PFRMAT TS TARGET TR429 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 For a REFINEMENT model, the predictions are redone for the sequence METHOD included in the refinement model, then both the automatic model and METHOD supplied model are further optiized, initially taking sheet and helix METHOD constraints from the supplied model to refine. METHOD METHOD In the case of TR429, the supplied model is rather terrible, with bad METHOD breaks and clashes and incompletely formed sheets. The domains were METHOD separately predicted, and predictions were pasted into the supplied model. METHOD Only model 5 was optimized directly from TR429, though model 4 was METHOD constructed from domains separately optimized from TR429. METHOD METHOD The other models submitted have nothing left of the original TR429 METHOD model, except the placement of the two domains, which I believe is METHOD incorrect, as the hydrophobic residues I104, F166, I164 are all METHOD exposed---I believe they should be packed against the other barrel. METHOD METHOD I tried looking for a model (among the server models and METHOD SAM+undertaker models) that would pack the two barrels better, but I METHOD didn't find one. I don't think that I have the time or the tools to METHOD dock the domains against each other properly. METHOD METHOD Model METHOD METHOD 1 TR429.try5-opt3.pdb # < chimera-try4-C4 METHOD chimera-try4-C4: METHOD initially TR429.try4-opt3.gromacs0.pdb METHOD L110-P176 from R100-P176/try4-opt3.gromacs0 < R100-P176/try1-opt3.gromacs0 < align(2f5kA) METHOD try4-opt3 < chimera-N3-try3 METHOD chimera-N3-try3: METHOD E22-A70, Y77-V97 from E22-A101/try3-opt3 < E22-A101/chimera-try1-init METHOD L71-I76, R98-P176 from try3-opt3.gromacs0 METHOD try3-opt3 < chimera-try2-C1 METHOD chimera-try2-C1: METHOD N-terminal region from TR429.try2-opt3.pdb METHOD I105-P176 from R100-P176/try1-opt3 < align(2f5kA) METHOD try2-opt3 < TR429 (initial model) METHOD METHOD E22-A101/chimera-try1-init: METHOD mostly from E22-S101/try1-opt3 < align(1mhnA) METHOD loop K55-I76 from TR429.pdb METHOD METHOD METHOD 2 TR429.try8-opt3.gromacs0.repack-nonPC.pdb # < try7-opt3.gromacs0 < chimera-N4-try5 METHOD # best Rosetta energy METHOD chimera-N4-try5: METHOD E22-V97 from E22-A101/try4-opt3 < try3-opt3 < E22-A101/chimera-try1-init METHOD R98-P176 from TR429.try5-opt3.pdb (see model 1) METHOD METHOD 3 TR429.try4-opt3.gromacs0.pdb # < chimera-N3-try3 METHOD METHOD 4 TR429.try6-opt3.gromacs0.pdb # < chimera-N2-C2 METHOD chimera-N2-C2: METHOD E22-R100 E22-A101/try2-opt3 < TR429 METHOD A101-L110 try4-opt3.gromacs0 METHOD E111-P176 R100-P176/try2-opt3 < TR429 METHOD METHOD 5 TR429.try9-opt3.pdb # < try2-opt3.gromacs0 < TR429 METHOD METHOD METHOD METHOD REMARK 6 REMARK 6 TR429 model 5 Sun Jul 13 16:58:04 2008 MODEL 5 PARENT N/A ATOM 1 N GLU 22 25.499 37.376 36.470 1.00 0.00 ATOM 2 CA GLU 22 25.472 35.934 36.770 1.00 0.00 ATOM 3 CB GLU 22 26.343 35.594 37.965 1.00 0.00 ATOM 4 CG GLU 22 27.836 35.771 37.693 1.00 0.00 ATOM 5 CD GLU 22 28.681 35.572 38.960 1.00 0.00 ATOM 6 OE1 GLU 22 28.086 35.449 40.052 1.00 0.00 ATOM 7 OE2 GLU 22 29.910 35.571 38.814 1.00 0.00 ATOM 8 O GLU 22 23.583 34.473 36.543 1.00 0.00 ATOM 9 C GLU 22 24.047 35.484 37.072 1.00 0.00 ATOM 10 N THR 23 23.353 36.236 37.921 1.00 0.00 ATOM 11 CA THR 