 CA TYR 43 31.891 41.018 41.159 1.00 0.00 ATOM 363 CB TYR 43 31.605 41.438 39.705 1.00 0.00 ATOM 364 CG TYR 43 30.750 40.389 39.077 1.00 0.00 ATOM 365 CD1 TYR 43 29.397 40.358 39.320 1.00 0.00 ATOM 366 CD2 TYR 43 31.294 39.448 38.234 1.00 0.00 ATOM 367 CE1 TYR 43 28.602 39.396 38.742 1.00 0.00 ATOM 368 CE2 TYR 43 30.505 38.484 37.650 1.00 0.00 ATOM 369 CZ TYR 43 29.156 38.458 37.905 1.00 0.00 ATOM 370 OH TYR 43 28.342 37.472 37.310 1.00 0.00 ATOM 371 O TYR 43 32.053 38.652 41.264 1.00 0.00 ATOM 372 C TYR 43 32.627 39.725 41.072 1.00 0.00 ATOM 373 N VAL 44 33.920 39.808 40.776 1.00 0.00 ATOM 374 CA VAL 44 34.747 38.614 40.666 1.00 0.00 ATOM 375 CB VAL 44 36.184 38.960 40.234 1.00 0.00 ATOM 376 CG1 VAL 44 37.076 37.730 40.317 1.00 0.00 ATOM 377 CG2 VAL 44 36.194 39.529 38.823 1.00 0.00 ATOM 378 O VAL 44 34.737 36.631 41.951 1.00 0.00 ATOM 379 C VAL 44 34.801 37.858 41.949 1.00 0.00 ATOM 380 N THR 45 34.914 38.564 43.087 1.00 0.00 ATOM 381 CA THR 45 35.056 37.834 44.309 1.00 0.00 ATOM 382 CB THR 45 35.275 38.776 45.508 1.00 0.00 ATOM 383 CG2 THR 45 35.369 37.980 46.802 1.00 0.00 ATOM 384 OG1 THR 45 36.486 39.519 45.320 1.00 0.00 ATOM 385 O THR 45 33.950 35.798 44.933 1.00 0.00 ATOM 386 C THR 45 33.830 36.972 44.563 1.00 0.00 ATOM 387 N VAL 46 32.664 37.530 44.342 1.00 0.00 ATOM 388 CA VAL 46 31.420 36.834 44.611 1.00 0.00 ATOM 389 CB VAL 46 30.217 37.796 44.584 1.00 0.00 ATOM 390 CG1 VAL 46 28.912 37.020 44.687 1.00 0.00 ATOM 391 CG2 VAL 46 30.322 38.811 45.713 1.00 0.00 ATOM 392 O VAL 46 30.802 34.627 44.011 1.00 0.00 ATOM 393 C VAL 46 31.178 35.733 43.627 1.00 0.00 ATOM 394 N ILE 47 31.400 35.992 42.324 1.00 0.00 ATOM 395 CA ILE 47 31.007 34.990 41.376 1.00 0.00 ATOM 396 CB ILE 47 30.271 35.608 40.173 1.00 0.00 ATOM 397 CG1 ILE 47 28.992 36.311 40.633 1.00 0.00 ATOM 398 CG2 ILE 47 29.954 34.540 39.138 1.00 0.00 ATOM 399 CD1 ILE 47 28.073 35.432 41.452 1.00 0.00 ATOM 400 O ILE 47 33.107 34.813 40.228 1.00 0.00 ATOM 401 C ILE 47 32.258 34.248 40.920 1.00 0.00 ATOM 402 N LYS 48 32.373 32.981 41.309 1.00 0.00 ATOM 403 CA LYS 48 33.488 32.220 40.936 1.00 0.00 ATOM 404 CB LYS 48 33.541 30.919 41.740 1.00 0.00 ATOM 405 CG LYS 48 34.754 30.047 41.445 1.00 0.00 ATOM 406 CD LYS 48 34.785 28.819 42.344 1.00 0.00 ATOM 407 CE LYS 48 35.982 27.934 42.032 1.00 0.00 ATOM 408 NZ LYS 48 36.010 26.715 42.885 1.00 0.00 ATOM 409 O LYS 48 34.537 31.975 38.826 1.00 0.00 ATOM 410 C LYS 48 33.499 31.906 39.487 1.00 0.00 ATOM 411 N GLN 49 32.332 31.553 38.958 1.00 0.00 ATOM 412 CA GLN 49 32.211 31.223 37.543 1.00 0.00 ATOM 413 CB GLN 49 31.605 29.828 37.367 1.00 0.00 ATOM 414 CG GLN 49 32.481 28.700 37.886 1.00 0.00 ATOM 415 CD GLN 49 33.769 28.557 37.098 1.00 0.00 ATOM 416 OE1 GLN 49 33.770 28.629 35.866 1.00 0.00 ATOM 417 NE2 GLN 49 34.874 28.351 37.804 1.00 0.00 ATOM 418 O GLN 49 30.168 32.048 36.659 1.00 0.00 ATOM 419 C GLN 49 31.379 32.215 36.804 1.00 0.00 ATOM 420 N PRO 50 32.012 33.243 36.323 1.00 0.00 ATOM 421 CA PRO 50 31.277 34.215 35.574 1.00 0.00 ATOM 422 CB PRO 50 32.203 35.420 35.433 1.00 0.00 ATOM 423 CG PRO 50 33.133 35.299 36.651 1.00 0.00 ATOM 424 CD PRO 50 33.191 33.789 36.936 1.00 0.00 ATOM 425 O PRO 50 31.670 32.948 33.648 1.00 0.00 ATOM 426 C PRO 50 30.886 33.683 34.246 1.00 0.00 ATOM 427 N MET 51 29.679 34.024 33.772 1.00 0.00 ATOM 428 CA MET 51 29.288 33.554 32.484 1.00 0.00 ATOM 429 CB MET 51 28.425 32.301 32.619 1.00 0.00 ATOM 430 CG MET 51 28.099 31.615 31.299 1.00 0.00 ATOM 431 SD MET 51 29.575 31.091 30.406 1.00 0.00 ATOM 432 CE MET 51 30.135 29.741 31.440 1.00 0.00 ATOM 433 O MET 51 27.806 35.439 32.411 1.00 0.00 ATOM 434 C MET 51 28.549 34.687 31.780 1.00 0.00 ATOM 435 N ASP 52 28.752 34.806 30.472 1.00 0.00 ATOM 436 CA ASP 52 28.116 35.812 29.746 1.00 0.00 ATOM 437 CB ASP 52 28.975 37.079 29.716 1.00 0.00 ATOM 438 CG ASP 52 30.385 36.869 29.177 1.00 0.00 ATOM 439 OD1 ASP 52 30.541 36.828 27.980 1.00 0.00 ATOM 440 OD2 ASP 52 31.308 36.910 29.954 1.00 0.00 ATOM 441 O ASP 52 28.499 34.217 27.995 1.00 0.00 ATOM 442 C ASP 52 27.876 35.214 28.365 1.00 0.00 ATOM 443 N LEU 53 26.972 35.821 27.603 1.00 0.00 ATOM 444 CA LEU 53 26.683 35.342 26.307 1.00 0.00 ATOM 445 CB LEU 53 25.517 36.130 25.698 1.00 0.00 ATOM 446 CG LEU 53 24.189 35.367 25.609 1.00 0.00 ATOM 447 CD1 LEU 53 24.217 34.160 26.537 1.00 0.00 ATOM 448 CD2 LEU 53 23.041 36.298 25.969 1.00 0.00 ATOM 449 O LEU 53 28.045 34.489 24.526 1.00 0.00 ATOM 450 C LEU 53 27.863 35.393 25.343 1.00 0.00 ATOM 451 N SER 54 28.664 36.450 25.439 1.00 0.00 ATOM 452 CA SER 54 29.789 36.585 24.588 1.00 0.00 ATOM 453 CB SER 54 30.509 37.888 24.878 1.00 0.00 ATOM 454 OG SER 54 31.640 38.056 24.069 1.00 0.00 ATOM 455 O SER 54 31.111 34.742 23.806 1.00 0.00 ATOM 456 C SER 54 30.714 35.387 24.776 1.00 0.00 ATOM 457 N SER 55 31.053 35.091 26.027 1.00 0.00 ATOM 458 CA SER 55 31.910 33.990 26.308 1.00 0.00 ATOM 459 CB SER 55 32.280 33.979 27.779 1.00 0.00 ATOM 460 OG SER 55 33.049 35.095 28.135 1.00 0.00 ATOM 461 O SER 55 31.952 31.749 25.526 1.00 0.00 ATOM 462 C SER 55 31.274 32.697 25.925 1.00 0.00 ATOM 463 N VAL 56 29.951 32.638 26.042 1.00 0.00 ATOM 464 CA VAL 56 29.214 31.429 25.695 1.00 0.00 ATOM 465 CB VAL 56 27.720 31.558 26.042 1.00 0.00 ATOM 466 CG1 VAL 56 26.922 30.438 25.389 1.00 0.00 ATOM 467 CG2 VAL 56 27.520 31.544 27.551 1.00 0.00 ATOM 468 O VAL 56 29.684 30.054 23.785 1.00 0.00 ATOM 469 C VAL 56 29.409 31.180 24.203 1.00 0.00 ATOM 470 N ILE 57 29.267 32.231 23.402 1.00 0.00 ATOM 471 CA ILE 57 29.432 32.101 22.001 1.00 0.00 ATOM 472 CB ILE 57 29.243 33.449 21.282 1.00 0.00 ATOM 473 CG1 ILE 57 27.786 33.909 21.382 1.00 0.00 ATOM 474 CG2 ILE 57 29.671 33.340 19.826 1.00 0.00 ATOM 475 CD1 ILE 57 27.564 35.337 20.942 1.00 0.00 ATOM 476 O ILE 57 30.938 30.637 20.842 1.00 0.00 ATOM 477 C ILE 57 30.810 31.539 21.672 1.00 0.00 ATOM 478 N SER 58 31.839 32.070 22.323 1.00 0.00 ATOM 479 CA SER 58 33.145 31.617 22.086 1.00 0.00 ATOM 480 CB SER 58 34.128 32.379 22.953 1.00 0.00 ATOM 481 OG SER 58 34.195 33.735 22.605 1.00 0.00 ATOM 482 O SER 58 33.946 29.436 21.570 1.00 0.00 ATOM 483 C SER 58 33.287 30.145 22.330 1.00 0.00 ATOM 484 N LYS 59 32.663 29.666 23.402 1.00 0.00 ATOM 485 CA LYS 59 32.725 28.249 23.742 1.00 0.00 ATOM 486 CB LYS 59 32.028 27.988 25.079 1.00 0.00 ATOM 487 CG LYS 59 32.780 28.513 26.294 1.00 0.00 ATOM 488 CD LYS 59 32.043 28.189 27.584 1.00 0.00 ATOM 489 CE LYS 59 32.743 28.797 28.791 1.00 0.00 ATOM 490 NZ LYS 59 34.088 28.198 29.013 1.00 0.00 ATOM 491 O LYS 59 32.626 26.265 22.389 1.00 0.00 ATOM 492 C LYS 59 32.108 27.356 22.671 1.00 0.00 ATOM 493 N ILE 60 31.057 27.856 22.114 1.00 0.00 ATOM 494 CA ILE 60 30.432 27.143 20.988 1.00 0.00 ATOM 495 CB ILE 60 29.218 27.911 20.435 1.00 0.00 ATOM 496 CG1 ILE 60 28.082 27.926 21.463 1.00 0.00 ATOM 497 CG2 ILE 60 28.747 27.295 19.127 1.00 0.00 ATOM 498 CD1 ILE 60 26.961 28.879 21.120 1.00 0.00 ATOM 499 O ILE 60 31.656 25.868 19.406 1.00 0.00 ATOM 500 C ILE 60 31.484 26.963 19.937 1.00 0.00 ATOM 501 N ASP 61 32.212 28.051 19.612 1.00 0.00 ATOM 502 CA ASP 61 33.281 28.024 18.648 1.00 0.00 ATOM 503 CB ASP 61 33.866 29.425 18.457 1.00 0.00 ATOM 504 CG ASP 61 32.970 30.380 17.681 1.00 0.00 ATOM 505 OD1 ASP 61 32.016 29.925 17.096 1.00 0.00 ATOM 506 OD2 ASP 61 33.151 31.568 17.808 1.00 0.00 ATOM 507 O ASP 61 34.980 26.388 18.288 1.00 0.00 ATOM 508 C ASP 61 34.339 27.052 19.102 1.00 0.00 ATOM 509 N LEU 62 34.578 26.984 20.424 1.00 0.00 ATOM 510 CA LEU 62 35.536 26.106 21.044 1.00 0.00 ATOM 511 CB LEU 62 35.709 26.472 22.524 1.00 0.00 ATOM 512 CG LEU 62 36.350 27.841 22.788 1.00 0.00 ATOM 513 CD1 LEU 62 36.352 28.137 24.280 1.00 0.00 ATOM 514 CD2 LEU 62 37.767 27.854 22.232 1.00 0.00 ATOM 515 O LEU 62 36.009 23.805 21.114 1.00 0.00 ATOM 516 C LEU 62 35.156 24.668 20.925 1.00 0.00 ATOM 517 N HIS 63 33.876 24.366 20.628 1.00 0.00 ATOM 518 CA HIS 63 33.415 23.005 20.588 1.00 0.00 ATOM 519 CB HIS 63 34.358 22.138 19.748 1.00 0.00 ATOM 520 CG HIS 63 34.541 22.632 18.346 1.00 0.00 ATOM 521 CD2 HIS 63 35.608 23.196 17.731 1.00 0.00 ATOM 522 ND1 HIS 63 33.541 22.569 17.399 1.00 0.00 ATOM 523 CE1 HIS 63 33.984 23.074 16.261 1.00 0.00 ATOM 524 NE2 HIS 63 35.235 23.461 16.437 1.00 0.00 ATOM 525 O HIS 63 33.387 21.268 22.219 1.00 0.00 ATOM 526 C HIS 63 33.302 22.471 21.980 1.00 0.00 ATOM 527 N LYS 64 33.125 23.384 22.951 1.00 0.00 ATOM 528 CA LYS 64 32.902 23.010 24.314 1.00 0.00 ATOM 529 CB LYS 64 32.976 24.236 25.225 1.00 0.00 ATOM 530 CG LYS 64 34.367 24.843 25.351 1.00 0.00 ATOM 531 CD LYS 64 35.323 23.896 26.060 1.00 0.00 ATOM 532 CE LYS 64 36.702 24.517 26.223 1.00 0.00 ATOM 533 NZ LYS 64 37.644 23.606 26.926 1.00 0.00 ATOM 534 O LYS 64 31.495 21.457 25.414 1.00 0.00 ATOM 535 C LYS 64 31.587 22.317 24.539 1.00 0.00 ATOM 536 N TYR 65 30.530 22.642 23.761 1.00 0.00 ATOM 537 CA TYR 65 29.235 22.112 24.117 1.00 0.00 ATOM 538 CB TYR 65 28.063 23.082 23.892 1.00 0.00 ATOM 539 CG TYR 65 28.247 24.315 24.700 1.00 0.00 ATOM 540 CD1 TYR 65 27.979 24.337 26.050 1.00 0.00 ATOM 541 CD2 TYR 65 28.676 25.467 24.083 1.00 0.00 ATOM 542 CE1 TYR 65 28.147 25.497 26.769 1.00 0.00 ATOM 543 CE2 TYR 65 28.844 26.627 24.795 1.00 0.00 