23 21.926 35.902 38.303 1.00 0.00 ATOM 12 CB THR 23 21.438 36.933 39.319 1.00 0.00 ATOM 13 CG2 THR 23 20.036 36.668 39.881 1.00 0.00 ATOM 14 OG1 THR 23 22.397 36.899 40.344 1.00 0.00 ATOM 15 O THR 23 20.404 34.890 36.771 1.00 0.00 ATOM 16 C THR 23 21.022 35.903 37.100 1.00 0.00 ATOM 17 N GLU 24 20.938 37.049 36.430 1.00 0.00 ATOM 18 CA GLU 24 20.097 37.172 35.246 1.00 0.00 ATOM 19 CB GLU 24 19.635 38.613 35.008 1.00 0.00 ATOM 20 CG GLU 24 18.662 39.110 36.099 1.00 0.00 ATOM 21 CD GLU 24 19.285 39.746 37.349 1.00 0.00 ATOM 22 OE1 GLU 24 20.451 39.463 37.720 1.00 0.00 ATOM 23 OE2 GLU 24 18.562 40.614 37.861 1.00 0.00 ATOM 24 O GLU 24 19.910 35.840 33.222 1.00 0.00 ATOM 25 C GLU 24 20.669 36.306 34.073 1.00 0.00 ATOM 26 N LEU 25 21.984 36.110 34.051 1.00 0.00 ATOM 27 CA LEU 25 22.611 35.316 33.001 1.00 0.00 ATOM 28 CB LEU 25 24.131 35.285 33.181 1.00 0.00 ATOM 29 CG LEU 25 24.813 36.633 32.917 1.00 0.00 ATOM 30 CD1 LEU 25 26.300 36.668 33.266 1.00 0.00 ATOM 31 CD2 LEU 25 24.667 36.993 31.450 1.00 0.00 ATOM 32 O LEU 25 21.950 33.193 32.044 1.00 0.00 ATOM 33 C LEU 25 22.112 33.846 33.075 1.00 0.00 ATOM 34 N GLY 26 21.876 33.351 34.287 1.00 0.00 ATOM 35 CA GLY 26 21.401 31.983 34.465 1.00 0.00 ATOM 36 O GLY 26 19.744 30.760 33.230 1.00 0.00 ATOM 37 C GLY 26 20.013 31.787 33.855 1.00 0.00 ATOM 38 N LEU 27 19.147 32.783 34.011 1.00 0.00 ATOM 39 CA LEU 27 17.807 32.716 33.442 1.00 0.00 ATOM 40 CB LEU 27 16.932 33.735 34.173 1.00 0.00 ATOM 41 CG LEU 27 15.478 33.759 33.699 1.00 0.00 ATOM 42 CD1 LEU 27 14.801 32.385 33.856 1.00 0.00 ATOM 43 CD2 LEU 27 14.758 34.845 34.491 1.00 0.00 ATOM 44 O LEU 27 17.034 32.408 31.203 1.00 0.00 ATOM 45 C LEU 27 17.814 33.016 31.940 1.00 0.00 ATOM 46 N TYR 28 18.645 33.993 31.584 1.00 0.00 ATOM 47 CA TYR 28 18.877 34.495 30.216 1.00 0.00 ATOM 48 CB TYR 28 19.100 33.367 29.236 1.00 0.00 ATOM 49 CG TYR 28 20.188 32.374 29.439 1.00 0.00 ATOM 50 CD1 TYR 28 20.068 31.251 30.250 1.00 0.00 ATOM 51 CD2 TYR 28 21.335 32.767 28.829 1.00 0.00 ATOM 52 CE1 TYR 28 21.225 30.529 30.493 1.00 0.00 ATOM 53 CE2 TYR 28 22.481 32.057 29.080 1.00 0.00 ATOM 54 CZ TYR 28 22.431 30.944 29.910 1.00 0.00 ATOM 55 OH TYR 28 23.592 30.288 30.168 1.00 0.00 ATOM 56 O TYR 28 18.045 36.325 28.991 1.00 0.00 ATOM 57 C TYR 28 17.746 35.304 29.603 1.00 0.00 ATOM 58 N LYS 29 16.497 34.827 29.628 1.00 0.00 ATOM 59 CA LYS 29 15.312 35.560 29.110 1.00 0.00 ATOM 60 CB LYS 29 15.297 37.007 29.609 1.00 0.00 ATOM 61 CG LYS 29 15.243 37.133 31.126 1.00 0.00 ATOM 62 CD LYS 29 15.235 38.609 31.494 1.00 0.00 ATOM 63 CE LYS 29 15.049 38.752 32.993 1.00 0.00 ATOM 64 NZ LYS 29 15.056 40.168 33.367 1.00 0.00 ATOM 65 O LYS 29 15.790 34.679 26.895 1.00 0.00 ATOM 66 C LYS 29 14.990 35.272 27.622 1.00 0.00 ATOM 67 N VAL 30 13.952 35.946 27.144 1.00 0.00 ATOM 68 CA VAL 30 13.436 35.867 25.752 1.00 0.00 ATOM 69 CB VAL 30 11.908 35.931 25.619 1.00 0.00 ATOM 70 CG1 VAL 30 11.271 34.600 25.974 1.00 0.00 ATOM 71 CG2 VAL 30 11.309 37.105 26.384 1.00 0.00 ATOM 72 O VAL 30 13.474 36.824 23.588 1.00 0.00 ATOM 73 C VAL 30 13.914 36.919 24.732 1.00 0.00 ATOM 74 N ASN 31 14.546 38.024 25.097 1.00 0.00 ATOM 75 CA ASN 31 14.704 39.068 24.062 1.00 0.00 ATOM 76 CB ASN 31 13.539 40.056 24.273 1.00 0.00 ATOM 77 CG ASN 31 12.842 40.596 23.010 1.00 0.00 ATOM 78 ND2 ASN 31 12.900 41.884 22.922 1.00 0.00 