ATOM 544 CZ TYR 65 28.580 26.641 26.140 1.00 0.00 ATOM 545 OH TYR 65 28.752 27.836 26.868 1.00 0.00 ATOM 546 O TYR 65 28.448 21.020 22.131 1.00 0.00 ATOM 547 C TYR 65 28.836 20.892 23.293 1.00 0.00 ATOM 548 N LEU 66 28.934 19.711 23.895 1.00 0.00 ATOM 549 CA LEU 66 28.579 18.491 23.205 1.00 0.00 ATOM 550 CB LEU 66 29.232 17.285 23.893 1.00 0.00 ATOM 551 CG LEU 66 30.763 17.240 23.817 1.00 0.00 ATOM 552 CD1 LEU 66 31.292 16.073 24.639 1.00 0.00 ATOM 553 CD2 LEU 66 31.197 17.117 22.364 1.00 0.00 ATOM 554 O LEU 66 26.515 17.831 22.238 1.00 0.00 ATOM 555 C LEU 66 27.085 18.379 23.182 1.00 0.00 ATOM 556 N THR 67 26.406 18.862 24.242 1.00 0.00 ATOM 557 CA THR 67 24.984 18.667 24.296 1.00 0.00 ATOM 558 CB THR 67 24.602 17.658 25.427 1.00 0.00 ATOM 559 CG2 THR 67 25.395 16.366 25.329 1.00 0.00 ATOM 560 OG1 THR 67 24.974 18.199 26.708 1.00 0.00 ATOM 561 O THR 67 24.835 20.987 24.909 1.00 0.00 ATOM 562 C THR 67 24.251 19.951 24.580 1.00 0.00 ATOM 563 N VAL 68 22.953 19.883 24.494 1.00 0.00 ATOM 564 CA VAL 68 22.094 21.007 24.853 1.00 0.00 ATOM 565 CB VAL 68 20.616 20.711 24.540 1.00 0.00 ATOM 566 CG1 VAL 68 20.156 19.460 25.273 1.00 0.00 ATOM 567 CG2 VAL 68 19.743 21.899 24.916 1.00 0.00 ATOM 568 O VAL 68 22.253 22.541 26.663 1.00 0.00 ATOM 569 C VAL 68 22.209 21.367 26.299 1.00 0.00 ATOM 570 N LYS 69 22.285 20.339 27.162 1.00 0.00 ATOM 571 CA LYS 69 22.263 20.523 28.582 1.00 0.00 ATOM 572 CB LYS 69 22.282 19.171 29.297 1.00 0.00 ATOM 573 CG LYS 69 20.996 18.366 29.155 1.00 0.00 ATOM 574 CD LYS 69 21.091 17.038 29.890 1.00 0.00 ATOM 575 CE LYS 69 19.816 16.222 29.728 1.00 0.00 ATOM 576 NZ LYS 69 19.907 14.905 30.414 1.00 0.00 ATOM 577 O LYS 69 23.298 22.297 29.852 1.00 0.00 ATOM 578 C LYS 69 23.443 21.378 29.023 1.00 0.00 ATOM 579 N ASP 70 24.624 21.056 28.514 1.00 0.00 ATOM 580 CA ASP 70 25.780 21.845 28.865 1.00 0.00 ATOM 581 CB ASP 70 27.029 21.307 28.163 1.00 0.00 ATOM 582 CG ASP 70 27.550 19.991 28.725 1.00 0.00 ATOM 583 OD1 ASP 70 27.106 19.602 29.780 1.00 0.00 ATOM 584 OD2 ASP 70 28.263 19.311 28.027 1.00 0.00 ATOM 585 O ASP 70 25.934 24.206 29.260 1.00 0.00 ATOM 586 C ASP 70 25.555 23.310 28.505 1.00 0.00 ATOM 587 N TYR 71 24.937 23.551 27.353 1.00 0.00 ATOM 588 CA TYR 71 24.679 24.880 26.934 1.00 0.00 ATOM 589 CB TYR 71 24.107 24.892 25.515 1.00 0.00 ATOM 590 CG TYR 71 23.560 26.235 25.086 1.00 0.00 ATOM 591 CD1 TYR 71 24.409 27.252 24.673 1.00 0.00 ATOM 592 CD2 TYR 71 22.195 26.483 25.093 1.00 0.00 ATOM 593 CE1 TYR 71 23.916 28.480 24.280 1.00 0.00 ATOM 594 CE2 TYR 71 21.690 27.708 24.702 1.00 0.00 ATOM 595 CZ TYR 71 22.554 28.704 24.296 1.00 0.00 ATOM 596 OH TYR 71 22.056 29.926 23.905 1.00 0.00 ATOM 597 O TYR 71 23.957 26.715 28.268 1.00 0.00 ATOM 598 C TYR 71 23.737 25.568 27.878 1.00 0.00 ATOM 599 N LEU 72 22.671 24.870 28.256 1.00 0.00 ATOM 600 CA LEU 72 21.685 25.432 29.171 1.00 0.00 ATOM 601 CB LEU 72 20.485 24.485 29.304 1.00 0.00 ATOM 602 CG LEU 72 19.365 24.978 30.229 1.00 0.00 ATOM 603 CD1 LEU 72 18.792 26.287 29.706 1.00 0.00 ATOM 604 CD2 LEU 72 18.281 23.915 30.325 1.00 0.00 ATOM 605 O LEU 72 21.965 26.743 31.161 1.00 0.00 ATOM 606 C LEU 72 22.270 25.717 30.551 1.00 0.00 ATOM 607 N ARG 73 23.111 24.810 31.038 1.00 0.00 ATOM 608 CA ARG 73 23.709 24.987 32.314 1.00 0.00 ATOM 609 CB ARG 73 24.598 23.813 32.699 1.00 0.00 ATOM 610 CG ARG 73 25.225 23.912 34.080 1.00 0.00 ATOM 611 CD ARG 73 26.092 22.761 34.443 1.00 0.00 ATOM 612 NE ARG 73 27.260 22.595 33.592 1.00 0.00 ATOM 613 CZ ARG 73 27.382 21.653 32.637 1.00 0.00 ATOM 614 NH1 ARG 73 26.432 20.768 32.433 1.00 0.00 ATOM 615 NH2 ARG 73 28.497 21.626 31.926 1.00 0.00 ATOM 616 O ARG 73 24.361 26.986 33.422 1.00 0.00 ATOM 617 C ARG 73 24.460 26.275 32.421 1.00 0.00 ATOM 618 N ASP 74 25.225 26.594 31.383 1.00 0.00 ATOM 619 CA ASP 74 26.004 27.826 31.368 1.00 0.00 ATOM 620 CB ASP 74 26.913 28.008 30.144 1.00 0.00 ATOM 621 CG ASP 74 28.084 27.057 30.331 1.00 0.00 ATOM 622 OD1 ASP 74 27.991 26.175 31.225 1.00 0.00 ATOM 623 OD2 ASP 74 29.094 27.203 29.593 1.00 0.00 ATOM 624 O ASP 74 25.383 29.982 32.125 1.00 0.00 ATOM 625 C ASP 74 25.091 28.989 31.457 1.00 0.00 ATOM 626 N ILE 75 23.953 28.888 30.779 1.00 0.00 ATOM 627 CA ILE 75 22.968 29.963 30.788 1.00 0.00 ATOM 628 CB ILE 75 21.807 29.674 29.820 1.00 0.00 ATOM 629 CG1 ILE 75 22.287 29.766 28.368 1.00 0.00 ATOM 630 CG2 ILE 75 20.658 30.639 30.065 1.00 0.00 ATOM 631 CD1 ILE 75 22.816 31.129 27.985 1.00 0.00 ATOM 632 O ILE 75 22.292 31.228 32.711 1.00 0.00 ATOM 633 C ILE 75 22.466 30.112 32.220 1.00 0.00 ATOM 634 N ASP 76 22.234 28.986 32.888 1.00 0.00 ATOM 635 CA ASP 76 21.771 29.023 34.216 1.00 0.00 ATOM 636 CB ASP 76 21.571 27.604 34.753 1.00 0.00 ATOM 637 CG ASP 76 21.160 27.538 36.218 1.00 0.00 ATOM 638 OD1 ASP 76 20.115 28.051 36.545 1.00 0.00 ATOM 639 OD2 ASP 76 21.808 26.846 36.966 1.00 0.00 ATOM 640 O ASP 76 22.341 30.498 36.021 1.00 0.00 ATOM 641 C ASP 76 22.749 29.796 35.093 1.00 0.00 ATOM 642 N LEU 77 24.040 29.669 34.801 1.00 0.00 ATOM 643 CA LEU 77 25.038 30.355 35.563 1.00 0.00 ATOM 644 CB LEU 77 26.439 29.970 35.070 1.00 0.00 ATOM 645 CG LEU 77 26.863 28.527 35.369 1.00 0.00 ATOM 646 CD1 LEU 77 28.184 28.217 34.679 1.00 0.00 ATOM 647 CD2 LEU 77 26.981 28.332 36.873 1.00 0.00 ATOM 648 O LEU 77 25.075 32.567 36.492 1.00 0.00 ATOM 649 C LEU 77 24.861 31.869 35.500 1.00 0.00 ATOM 650 N ILE 78 24.470 32.373 34.333 1.00 0.00 ATOM 651 CA ILE 78 24.279 33.748 34.184 1.00 0.00 ATOM 652 CB ILE 78 23.846 34.158 32.765 1.00 0.00 ATOM 653 CG1 ILE 78 24.972 33.817 31.785 1.00 0.00 ATOM 654 CG2 ILE 78 23.503 35.645 32.707 1.00 0.00 ATOM 655 CD1 ILE 78 24.583 33.969 30.330 1.00 0.00 ATOM 656 O ILE 78 23.485 35.168 35.956 1.00 0.00 ATOM 657 C ILE 78 23.264 34.202 35.225 1.00 0.00 ATOM 658 N CYS 79 22.126 33.486 35.282 1.00 0.00 ATOM 659 CA CYS 79 21.092 33.868 36.193 1.00 0.00 ATOM 660 CB CYS 79 19.832 33.000 36.030 1.00 0.00 ATOM 661 SG CYS 79 18.460 33.530 37.091 1.00 0.00 ATOM 662 O CYS 79 21.370 34.704 38.424 1.00 0.00 ATOM 663 C CYS 79 21.528 33.761 37.649 1.00 0.00 ATOM 664 N SER 80 22.079 32.609 38.020 1.00 0.00 ATOM 665 CA SER 80 22.533 32.400 39.381 1.00 0.00 ATOM 666 CB SER 80 23.057 30.987 39.545 1.00 0.00 ATOM 667 OG SER 80 22.044 30.030 39.404 1.00 0.00 ATOM 668 O SER 80 23.510 33.826 40.982 1.00 0.00 ATOM 669 C SER 80 23.569 33.321 39.860 1.00 0.00 ATOM 670 N ASN 81 24.559 33.568 39.008 1.00 0.00 ATOM 671 CA ASN 81 25.651 34.468 39.359 1.00 0.00 ATOM 672 CB ASN 81 26.707 34.511 38.270 1.00 0.00 ATOM 673 CG ASN 81 27.435 33.209 38.082 1.00 0.00 ATOM 674 ND2 ASN 81 27.917 33.000 36.883 1.00 0.00 ATOM 675 OD1 ASN 81 27.623 32.437 39.028 1.00 0.00 ATOM 676 O ASN 81 25.397 36.459 40.633 1.00 0.00 ATOM 677 C ASN 81 25.077 35.820 39.629 1.00 0.00 ATOM 678 N ALA 82 24.212 36.279 38.730 1.00 0.00 ATOM 679 CA ALA 82 23.581 37.585 38.884 1.00 0.00 ATOM 680 CB ALA 82 22.707 37.878 37.681 1.00 0.00 ATOM 681 O ALA 82 22.779 38.777 40.809 1.00 0.00 ATOM 682 C ALA 82 22.787 37.724 40.154 1.00 0.00 ATOM 683 N LEU 83 22.075 36.648 40.558 1.00 0.00 ATOM 684 CA LEU 83 21.260 36.745 41.733 1.00 0.00 ATOM 685 CB LEU 83 20.343 35.520 41.845 1.00 0.00 ATOM 686 CG LEU 83 19.394 35.524 43.049 1.00 0.00 ATOM 687 CD1 LEU 83 18.465 36.729 42.981 1.00 0.00 ATOM 688 CD2 LEU 83 18.595 34.229 43.071 1.00 0.00 ATOM 689 O LEU 83 21.739 37.643 43.872 1.00 0.00 ATOM 690 C LEU 83 22.086 36.881 42.972 1.00 0.00 ATOM 691 N GLU 84 23.212 36.152 43.056 1.00 0.00 ATOM 692 CA GLU 84 23.969 36.156 44.275 1.00 0.00 ATOM 693 CB GLU 84 25.088 35.114 44.215 1.00 0.00 ATOM 694 CG GLU 84 25.913 35.005 45.489 1.00 0.00 ATOM 695 CD GLU 84 26.965 33.937 45.368 1.00 0.00 ATOM 696 OE1 GLU 84 27.034 33.311 44.338 1.00 0.00 ATOM 697 OE2 GLU 84 27.771 33.821 46.262 1.00 0.00 ATOM 698 O GLU 84 24.438 38.039 45.646 1.00 0.00 ATOM 699 C GLU 84 24.535 37.517 44.537 1.00 0.00 ATOM 700 N TYR 85 25.158 38.119 43.513 1.00 0.00 ATOM 701 CA TYR 85 25.876 39.350 43.677 1.00 0.00 ATOM 702 CB TYR 85 26.773 39.654 42.463 1.00 0.00 ATOM 703 CG TYR 85 27.490 40.931 42.731 1.00 0.00 ATOM 704 CD1 TYR 85 28.633 40.941 43.496 1.00 0.00 ATOM 705 CD2 TYR 85 27.024 42.114 42.211 1.00 0.00 ATOM 706 CE1 TYR 85 29.298 42.117 43.746 1.00 0.00 ATOM 707 CE2 TYR 85 27.683 43.294 42.456 1.00 0.00 ATOM 708 CZ TYR 85 28.820 43.295 43.224 1.00 0.00 ATOM 709 OH TYR 85 29.499 44.504 43.479 1.00 0.00 ATOM 710 O TYR 85 25.359 41.390 44.771 1.00 0.00 ATOM 711 C TYR 85 25.034 40.576 43.912 1.00 0.00 ATOM 712 N ASN 86 23.900 40.727 43.204 1.00 0.00 ATOM 713 CA ASN 86 23.234 42.005 43.109 1.00 0.00 ATOM 714 CB ASN 86 21.977 41.914 42.264 1.00 0.00 ATOM 715 CG ASN 86 22.246 41.710 40.798 1.00 0.00 ATOM 716 ND2 ASN 86 21.242 41.246 40.099 1.00 0.00 ATOM 717 OD1 ASN 86 23.326 42.038 40.293 1.00 0.00 ATOM 718 O ASN 86 22.418 42.098 45.395 1.00 0.00 ATOM 719 C ASN 86 22.844 42.676 44.397 1.00 0.00 ATOM 720 N PRO 87 23.070 43.969 44.318 1.00 0.00 ATOM 721 CA PRO 87 22.716 44.908 45.354 1.00 0.00 ATOM 722 CB PRO 87 23.746 46.018 45.189 1.00 0.00 ATOM 723 CG PRO 87 24.018 46.020 43.718 1.00 0.00 ATOM 724 CD PRO 87 24.070 44.543 43.358 1.00 0.00 ATOM 725 O PRO 87 20.702 45.280 44.135 1.00 