ATOM 79 OD1 ASN 31 12.271 39.944 22.145 1.00 0.00 ATOM 80 O ASN 31 16.278 40.754 23.345 1.00 0.00 ATOM 81 C ASN 31 16.105 39.661 23.886 1.00 0.00 ATOM 82 N GLU 32 17.142 38.903 24.231 1.00 0.00 ATOM 83 CA GLU 32 18.542 39.375 24.066 1.00 0.00 ATOM 84 CB GLU 32 19.268 39.387 25.412 1.00 0.00 ATOM 85 CG GLU 32 18.648 40.444 26.322 1.00 0.00 ATOM 86 CD GLU 32 19.184 40.325 27.730 1.00 0.00 ATOM 87 OE1 GLU 32 20.230 40.962 27.979 1.00 0.00 ATOM 88 OE2 GLU 32 18.475 39.696 28.530 1.00 0.00 ATOM 89 O GLU 32 19.008 37.339 22.925 1.00 0.00 ATOM 90 C GLU 32 19.334 38.495 23.097 1.00 0.00 ATOM 91 N TYR 33 20.331 39.040 22.420 1.00 0.00 ATOM 92 CA TYR 33 21.160 38.225 21.510 1.00 0.00 ATOM 93 CB TYR 33 21.725 39.048 20.354 1.00 0.00 ATOM 94 CG TYR 33 20.629 39.528 19.407 1.00 0.00 ATOM 95 CD1 TYR 33 20.037 40.771 19.564 1.00 0.00 ATOM 96 CD2 TYR 33 20.239 38.741 18.344 1.00 0.00 ATOM 97 CE1 TYR 33 19.076 41.201 18.665 1.00 0.00 ATOM 98 CE2 TYR 33 19.279 39.149 17.440 1.00 0.00 ATOM 99 CZ TYR 33 18.696 40.395 17.606 1.00 0.00 ATOM 100 OH TYR 33 17.641 40.734 16.822 1.00 0.00 ATOM 101 O TYR 33 23.108 38.167 22.938 1.00 0.00 ATOM 102 C TYR 33 22.316 37.541 22.230 1.00 0.00 ATOM 103 N VAL 34 22.344 36.232 22.103 1.00 0.00 ATOM 104 CA VAL 34 23.367 35.410 22.774 1.00 0.00 ATOM 105 CB VAL 34 22.655 34.400 23.695 1.00 0.00 ATOM 106 CG1 VAL 34 21.887 35.134 24.799 1.00 0.00 ATOM 107 CG2 VAL 34 21.722 33.473 22.915 1.00 0.00 ATOM 108 O VAL 34 24.019 34.746 20.563 1.00 0.00 ATOM 109 C VAL 34 24.322 34.799 21.755 1.00 0.00 ATOM 110 N ASP 35 25.476 34.336 22.227 1.00 0.00 ATOM 111 CA ASP 35 26.481 33.720 21.335 1.00 0.00 ATOM 112 CB ASP 35 27.893 34.333 21.464 1.00 0.00 ATOM 113 CG ASP 35 28.685 34.176 22.767 1.00 0.00 ATOM 114 OD1 ASP 35 28.708 33.035 23.278 1.00 0.00 ATOM 115 OD2 ASP 35 29.385 35.126 23.161 1.00 0.00 ATOM 116 O ASP 35 25.939 31.749 22.591 1.00 0.00 ATOM 117 C ASP 35 26.262 32.220 21.500 1.00 0.00 ATOM 118 N ALA 36 26.439 31.471 20.416 1.00 0.00 ATOM 119 CA ALA 36 26.260 30.038 20.462 1.00 0.00 ATOM 120 CB ALA 36 25.065 29.610 19.609 1.00 0.00 ATOM 121 O ALA 36 27.993 29.538 18.905 1.00 0.00 ATOM 122 C ALA 36 27.499 29.316 20.010 1.00 0.00 ATOM 123 N ARG 37 28.012 28.439 20.868 1.00 0.00 ATOM 124 CA ARG 37 29.210 27.676 20.540 1.00 0.00 ATOM 125 CB ARG 37 29.971 27.612 21.853 1.00 0.00 ATOM 126 CG ARG 37 31.271 26.867 21.677 1.00 0.00 ATOM 127 CD ARG 37 32.011 26.820 22.986 1.00 0.00 ATOM 128 NE ARG 37 33.390 26.343 22.855 1.00 0.00 ATOM 129 CZ ARG 37 34.196 26.120 23.871 1.00 0.00 ATOM 130 NH1 ARG 37 35.409 25.609 23.661 1.00 0.00 ATOM 131 NH2 ARG 37 33.745 26.324 25.106 1.00 0.00 ATOM 132 O ARG 37 27.858 25.705 20.779 1.00 0.00 ATOM 133 C ARG 37 28.694 26.311 20.107 1.00 0.00 ATOM 134 N ASP 38 29.075 25.963 18.897 1.00 0.00 ATOM 135 CA ASP 38 28.603 24.712 18.292 1.00 0.00 ATOM 136 CB ASP 38 28.863 24.691 16.784 1.00 0.00 ATOM 137 CG ASP 38 27.972 23.704 16.034 1.00 0.00 ATOM 138 OD1 ASP 38 27.093 23.124 16.697 1.00 0.00 ATOM 139 OD2 ASP 38 28.196 23.459 14.823 1.00 0.00 ATOM 140 O ASP 38 30.468 23.562 19.323 1.00 0.00 ATOM 141 C ASP 38 29.274 23.529 18.983 1.00 0.00 ATOM 142 N THR 39 28.489 22.487 19.152 1.00 0.00 ATOM 143 CA THR 39 28.900 21.321 19.972 1.00 0.00 ATOM 144 CB THR 39 27.730 20.365 20.286 1.00 0.00 ATOM 145 CG2 THR 39 26.679 21.071 