0.00 ATOM 726 C PRO 87 21.297 45.383 45.208 1.00 0.00 ATOM 727 N ASP 88 20.739 45.911 46.293 1.00 0.00 ATOM 728 CA ASP 88 19.367 46.408 46.272 1.00 0.00 ATOM 729 CB ASP 88 18.583 45.867 47.470 1.00 0.00 ATOM 730 CG ASP 88 19.103 46.331 48.824 1.00 0.00 ATOM 731 OD1 ASP 88 19.951 47.192 48.850 1.00 0.00 ATOM 732 OD2 ASP 88 18.542 45.937 49.819 1.00 0.00 ATOM 733 O ASP 88 20.499 48.510 46.443 1.00 0.00 ATOM 734 C ASP 88 19.441 47.907 46.270 1.00 0.00 ATOM 735 N ARG 89 18.259 48.530 46.101 1.00 0.00 ATOM 736 CA ARG 89 18.033 49.946 46.196 1.00 0.00 ATOM 737 CB ARG 89 18.237 50.467 47.611 1.00 0.00 ATOM 738 CG ARG 89 17.286 49.890 48.647 1.00 0.00 ATOM 739 CD ARG 89 17.510 50.390 50.029 1.00 0.00 ATOM 740 NE ARG 89 16.732 49.708 51.050 1.00 0.00 ATOM 741 CZ ARG 89 16.808 49.966 52.370 1.00 0.00 ATOM 742 NH1 ARG 89 17.651 50.860 52.837 1.00 0.00 ATOM 743 NH2 ARG 89 16.030 49.278 53.187 1.00 0.00 ATOM 744 O ARG 89 19.280 51.848 45.538 1.00 0.00 ATOM 745 C ARG 89 18.852 50.737 45.229 1.00 0.00 ATOM 746 N ASP 90 19.095 50.188 44.029 1.00 0.00 ATOM 747 CA ASP 90 19.737 50.950 43.000 1.00 0.00 ATOM 748 CB ASP 90 21.119 50.370 42.686 1.00 0.00 ATOM 749 CG ASP 90 22.117 50.470 43.832 1.00 0.00 ATOM 750 OD1 ASP 90 22.331 51.557 44.315 1.00 0.00 ATOM 751 OD2 ASP 90 22.538 49.447 44.317 1.00 0.00 ATOM 752 O ASP 90 17.954 50.000 41.723 1.00 0.00 ATOM 753 C ASP 90 18.790 50.898 41.840 1.00 0.00 ATOM 754 N PRO 91 18.930 51.860 40.979 1.00 0.00 ATOM 755 CA PRO 91 17.994 52.033 39.900 1.00 0.00 ATOM 756 CB PRO 91 18.442 53.417 39.328 1.00 0.00 ATOM 757 CG PRO 91 18.915 54.133 40.555 1.00 0.00 ATOM 758 CD PRO 91 19.721 53.057 41.254 1.00 0.00 ATOM 759 O PRO 91 16.731 50.849 38.239 1.00 0.00 ATOM 760 C PRO 91 17.833 51.037 38.756 1.00 0.00 ATOM 761 N GLY 92 18.932 50.401 38.363 1.00 0.00 ATOM 762 CA GLY 92 18.889 49.443 37.297 1.00 0.00 ATOM 763 O GLY 92 18.779 47.129 36.740 1.00 0.00 ATOM 764 C GLY 92 18.915 47.976 37.623 1.00 0.00 ATOM 765 N ASP 93 19.090 47.662 38.903 1.00 0.00 ATOM 766 CA ASP 93 19.130 46.272 39.340 1.00 0.00 ATOM 767 CB ASP 93 19.591 46.182 40.797 1.00 0.00 ATOM 768 CG ASP 93 21.074 46.458 41.005 1.00 0.00 ATOM 769 OD1 ASP 93 21.795 46.487 40.036 1.00 0.00 ATOM 770 OD2 ASP 93 21.447 46.791 42.105 1.00 0.00 ATOM 771 O ASP 93 17.783 44.298 39.075 1.00 0.00 ATOM 772 C ASP 93 17.798 45.524 39.213 1.00 0.00 ATOM 773 N ARG 94 16.722 46.271 39.288 1.00 0.00 ATOM 774 CA ARG 94 15.434 45.593 39.208 1.00 0.00 ATOM 775 CB ARG 94 14.270 46.540 39.455 1.00 0.00 ATOM 776 CG ARG 94 14.129 47.018 40.892 1.00 0.00 ATOM 777 CD ARG 94 13.030 47.995 41.107 1.00 0.00 ATOM 778 NE ARG 94 12.911 48.476 42.473 1.00 0.00 ATOM 779 CZ ARG 94 12.035 49.416 42.881 1.00 0.00 ATOM 780 NH1 ARG 94 11.226 50.003 42.026 1.00 0.00 ATOM 781 NH2 ARG 94 12.026 49.749 44.159 1.00 0.00 ATOM 782 O ARG 94 14.691 43.717 37.910 1.00 0.00 ATOM 783 C ARG 94 15.215 44.832 37.904 1.00 0.00 ATOM 784 N LEU 95 15.616 45.435 36.790 1.00 0.00 ATOM 785 CA LEU 95 15.457 44.808 35.525 1.00 0.00 ATOM 786 CB LEU 95 15.772 45.799 34.398 1.00 0.00 ATOM 787 CG LEU 95 14.754 46.934 34.223 1.00 0.00 ATOM 788 CD1 LEU 95 15.269 47.946 33.210 1.00 0.00 ATOM 789 CD2 LEU 95 13.420 46.356 33.776 1.00 0.00 ATOM 790 O LEU 95 15.840 42.542 34.925 1.00 0.00 ATOM 791 C LEU 95 16.307 43.593 35.369 1.00 0.00 ATOM 792 N ILE 96 17.578 43.717 35.735 1.00 0.00 ATOM 793 CA ILE 96 18.507 42.598 35.632 1.00 0.00 ATOM 794 CB ILE 96 19.867 43.020 36.345 1.00 0.00 ATOM 795 CG1 ILE 96 20.545 44.178 35.582 1.00 0.00 ATOM 796 CG2 ILE 96 20.810 41.783 36.469 1.00 0.00 ATOM 797 CD1 ILE 96 21.729 44.817 36.320 1.00 0.00 ATOM 798 O ILE 96 18.491 40.200 35.602 1.00 0.00 ATOM 799 C ILE 96 18.176 41.225 36.206 1.00 0.00 ATOM 800 N ARG 97 17.540 41.207 37.373 1.00 0.00 ATOM 801 CA ARG 97 17.183 39.973 37.992 1.00 0.00 ATOM 802 CB ARG 97 16.694 40.168 39.420 1.00 0.00 ATOM 803 CG ARG 97 17.771 40.565 40.417 1.00 0.00 ATOM 804 CD ARG 97 17.272 40.805 41.795 1.00 0.00 ATOM 805 NE ARG 97 18.294 41.216 42.743 1.00 0.00 ATOM 806 CZ ARG 97 18.060 41.533 44.031 1.00 0.00 ATOM 807 NH1 ARG 97 16.839 41.525 44.520 1.00 0.00 ATOM 808 NH2 ARG 97 19.089 41.876 44.787 1.00 0.00 ATOM 809 O ARG 97 16.327 38.039 36.910 1.00 0.00 ATOM 810 C ARG 97 16.185 39.237 37.157 1.00 0.00 ATOM 811 N HIS 98 15.158 39.949 36.708 1.00 0.00 ATOM 812 CA HIS 98 14.121 39.342 35.882 1.00 0.00 ATOM 813 CB HIS 98 12.993 40.341 35.607 1.00 0.00 ATOM 814 CG HIS 98 11.894 39.788 34.755 1.00 0.00 ATOM 815 CD2 HIS 98 11.552 40.035 33.469 1.00 0.00 ATOM 816 ND1 HIS 98 10.990 38.854 35.218 1.00 0.00 ATOM 817 CE1 HIS 98 10.140 38.552 34.253 1.00 0.00 ATOM 818 NE2 HIS 98 10.459 39.254 33.181 1.00 0.00 ATOM 819 O HIS 98 14.386 37.700 34.133 1.00 0.00 ATOM 820 C HIS 98 14.695 38.824 34.553 1.00 0.00 ATOM 821 N ARG 99 15.564 39.621 33.918 1.00 0.00 ATOM 822 CA ARG 99 16.136 39.204 32.612 1.00 0.00 ATOM 823 CB ARG 99 16.911 40.407 32.022 1.00 0.00 ATOM 824 CG ARG 99 16.033 41.511 31.505 1.00 0.00 ATOM 825 CD ARG 99 16.870 42.710 31.102 1.00 0.00 ATOM 826 NE ARG 99 16.028 43.798 30.619 1.00 0.00 ATOM 827 CZ ARG 99 16.481 44.973 30.196 1.00 0.00 ATOM 828 NH1 ARG 99 17.786 45.224 30.198 1.00 0.00 ATOM 829 NH2 ARG 99 15.625 45.900 29.781 1.00 0.00 ATOM 830 O ARG 99 16.994 37.043 31.960 1.00 0.00 ATOM 831 C ARG 99 17.060 38.009 32.726 1.00 0.00 ATOM 832 N ALA 100 18.041 38.108 33.643 1.00 0.00 ATOM 833 CA ALA 100 19.019 37.038 33.793 1.00 0.00 ATOM 834 CB ALA 100 19.972 37.290 34.954 1.00 0.00 ATOM 835 O ALA 100 18.695 34.700 33.547 1.00 0.00 ATOM 836 C ALA 100 18.375 35.738 34.129 1.00 0.00 ATOM 837 N CYS 101 17.436 35.776 35.090 1.00 0.00 ATOM 838 CA CYS 101 16.738 34.563 35.498 1.00 0.00 ATOM 839 CB CYS 101 15.838 34.895 36.701 1.00 0.00 ATOM 840 SG CYS 101 16.898 35.072 38.179 1.00 0.00 ATOM 841 O CYS 101 15.843 32.724 34.249 1.00 0.00 ATOM 842 C CYS 101 15.972 33.930 34.320 1.00 0.00 ATOM 843 N ALA 102 15.454 34.759 33.417 1.00 0.00 ATOM 844 CA ALA 102 14.758 34.216 32.250 1.00 0.00 ATOM 845 CB ALA 102 13.713 35.293 31.804 1.00 0.00 ATOM 846 O ALA 102 15.183 33.254 30.095 1.00 0.00 ATOM 847 C ALA 102 15.636 33.885 31.053 1.00 0.00 ATOM 848 N LEU 103 16.765 34.390 31.161 1.00 0.00 ATOM 849 CA LEU 103 17.686 34.006 30.081 1.00 0.00 ATOM 850 CB LEU 103 19.062 34.415 30.307 1.00 0.00 ATOM 851 CG LEU 103 20.098 33.829 29.345 1.00 0.00 ATOM 852 CD1 LEU 103 19.789 34.277 27.920 1.00 0.00 ATOM 853 CD2 LEU 103 21.487 34.283 29.761 1.00 0.00 ATOM 854 O LEU 103 17.648 31.844 29.037 1.00 0.00 ATOM 855 C LEU 103 17.674 32.488 30.094 1.00 0.00 ATOM 856 N ARG 104 17.662 31.935 31.296 1.00 0.00 ATOM 857 CA ARG 104 17.527 30.499 31.399 1.00 0.00 ATOM 858 CB ARG 104 17.792 29.997 32.810 1.00 0.00 ATOM 859 CG ARG 104 17.722 28.488 32.977 1.00 0.00 ATOM 860 CD ARG 104 17.625 28.030 34.386 1.00 0.00 ATOM 861 NE ARG 104 16.409 28.438 35.070 1.00 0.00 ATOM 862 CZ ARG 104 16.243 28.428 36.407 1.00 0.00 ATOM 863 NH1 ARG 104 17.195 28.000 37.205 1.00 0.00 ATOM 864 NH2 ARG 104 15.086 28.840 36.896 1.00 0.00 ATOM 865 O ARG 104 16.120 29.080 30.131 1.00 0.00 ATOM 866 C ARG 104 16.212 30.033 30.906 1.00 0.00 ATOM 867 N ASP 105 15.154 30.704 31.352 1.00 0.00 ATOM 868 CA ASP 105 13.803 30.345 30.939 1.00 0.00 ATOM 869 CB ASP 105 12.706 31.254 31.507 1.00 0.00 ATOM 870 CG ASP 105 12.657 31.027 33.007 1.00 0.00 ATOM 871 OD1 ASP 105 13.215 29.995 33.466 1.00 0.00 ATOM 872 OD2 ASP 105 12.060 31.879 33.716 1.00 0.00 ATOM 873 O ASP 105 13.190 29.493 28.814 1.00 0.00 ATOM 874 C ASP 105 13.696 30.414 29.452 1.00 0.00 ATOM 875 N THR 106 14.185 31.513 28.851 1.00 0.00 ATOM 876 CA THR 106 14.025 31.669 27.437 1.00 0.00 ATOM 877 CB THR 106 14.583 33.010 26.940 1.00 0.00 ATOM 878 CG2 THR 106 14.296 33.238 25.487 1.00 0.00 ATOM 879 OG1 THR 106 13.984 34.076 27.698 1.00 0.00 ATOM 880 O THR 106 14.225 29.972 25.736 1.00 0.00 ATOM 881 C THR 106 14.776 30.596 26.645 1.00 0.00 ATOM 882 N ALA 107 15.993 30.406 27.003 1.00 0.00 ATOM 883 CA ALA 107 16.797 29.393 26.327 1.00 0.00 ATOM 884 CB ALA 107 18.169 29.269 26.874 1.00 0.00 ATOM 885 O ALA 107 16.027 27.308 25.423 1.00 0.00 ATOM 886 C ALA 107 16.137 28.022 26.421 1.00 0.00 ATOM 887 N TYR 108 15.697 27.657 27.621 1.00 0.00 ATOM 888 CA TYR 108 15.065 26.400 27.811 1.00 0.00 ATOM 889 CB TYR 108 14.719 26.192 29.287 1.00 0.00 ATOM 890 CG TYR 108 13.812 25.009 29.544 1.00 0.00 ATOM 891 CD1 TYR 108 14.312 23.716 29.549 1.00 0.00 ATOM 892 CD2 TYR 108 12.458 25.191 29.780 1.00 0.00 ATOM 893 CE1 TYR 108 13.488 22.632 29.783 1.00 0.00 ATOM 894 CE2 TYR 108 11.623 24.115 30.015 1.00 0.00 ATOM 895 CZ TYR 108 12.142 22.836 30.016 1.00 0.00 ATOM 896 OH TYR 108 11.317 21.761 30.251 1.00 0.00 ATOM 897 O TYR 108 13.537 25.277 26.339 1.00 0.00 ATOM 898 C TYR 108 13.815 26.313 26.945 1.00 0.00 ATOM 899 N ALA 109 13.107 27.401 26.908 1.00 0.00 ATOM 900 CA ALA 109 11.886 27.437 26.113 1.00 0.00 ATOM 901 CB ALA 109 11.144 28.786 26.126 1.00 0.00 ATOM 902 O ALA 109 11.446 26.255 24.072 1.00 0.00 ATOM 903 C ALA 109 12.151 27.081 24.654 1.00 0.00 ATOM 904 N ILE 110 13.165 27.706 24.065 1.00 0.00 ATOM 905 CA ILE 110 13.492 27.440 22.713 1.00 0.00 ATOM 906 CB ILE 110 