21.136 1.00 0.00 ATOM 146 OG1 THR 39 27.056 19.975 19.082 1.00 0.00 ATOM 147 O THR 39 30.872 19.963 20.105 1.00 0.00 ATOM 148 C THR 39 29.988 20.429 19.385 1.00 0.00 ATOM 149 N ASN 40 29.922 20.193 18.079 1.00 0.00 ATOM 150 CA ASN 40 30.920 19.347 17.401 1.00 0.00 ATOM 151 CB ASN 40 30.497 18.968 15.997 1.00 0.00 ATOM 152 CG ASN 40 29.263 18.104 16.099 1.00 0.00 ATOM 153 ND2 ASN 40 28.403 18.257 15.132 1.00 0.00 ATOM 154 OD1 ASN 40 28.988 17.420 17.076 1.00 0.00 ATOM 155 O ASN 40 33.298 19.350 17.018 1.00 0.00 ATOM 156 C ASN 40 32.328 19.960 17.471 1.00 0.00 ATOM 157 N MET 41 32.431 21.158 18.037 1.00 0.00 ATOM 158 CA MET 41 33.720 21.829 18.157 1.00 0.00 ATOM 159 CB MET 41 33.789 22.647 16.693 1.00 0.00 ATOM 160 CG MET 41 33.737 21.834 15.415 1.00 0.00 ATOM 161 SD MET 41 34.334 22.768 13.979 1.00 0.00 ATOM 162 CE MET 41 33.115 24.027 13.849 1.00 0.00 ATOM 163 O MET 41 35.259 22.856 19.638 1.00 0.00 ATOM 164 C MET 41 34.106 22.886 19.183 1.00 0.00 ATOM 165 N GLY 42 33.293 23.909 19.390 1.00 0.00 ATOM 166 CA GLY 42 33.723 25.014 20.251 1.00 0.00 ATOM 167 O GLY 42 33.514 27.410 20.184 1.00 0.00 ATOM 168 C GLY 42 33.610 26.363 19.540 1.00 0.00 ATOM 169 N ALA 43 33.753 26.331 18.235 1.00 0.00 ATOM 170 CA ALA 43 33.643 27.536 17.416 1.00 0.00 ATOM 171 CB ALA 43 33.780 27.186 15.949 1.00 0.00 ATOM 172 O ALA 43 31.276 27.656 17.919 1.00 0.00 ATOM 173 C ALA 43 32.290 28.272 17.558 1.00 0.00 ATOM 174 N TRP 44 32.294 29.548 17.201 1.00 0.00 ATOM 175 CA TRP 44 31.222 30.514 17.539 1.00 0.00 ATOM 176 CB TRP 44 31.797 31.692 18.319 1.00 0.00 ATOM 177 CG TRP 44 32.345 31.334 19.646 1.00 0.00 ATOM 178 CD1 TRP 44 31.657 31.173 20.813 1.00 0.00 ATOM 179 CD2 TRP 44 33.725 31.089 19.952 1.00 0.00 ATOM 180 CE2 TRP 44 33.800 30.799 21.325 1.00 0.00 ATOM 181 CE3 TRP 44 34.893 31.121 19.209 1.00 0.00 ATOM 182 NE1 TRP 44 32.528 30.860 21.823 1.00 0.00 ATOM 183 CZ2 TRP 44 35.019 30.553 21.975 1.00 0.00 ATOM 184 CZ3 TRP 44 36.131 30.890 19.879 1.00 0.00 ATOM 185 CH2 TRP 44 36.149 30.607 21.232 1.00 0.00 ATOM 186 O TRP 44 30.802 31.710 15.476 1.00 0.00 ATOM 187 C TRP 44 30.344 31.018 16.382 1.00 0.00 ATOM 188 N PHE 45 29.038 30.939 16.631 1.00 0.00 ATOM 189 CA PHE 45 28.010 31.497 15.728 1.00 0.00 ATOM 190 CB PHE 45 27.196 30.378 15.074 1.00 0.00 ATOM 191 CG PHE 45 28.024 29.509 14.119 1.00 0.00 ATOM 192 CD1 PHE 45 28.504 28.314 14.613 1.00 0.00 ATOM 193 CD2 PHE 45 28.269 29.860 12.794 1.00 0.00 ATOM 194 CE1 PHE 45 29.227 27.480 13.779 1.00 0.00 ATOM 195 CE2 PHE 45 29.021 29.042 11.978 1.00 0.00 ATOM 196 CZ PHE 45 29.511 27.838 12.475 1.00 0.00 ATOM 197 O PHE 45 26.745 32.176 17.655 1.00 0.00 ATOM 198 C PHE 45 27.069 32.433 16.497 1.00 0.00 ATOM 199 N GLU 46 26.665 33.529 15.857 1.00 0.00 ATOM 200 CA GLU 46 25.739 34.496 16.482 1.00 0.00 ATOM 201 CB GLU 46 25.776 35.812 15.725 1.00 0.00 ATOM 202 CG GLU 46 24.918 36.864 16.435 1.00 0.00 ATOM 203 CD GLU 46 24.933 38.201 15.724 1.00 0.00 ATOM 204 OE1 GLU 46 25.745 38.386 14.802 1.00 0.00 ATOM 205 OE2 GLU 46 24.308 39.110 16.303 1.00 0.00 ATOM 206 O GLU 46 23.661 33.711 15.527 1.00 0.00 ATOM 207 C GLU 46 24.274 34.018 16.549 1.00 0.00 ATOM 208 N ALA 47 23.698 34.232 17.728 1.00 0.00 ATOM 209 CA ALA 47 22.353 33.720 18.022 1.00 0.00 ATOM 210 CB ALA 47 22.376 32.865 19.291 1.00 0.00 ATOM 211 O ALA 47 21.606 35.933 18.520 1.00 0.00 