14.622 28.359 22.214 1.00 0.00 ATOM 907 CG1 ILE 110 14.225 29.829 22.372 1.00 0.00 ATOM 908 CG2 ILE 110 14.959 28.047 20.764 1.00 0.00 ATOM 909 CD1 ILE 110 12.999 30.219 21.578 1.00 0.00 ATOM 910 O ILE 110 13.516 25.400 21.510 1.00 0.00 ATOM 911 C ILE 110 13.902 26.031 22.494 1.00 0.00 ATOM 912 N ILE 111 14.701 25.507 23.418 1.00 0.00 ATOM 913 CA ILE 111 15.173 24.131 23.317 1.00 0.00 ATOM 914 CB ILE 111 16.150 23.783 24.455 1.00 0.00 ATOM 915 CG1 ILE 111 17.448 24.581 24.307 1.00 0.00 ATOM 916 CG2 ILE 111 16.438 22.290 24.472 1.00 0.00 ATOM 917 CD1 ILE 111 18.272 24.647 25.573 1.00 0.00 ATOM 918 O ILE 111 13.801 22.411 22.442 1.00 0.00 ATOM 919 C ILE 111 13.991 23.226 23.346 1.00 0.00 ATOM 920 N LYS 112 13.139 23.345 24.374 1.00 0.00 ATOM 921 CA LYS 112 12.082 22.389 24.427 1.00 0.00 ATOM 922 CB LYS 112 11.249 22.582 25.694 1.00 0.00 ATOM 923 CG LYS 112 10.120 21.574 25.864 1.00 0.00 ATOM 924 CD LYS 112 9.386 21.781 27.180 1.00 0.00 ATOM 925 CE LYS 112 8.237 20.796 27.335 1.00 0.00 ATOM 926 NZ LYS 112 7.498 20.998 28.612 1.00 0.00 ATOM 927 O LYS 112 10.816 21.428 22.685 1.00 0.00 ATOM 928 C LYS 112 11.196 22.457 23.236 1.00 0.00 ATOM 929 N GLU 113 10.838 23.667 22.787 1.00 0.00 ATOM 930 CA GLU 113 9.918 23.684 21.694 1.00 0.00 ATOM 931 CB GLU 113 9.425 25.108 21.432 1.00 0.00 ATOM 932 CG GLU 113 8.500 25.662 22.507 1.00 0.00 ATOM 933 CD GLU 113 8.167 27.105 22.250 1.00 0.00 ATOM 934 OE1 GLU 113 8.695 27.661 21.318 1.00 0.00 ATOM 935 OE2 GLU 113 7.300 27.622 22.916 1.00 0.00 ATOM 936 O GLU 113 9.933 22.290 19.771 1.00 0.00 ATOM 937 C GLU 113 10.533 23.119 20.452 1.00 0.00 ATOM 938 N GLU 114 11.766 23.554 20.140 1.00 0.00 ATOM 939 CA GLU 114 12.460 23.200 18.933 1.00 0.00 ATOM 940 CB GLU 114 13.639 24.147 18.696 1.00 0.00 ATOM 941 CG GLU 114 13.240 25.567 18.323 1.00 0.00 ATOM 942 CD GLU 114 12.413 25.591 17.068 1.00 0.00 ATOM 943 OE1 GLU 114 12.841 25.032 16.087 1.00 0.00 ATOM 944 OE2 GLU 114 11.305 26.070 17.120 1.00 0.00 ATOM 945 O GLU 114 12.810 21.052 17.978 1.00 0.00 ATOM 946 C GLU 114 12.951 21.785 18.953 1.00 0.00 ATOM 947 N LEU 115 13.495 21.349 20.099 1.00 0.00 ATOM 948 CA LEU 115 14.281 20.150 20.140 1.00 0.00 ATOM 949 CB LEU 115 14.810 19.910 21.560 1.00 0.00 ATOM 950 CG LEU 115 15.669 18.652 21.733 1.00 0.00 ATOM 951 CD1 LEU 115 16.915 18.747 20.861 1.00 0.00 ATOM 952 CD2 LEU 115 16.048 18.492 23.197 1.00 0.00 ATOM 953 O LEU 115 14.119 18.146 18.906 1.00 0.00 ATOM 954 C LEU 115 13.563 18.914 19.686 1.00 0.00 ATOM 955 N ASP 116 12.314 18.680 20.113 1.00 0.00 ATOM 956 CA ASP 116 11.635 17.472 19.741 1.00 0.00 ATOM 957 CB ASP 116 11.636 17.136 18.235 1.00 0.00 ATOM 958 CG ASP 116 10.527 17.949 17.579 1.00 0.00 ATOM 959 OD1 ASP 116 9.694 18.511 18.340 1.00 0.00 ATOM 960 OD2 ASP 116 10.483 18.008 16.321 1.00 0.00 ATOM 961 O ASP 116 13.370 16.158 20.717 1.00 0.00 ATOM 962 C ASP 116 12.166 16.326 20.524 1.00 0.00 ATOM 963 N GLU 117 11.217 15.512 21.005 1.00 0.00 ATOM 964 CA GLU 117 11.439 14.391 21.865 1.00 0.00 ATOM 965 CB GLU 117 10.106 13.772 22.292 1.00 0.00 ATOM 966 CG GLU 117 9.297 14.626 23.258 1.00 0.00 ATOM 967 CD GLU 117 7.950 14.015 23.530 1.00 0.00 ATOM 968 OE1 GLU 117 7.640 13.015 22.929 1.00 0.00 ATOM 969 OE2 GLU 117 7.276 14.483 24.417 1.00 0.00 ATOM 970 O GLU 117 13.195 12.809 21.792 1.00 0.00 ATOM 971 C GLU 117 12.297 13.379 21.175 1.00 0.00 ATOM 972 N ASP 118 12.014 13.089 19.892 1.00 0.00 ATOM 973 CA ASP 118 12.763 12.101 19.163 1.00 0.00 ATOM 974 CB ASP 118 12.148 11.875 17.780 1.00 0.00 ATOM 975 CG ASP 118 10.829 11.114 17.795 1.00 0.00 ATOM 976 OD1 ASP 118 10.498 10.559 18.815 1.00 0.00 ATOM 977 OD2 ASP 118 10.093 11.223 16.844 1.00 0.00 ATOM 978 O ASP 118 15.098 11.677 19.269 1.00 0.00 ATOM 979 C ASP 118 14.200 12.478 19.015 1.00 0.00 ATOM 980 N PHE 119 14.398 13.750 18.610 1.00 0.00 ATOM 981 CA PHE 119 15.727 14.219 18.256 1.00 0.00 ATOM 982 CB PHE 119 15.701 15.571 17.526 1.00 0.00 ATOM 983 CG PHE 119 17.071 16.097 17.233 1.00 0.00 ATOM 984 CD1 PHE 119 17.795 15.627 16.149 1.00 0.00 ATOM 985 CD2 PHE 119 17.670 16.970 18.084 1.00 0.00 ATOM 986 CE1 PHE 119 19.065 16.073 15.907 1.00 0.00 ATOM 987 CE2 PHE 119 18.941 17.429 17.848 1.00 0.00 ATOM 988 CZ PHE 119 19.635 16.974 16.751 1.00 0.00 ATOM 989 O PHE 119 17.785 13.782 19.462 1.00 0.00 ATOM 990 C PHE 119 16.629 14.221 19.508 1.00 0.00 ATOM 991 N GLU 120 16.086 14.694 20.621 1.00 0.00 ATOM 992 CA GLU 120 16.824 14.761 21.872 1.00 0.00 ATOM 993 CB GLU 120 15.962 15.389 22.969 1.00 0.00 ATOM 994 CG GLU 120 16.661 15.529 24.315 1.00 0.00 ATOM 995 CD GLU 120 15.789 16.240 25.312 