ATOM 212 C ALA 47 21.300 34.814 18.151 1.00 0.00 ATOM 213 N GLN 48 20.057 34.416 17.962 1.00 0.00 ATOM 214 CA GLN 48 18.956 35.303 18.373 1.00 0.00 ATOM 215 CB GLN 48 18.103 35.830 17.214 1.00 0.00 ATOM 216 CG GLN 48 16.765 36.351 17.726 1.00 0.00 ATOM 217 CD GLN 48 15.739 36.620 16.650 1.00 0.00 ATOM 218 OE1 GLN 48 15.338 35.788 15.841 1.00 0.00 ATOM 219 NE2 GLN 48 15.200 37.801 16.787 1.00 0.00 ATOM 220 O GLN 48 17.429 33.608 18.773 1.00 0.00 ATOM 221 C GLN 48 18.052 34.514 19.297 1.00 0.00 ATOM 222 N VAL 49 17.681 35.126 20.399 1.00 0.00 ATOM 223 CA VAL 49 16.762 34.534 21.398 1.00 0.00 ATOM 224 CB VAL 49 17.019 35.154 22.775 1.00 0.00 ATOM 225 CG1 VAL 49 16.046 34.662 23.833 1.00 0.00 ATOM 226 CG2 VAL 49 18.362 34.631 23.277 1.00 0.00 ATOM 227 O VAL 49 14.651 35.616 21.076 1.00 0.00 ATOM 228 C VAL 49 15.279 34.579 20.998 1.00 0.00 ATOM 229 N VAL 50 14.705 33.390 20.905 1.00 0.00 ATOM 230 CA VAL 50 13.248 33.185 20.767 1.00 0.00 ATOM 231 CB VAL 50 12.871 32.721 19.345 1.00 0.00 ATOM 232 CG1 VAL 50 11.366 32.485 19.191 1.00 0.00 ATOM 233 CG2 VAL 50 13.338 33.687 18.249 1.00 0.00 ATOM 234 O VAL 50 13.410 31.020 21.823 1.00 0.00 ATOM 235 C VAL 50 12.843 32.113 21.792 1.00 0.00 ATOM 236 N ARG 51 11.949 32.511 22.684 1.00 0.00 ATOM 237 CA ARG 51 11.293 31.624 23.676 1.00 0.00 ATOM 238 CB ARG 51 10.267 30.713 23.022 1.00 0.00 ATOM 239 CG ARG 51 9.258 31.519 22.225 1.00 0.00 ATOM 240 CD ARG 51 8.117 30.634 21.777 1.00 0.00 ATOM 241 NE ARG 51 7.144 31.550 21.190 1.00 0.00 ATOM 242 CZ ARG 51 5.887 31.658 21.614 1.00 0.00 ATOM 243 NH1 ARG 51 5.378 30.891 22.565 1.00 0.00 ATOM 244 NH2 ARG 51 5.099 32.524 21.026 1.00 0.00 ATOM 245 O ARG 51 12.863 29.853 24.245 1.00 0.00 ATOM 246 C ARG 51 12.180 30.801 24.615 1.00 0.00 ATOM 247 N VAL 52 11.835 31.008 25.884 1.00 0.00 ATOM 248 CA VAL 52 12.457 30.260 26.966 1.00 0.00 ATOM 249 CB VAL 52 13.211 31.252 27.878 1.00 0.00 ATOM 250 CG1 VAL 52 12.400 32.286 28.663 1.00 0.00 ATOM 251 CG2 VAL 52 13.734 30.464 29.027 1.00 0.00 ATOM 252 O VAL 52 10.471 29.946 28.302 1.00 0.00 ATOM 253 C VAL 52 11.412 29.416 27.714 1.00 0.00 ATOM 254 N THR 53 11.682 28.122 27.792 1.00 0.00 ATOM 255 CA THR 53 10.928 27.272 28.726 1.00 0.00 ATOM 256 CB THR 53 10.156 26.198 27.979 1.00 0.00 ATOM 257 CG2 THR 53 9.200 25.392 28.863 1.00 0.00 ATOM 258 OG1 THR 53 9.574 26.736 26.803 1.00 0.00 ATOM 259 O THR 53 12.806 25.855 29.190 1.00 0.00 ATOM 260 C THR 53 11.952 26.622 29.639 1.00 0.00 ATOM 261 N ARG 54 11.855 26.933 30.929 1.00 0.00 ATOM 262 CA ARG 54 12.756 26.301 31.914 1.00 0.00 ATOM 263 CB ARG 54 12.386 26.675 33.334 1.00 0.00 ATOM 264 CG ARG 54 12.909 28.039 33.758 1.00 0.00 ATOM 265 CD ARG 54 12.416 28.303 35.192 1.00 0.00 ATOM 266 NE ARG 54 12.992 27.359 36.166 1.00 0.00 ATOM 267 CZ ARG 54 14.045 27.602 36.956 1.00 0.00 ATOM 268 NH1 ARG 54 14.643 28.753 36.911 1.00 0.00 ATOM 269 NH2 ARG 54 14.610 26.725 37.757 1.00 0.00 ATOM 270 O ARG 54 13.603 24.063 32.009 1.00 0.00 ATOM 271 C ARG 54 12.640 24.774 31.858 1.00 0.00 ATOM 272 N LYS 55 11.413 24.281 31.853 1.00 0.00 ATOM 273 CA LYS 55 11.181 22.828 31.793 1.00 0.00 ATOM 274 CB LYS 55 9.721 22.567 32.133 1.00 0.00 ATOM 275 CG LYS 55 9.316 22.858 33.563 1.00 0.00 ATOM 276 CD LYS 55 7.810 22.601 33.620 1.00 0.00 ATOM 277 CE LYS 55 7.343 22.795 35.052 1.00 0.00 ATOM 278 NZ LYS 55 5.909 22.500 35.142 1.00 0.00 ATOM 279 O LYS 55 11.072 21.045 30.191 1.00 0.00 ATOM 280 C LYS 55 11.298 22.239 30.395 1.00 0.00 ATOM 281 N ALA 56 11.794 23.012 29.344 1.00 0.00 ATOM 282 CA ALA 56 11.925 22.525 27.977 1.00 0.00 ATOM 283 CB ALA 56 10.798 23.280 27.049 1.00 0.00 ATOM 284 O ALA 56 13.220 22.325 25.914 1.00 0.00 ATOM 285 C ALA 56 12.911 21.818 27.006 1.00 0.00 ATOM 286 N PRO 57 13.155 20.519 27.125 1.00 0.00 ATOM 287 CA PRO 57 13.830 19.842 26.011 1.00 0.00 ATOM 288 CB PRO 57 14.405 18.584 26.665 1.00 0.00 ATOM 289 CG PRO 57 13.350 18.251 27.719 1.00 0.00 ATOM 290 CD PRO 57 12.920 19.609 28.256 1.00 0.00 ATOM 291 O PRO 57 11.937 20.555 24.613 1.00 0.00 ATOM 292 C PRO 57 12.773 19.687 24.900 1.00 0.00 ATOM 293 N SER 58 12.811 18.544 24.248 1.00 0.00 ATOM 294 CA SER 58 11.836 18.245 23.196 1.00 0.00 ATOM 295 CB SER 58 12.356 18.808 21.866 1.00 0.00 ATOM 296 OG SER 58 13.608 18.211 21.550 1.00 0.00 ATOM 297 O SER 58 11.745 16.097 24.248 1.00 0.00 ATOM 298 C SER 58 11.492 16.760 23.240 1.00 0.00 ATOM 299 N ARG 59 10.915 16.282 22.143 1.00 0.00 ATOM 300 CA ARG 59 10.501 14.864 22.036 1.00 0.00 ATOM 301 CB ARG 59 9.969 14.587 20.642 1.00 0.00 ATOM 302 CG ARG 59 8.684 15.336 20.309 1.00 0.00 ATOM 303 CD ARG 59 7.559 14.920 21.229 1.00 0.00 ATOM 304 NE ARG 59 6.297 15.403 20.719 1.00 0.00 ATOM 305 CZ ARG 59 5.103 14.980 21.120 1.00 0.00 ATOM 306 NH1 ARG 59 4.997 14.079 22.088 1.00 0.00 ATOM 307 NH2 ARG 59 4.012 15.488 20.562 1.00 0.00 ATOM 308 O ARG 59 12.879 14.539 22.175 1.00 0.00 ATOM 309 C ARG 59 11.766 14.016 22.139 1.00 0.00 ATOM 310 N ASP 60 11.570 12.715 22.290 1.00 0.00 ATOM 311 CA ASP 60 12.686 11.771 22.113 1.00 0.00 ATOM 312 CB ASP 60 12.220 10.393 22.554 1.00 0.00 ATOM 313 CG ASP 60 13.296 9.313 22.422 1.00 0.00 ATOM 314 OD1 ASP 60 14.504 9.669 22.308 1.00 0.00 ATOM 315 OD2 ASP 60 12.868 8.156 22.589 1.00 0.00 ATOM 316 O ASP 60 12.642 11.099 19.764 1.00 0.00 ATOM 317 C ASP 60 13.137 11.804 20.640 1.00 0.00 ATOM 318 N GLU 61 13.822 12.905 20.352 1.00 0.00 ATOM 319 CA GLU 61 14.284 13.309 19.020 1.00 0.00 ATOM 320 CB GLU 61 13.314 14.324 18.417 1.00 0.00 ATOM 321 CG GLU 61 12.047 13.686 17.837 1.00 0.00 ATOM 322 CD GLU 61 12.246 12.898 16.542 1.00 0.00 ATOM 323 OE1 GLU 61 13.343 12.987 15.925 1.00 0.00 ATOM 324 OE2 GLU 61 11.208 12.388 16.071 1.00 0.00 ATOM 325 O GLU 61 15.850 15.117 19.280 1.00 0.00 ATOM 326 C GLU 61 15.691 13.902 19.203 1.00 0.00 ATOM 327 N PRO 62 16.693 13.058 19.429 1.00 0.00 ATOM 328 CA PRO 62 18.081 13.489 19.705 1.00 0.00 ATOM 329 CB PRO 62 18.886 12.209 19.825 1.00 0.00 ATOM 330 CG PRO 62 17.863 11.178 20.278 1.00 0.00 ATOM 331 CD PRO 62 16.568 11.610 19.591 1.00 0.00 ATOM 332 O PRO 62 18.894 13.936 17.473 1.00 0.00 ATOM 333 C PRO 62 18.654 14.376 18.602 1.00 0.00 ATOM 334 N CYS 63 18.815 15.644 18.955 1.00 0.00 ATOM 335 CA CYS 63 19.497 16.625 18.098 1.00 0.00 ATOM 336 CB CYS 63 18.991 18.021 18.247 1.00 0.00 ATOM 337 SG CYS 63 18.989 18.708 19.916 1.00 0.00 ATOM 338 O CYS 63 21.791 17.108 17.612 1.00 0.00 ATOM 339 C CYS 63 20.990 16.695 18.447 1.00 0.00 ATOM 340 N SER 64 21.236 16.478 19.765 1.00 0.00 ATOM 341 CA SER 64 22.549 16.342 20.406 1.00 0.00 ATOM 342 CB SER 64 23.680 15.763 19.553 1.00 0.00 ATOM 343 OG SER 64 23.522 14.363 19.793 1.00 0.00 ATOM 344 O SER 64 23.135 18.467 21.494 1.00 0.00 ATOM 345 C SER 