1.00 0.00 ATOM 996 OE1 GLU 120 14.692 15.791 25.539 1.00 0.00 ATOM 997 OE2 GLU 120 16.261 17.166 25.930 1.00 0.00 ATOM 998 O GLU 120 18.444 13.178 22.691 1.00 0.00 ATOM 999 C GLU 120 17.294 13.357 22.288 1.00 0.00 ATOM 1000 N GLN 121 16.405 12.375 22.187 1.00 0.00 ATOM 1001 CA GLN 121 16.747 11.005 22.553 1.00 0.00 ATOM 1002 CB GLN 121 15.498 10.120 22.545 1.00 0.00 ATOM 1003 CG GLN 121 14.519 10.415 23.668 1.00 0.00 ATOM 1004 CD GLN 121 13.247 9.596 23.557 1.00 0.00 ATOM 1005 OE1 GLN 121 13.044 8.867 22.581 1.00 0.00 ATOM 1006 NE2 GLN 121 12.379 9.714 24.555 1.00 0.00 ATOM 1007 O GLN 121 18.701 9.717 22.079 1.00 0.00 ATOM 1008 C GLN 121 17.789 10.401 21.627 1.00 0.00 ATOM 1009 N LEU 122 17.648 10.682 20.338 1.00 0.00 ATOM 1010 CA LEU 122 18.604 10.223 19.348 1.00 0.00 ATOM 1011 CB LEU 122 18.147 10.631 17.942 1.00 0.00 ATOM 1012 CG LEU 122 19.079 10.202 16.802 1.00 0.00 ATOM 1013 CD1 LEU 122 19.186 8.683 16.758 1.00 0.00 ATOM 1014 CD2 LEU 122 18.552 10.742 15.481 1.00 0.00 ATOM 1015 O LEU 122 20.990 10.083 19.608 1.00 0.00 ATOM 1016 C LEU 122 19.983 10.783 19.654 1.00 0.00 ATOM 1017 N CYS 123 20.014 12.086 19.973 1.00 0.00 ATOM 1018 CA CYS 123 21.265 12.729 20.238 1.00 0.00 ATOM 1019 CB CYS 123 21.062 14.218 20.513 1.00 0.00 ATOM 1020 SG CYS 123 22.589 15.136 20.787 1.00 0.00 ATOM 1021 O CYS 123 23.219 11.892 21.348 1.00 0.00 ATOM 1022 C CYS 123 22.003 12.079 21.402 1.00 0.00 ATOM 1023 N GLU 124 21.268 11.735 22.455 1.00 0.00 ATOM 1024 CA GLU 124 21.865 11.115 23.598 1.00 0.00 ATOM 1025 CB GLU 124 20.816 10.876 24.686 1.00 0.00 ATOM 1026 CG GLU 124 20.319 12.141 25.370 1.00 0.00 ATOM 1027 CD GLU 124 19.201 11.842 26.329 1.00 0.00 ATOM 1028 OE1 GLU 124 18.784 10.710 26.390 1.00 0.00 ATOM 1029 OE2 GLU 124 18.837 12.717 27.079 1.00 0.00 ATOM 1030 O GLU 124 23.688 9.558 23.667 1.00 0.00 ATOM 1031 C GLU 124 22.550 9.797 23.262 1.00 0.00 ATOM 1032 N GLU 125 21.858 8.932 22.521 1.00 0.00 ATOM 1033 CA GLU 125 22.404 7.641 22.133 1.00 0.00 ATOM 1034 CB GLU 125 21.341 6.801 21.424 1.00 0.00 ATOM 1035 CG GLU 125 20.226 6.299 22.331 1.00 0.00 ATOM 1036 CD GLU 125 19.163 5.583 21.545 1.00 0.00 ATOM 1037 OE1 GLU 125 19.263 5.547 20.343 1.00 0.00 ATOM 1038 OE2 GLU 125 18.312 4.976 22.153 1.00 0.00 ATOM 1039 O GLU 125 24.587 7.037 21.348 1.00 0.00 ATOM 1040 C GLU 125 23.627 7.800 21.236 1.00 0.00 ATOM 1041 N ILE 126 23.600 8.793 20.350 1.00 0.00 ATOM 1042 CA ILE 126 24.733 9.050 19.469 1.00 0.00 ATOM 1043 CB ILE 126 24.407 10.140 18.432 1.00 0.00 ATOM 1044 CG1 ILE 126 23.277 9.676 17.508 1.00 0.00 ATOM 1045 CG2 ILE 126 25.646 10.495 17.625 1.00 0.00 ATOM 1046 CD1 ILE 126 23.613 8.440 16.705 1.00 0.00 ATOM 1047 O ILE 126 27.041 8.941 20.132 1.00 0.00 ATOM 1048 C ILE 126 25.940 9.466 20.312 1.00 0.00 ATOM 1049 N GLN 127 25.732 10.403 21.233 1.00 0.00 ATOM 1050 CA GLN 127 26.815 10.862 22.102 1.00 0.00 ATOM 1051 CB GLN 127 26.304 11.925 23.078 1.00 0.00 ATOM 1052 CG GLN 127 27.383 12.522 23.966 1.00 0.00 ATOM 1053 CD GLN 127 28.408 13.315 23.178 1.00 0.00 ATOM 1054 OE1 GLN 127 28.059 14.114 22.304 1.00 0.00 ATOM 1055 NE2 GLN 127 29.683 13.095 23.479 1.00 0.00 ATOM 1056 O GLN 127 28.625 9.534 22.960 1.00 0.00 ATOM 1057 C GLN 127 27.408 9.682 22.865 1.00 0.00 ATOM 1058 N GLU 128 26.534 8.844 23.407 1.00 0.00 ATOM 1059 CA GLU 128 26.957 7.680 24.172 1.00 0.00 ATOM 1060 CB GLU 128 25.747 6.975 24.788 1.00 0.00 ATOM 1061 CG GLU 128 25.081 7.744 25.921 1.00 0.00 ATOM 1062 CD GLU 128 23.827 7.056 26.383 1.00 0.00 ATOM 1063 OE1 GLU 128 23.460 6.069 25.793 1.00 0.00 ATOM 1064 OE2 GLU 128 23.296 7.450 27.395 1.00 0.00 ATOM 1065 O GLU 128 28.836 6.257 23.706 1.00 0.00 ATOM 1066 C GLU 128 27.749 6.686 23.323 1.00 0.00 ATOM 1067 N SER 129 27.228 6.381 22.123 1.00 0.00 ATOM 1068 CA SER 129 27.906 5.497 21.225 1.00 0.00 ATOM 1069 CB SER 129 27.160 5.326 19.895 1.00 0.00 ATOM 1070 OG SER 129 27.872 4.443 19.042 1.00 0.00 ATOM 1071 O SER 129 30.273 5.465 21.189 1.00 0.00 ATOM 1072 C SER 129 29.245 6.081 20.918 1.00 0.00 ATOM 1073 N ARG 130 29.282 7.303 20.359 1.00 0.00 ATOM 1074 CA ARG 130 30.563 7.843 20.040 1.00 0.00 ATOM 1075 CB ARG 130 30.460 9.128 19.231 1.00 0.00 ATOM 1076 CG ARG 130 29.966 8.948 17.805 1.00 0.00 ATOM 1077 CD ARG 130 29.941 10.198 17.003 1.00 0.00 ATOM 1078 NE ARG 130 31.234 10.850 16.863 1.00 0.00 ATOM 1079 CZ ARG 130 31.412 12.107 16.411 1.00 0.00 ATOM 1080 NH1 ARG 130 30.391 12.837 16.019 1.00 0.00 ATOM 1081 NH2 ARG 130 32.644 12.579 16.348 1.00 0.00 ATOM 1082 O ARG 130 30.946 8.889 22.150 1.00 0.00 ATOM 1083 C ARG 130 31.331 8.005 21.341 1.00 0.00 TER END