64 22.962 17.250 21.549 1.00 0.00 ATOM 346 N SER 65 22.808 16.635 22.707 1.00 0.00 ATOM 347 CA SER 65 23.368 17.184 23.950 1.00 0.00 ATOM 348 CB SER 65 22.426 16.865 25.108 1.00 0.00 ATOM 349 OG SER 65 22.365 15.468 25.365 1.00 0.00 ATOM 350 O SER 65 25.394 16.758 25.185 1.00 0.00 ATOM 351 C SER 65 24.740 16.541 24.166 1.00 0.00 ATOM 352 N THR 66 25.127 15.782 23.146 1.00 0.00 ATOM 353 CA THR 66 26.397 15.091 23.015 1.00 0.00 ATOM 354 CB THR 66 27.528 16.089 22.690 1.00 0.00 ATOM 355 CG2 THR 66 27.199 16.803 21.376 1.00 0.00 ATOM 356 OG1 THR 66 27.883 17.014 23.703 1.00 0.00 ATOM 357 O THR 66 27.760 14.118 24.754 1.00 0.00 ATOM 358 C THR 66 26.682 14.126 24.162 1.00 0.00 ATOM 359 N SER 67 25.645 13.353 24.484 1.00 0.00 ATOM 360 CA SER 67 25.662 12.356 25.585 1.00 0.00 ATOM 361 CB SER 67 26.688 11.269 25.276 1.00 0.00 ATOM 362 OG SER 67 26.271 10.511 24.140 1.00 0.00 ATOM 363 O SER 67 26.074 12.293 27.968 1.00 0.00 ATOM 364 C SER 67 25.950 12.975 26.959 1.00 0.00 ATOM 365 N ARG 68 25.808 14.290 27.013 1.00 0.00 ATOM 366 CA ARG 68 25.964 15.058 28.247 1.00 0.00 ATOM 367 CB ARG 68 26.842 16.249 27.893 1.00 0.00 ATOM 368 CG ARG 68 27.275 17.062 29.107 1.00 0.00 ATOM 369 CD ARG 68 28.178 18.171 28.611 1.00 0.00 ATOM 370 NE ARG 68 28.503 19.081 29.721 1.00 0.00 ATOM 371 CZ ARG 68 29.102 20.259 29.597 1.00 0.00 ATOM 372 NH1 ARG 68 29.253 21.084 30.605 1.00 0.00 ATOM 373 NH2 ARG 68 29.519 20.638 28.425 1.00 0.00 ATOM 374 O ARG 68 23.979 16.341 27.941 1.00 0.00 ATOM 375 C ARG 68 24.527 15.448 28.602 1.00 0.00 ATOM 376 N PRO 69 23.881 14.728 29.528 1.00 0.00 ATOM 377 CA PRO 69 22.456 14.933 29.855 1.00 0.00 ATOM 378 CB PRO 69 22.130 13.796 30.815 1.00 0.00 ATOM 379 CG PRO 69 23.445 13.555 31.552 1.00 0.00 ATOM 380 CD PRO 69 24.451 13.683 30.411 1.00 0.00 ATOM 381 O PRO 69 21.120 16.365 31.168 1.00 0.00 ATOM 382 C PRO 69 22.120 16.289 30.469 1.00 0.00 ATOM 383 N ALA 70 22.847 17.357 30.130 1.00 0.00 ATOM 384 CA ALA 70 22.643 18.699 30.716 1.00 0.00 ATOM 385 CB ALA 70 21.248 19.260 30.407 1.00 0.00 ATOM 386 O ALA 70 23.095 17.547 32.797 1.00 0.00 ATOM 387 C ALA 70 22.894 18.621 32.232 1.00 0.00 ATOM 388 N LEU 71 23.211 19.774 32.791 1.00 0.00 ATOM 389 CA LEU 71 23.638 19.817 34.209 1.00 0.00 ATOM 390 CB LEU 71 24.969 20.536 34.374 1.00 0.00 ATOM 391 CG LEU 71 26.213 19.691 34.169 1.00 0.00 ATOM 392 CD1 LEU 71 27.404 20.610 34.321 1.00 0.00 ATOM 393 CD2 LEU 71 26.336 18.557 35.190 1.00 0.00 ATOM 394 O LEU 71 23.081 20.894 36.234 1.00 0.00 ATOM 395 C LEU 71 22.668 20.536 35.131 1.00 0.00 ATOM 396 N GLU 72 21.418 20.735 34.702 1.00 0.00 ATOM 397 CA GLU 72 20.341 21.193 35.601 1.00 0.00 ATOM 398 CB GLU 72 20.419 20.435 36.950 1.00 0.00 ATOM 399 CG GLU 72 20.474 18.891 36.811 1.00 0.00 ATOM 400 CD GLU 72 20.532 18.103 38.139 1.00 0.00 ATOM 401 OE1 GLU 72 20.197 18.678 39.188 1.00 0.00 ATOM 402 OE2 GLU 72 20.736 16.865 38.092 1.00 0.00 ATOM 403 O GLU 72 19.237 23.264 36.260 1.00 0.00 ATOM 404 C GLU 72 20.189 22.735 35.677 1.00 0.00 ATOM 405 N GLU 73 20.932 23.469 34.838 1.00 0.00 ATOM 406 CA GLU 73 20.585 24.884 34.624 1.00 0.00 ATOM 407 CB GLU 73 21.824 25.725 34.444 1.00 0.00 ATOM 408 CG GLU 73 22.290 26.331 35.773 1.00 0.00 ATOM 409 CD GLU 73 21.199 27.166 36.462 1.00 0.00 ATOM 410 OE1 GLU 73 20.689 28.122 35.835 1.00 0.00 ATOM 411 OE2 GLU 73 20.851 26.873 37.630 1.00 0.00 ATOM 412 O GLU 73 18.410 25.852 34.446 1.00 0.00 ATOM 413 C GLU 73 19.121 24.897 34.165 1.00 0.00 ATOM 414 N ASP 74 18.761 23.912 33.322 1.00 0.00 ATOM 415 CA ASP 74 17.422 23.835 32.741 1.00 0.00 ATOM 416 CB ASP 74 16.274 23.165 33.479 1.00 0.00 ATOM 417 CG ASP 74 16.667 22.019 34.391 1.00 0.00 ATOM 418 OD1 ASP 74 17.596 21.281 34.042 1.00 0.00 ATOM 419 OD2 ASP 74 15.980 21.904 35.433 1.00 0.00 ATOM 420 O ASP 74 15.929 24.135 30.867 1.00 0.00 ATOM 421 C ASP 74 16.760 24.634 31.623 1.00 0.00 ATOM 422 N VAL 75 17.171 25.870 31.422 1.00 0.00 ATOM 423 CA VAL 75 16.453 26.719 30.475 1.00 0.00 ATOM 424 CB VAL 75 16.494 28.241 30.948 1.00 0.00 ATOM 425 CG1 VAL 75 16.029 28.402 32.404 1.00 0.00 ATOM 426 CG2 VAL 75 17.912 28.789 30.792 1.00 0.00 ATOM 427 O VAL 75 17.886 26.260 28.604 1.00 0.00 ATOM 428 C VAL 75 16.731 26.266 29.021 1.00 0.00 ATOM 429 N ILE 76 15.687 26.191 28.197 1.00 0.00 ATOM 430 CA ILE 76 15.875 25.840 26.773 1.00 0.00 ATOM 431 CB ILE 76 15.209 24.500 26.393 1.00 0.00 ATOM 432 CG1 ILE 76 15.699 23.395 27.349 1.00 0.00 ATOM 433 CG2 ILE 76 15.383 24.105 24.920 1.00 0.00 ATOM 434 CD1 ILE 76 17.207 23.223 27.428 1.00 0.00 ATOM 435 O ILE 76 14.251 27.406 25.974 1.00 0.00 ATOM 436 C ILE 76 15.386 26.939 25.830 1.00 0.00 ATOM 437 N TYR 77 16.152 27.081 24.753 1.00 0.00 ATOM 438 CA TYR 77 15.788 28.020 23.680 1.00 0.00 ATOM 439 CB TYR 77 16.833 29.114 23.499 1.00 0.00 ATOM 440 CG TYR 77 16.929 30.057 24.690 1.00 0.00 ATOM 441 CD1 TYR 77 17.965 29.883 25.592 1.00 0.00 ATOM 442 CD2 TYR 77 16.036 31.118 24.808 1.00 0.00 ATOM 443 CE1 TYR 77 18.115 30.788 26.630 1.00 0.00 ATOM 444 CE2 TYR 77 16.189 32.012 25.838 1.00 0.00 ATOM 445 CZ TYR 77 17.213 31.845 26.728 1.00 0.00 ATOM 446 OH TYR 77 16.982 32.499 27.871 1.00 0.00 ATOM 447 O TYR 77 16.300 26.517 21.854 1.00 0.00 ATOM 448 C TYR 77 15.541 27.362 22.315 1.00 0.00 ATOM 449 N HIS 78 14.530 27.918 21.673 1.00 0.00 ATOM 450 CA HIS 78 14.204 27.617 20.272 1.00 0.00 ATOM 451 CB HIS 78 12.713 27.275 20.137 1.00 0.00 ATOM 452 CG HIS 78 12.318 26.033 20.941 1.00 0.00 ATOM 453 CD2 HIS 78 11.589 25.961 22.057 1.00 0.00 ATOM 454 ND1 HIS 78 12.566 24.789 20.566 1.00 0.00 ATOM 455 CE1 HIS 78 12.024 23.959 21.461 1.00 0.00 ATOM 456 NE2 HIS 78 11.415 24.681 22.382 1.00 0.00 ATOM 457 O HIS 78 13.749 29.858 19.556 1.00 0.00 ATOM 458 C HIS 78 14.516 28.899 19.515 1.00 0.00 ATOM 459 N VAL 79 15.705 28.981 18.952 1.00 0.00 ATOM 460 CA VAL 79 16.078 30.220 18.293 1.00 0.00 ATOM 461 CB VAL 79 17.283 30.788 19.030 1.00 0.00 ATOM 462 CG1 VAL 79 17.011 31.018 20.513 1.00 0.00 ATOM 463 CG2 VAL 79 18.629 30.130 18.729 1.00 0.00 ATOM 464 O VAL 79 16.476 29.044 16.181 1.00 0.00 ATOM 465 C VAL 79 16.354 30.102 16.799 1.00 0.00 ATOM 466 N LYS 80 16.716 31.272 16.345 1.00 0.00 ATOM 467 CA LYS 80 17.267 31.387 15.005 1.00 0.00 ATOM 468 CB LYS 80 16.150 31.944 14.148 1.00 0.00 ATOM 469 CG LYS 80 16.673 32.033 12.720 1.00 0.00 ATOM 470 CD LYS 80 15.572 32.357 11.731 1.00 0.00 ATOM 471 CE LYS 80 15.047 33.754 11.993 1.00 0.00 ATOM 472 NZ LYS 80 14.286 34.148 10.821 1.00 0.00 ATOM 473 O LYS 80 18.609 33.304 15.600 1.00 0.00 ATOM 474 C LYS 80 18.491 32.296 14.890 1.00 0.00 ATOM 475 N TYR 81 19.411 31.916 13.996 1.00 0.00 ATOM 476 CA TYR 81 20.635 32.678 13.814 1.00 0.00 ATOM 477 CB TYR 81 21.785 31.764 13.406 1.00 0.00 ATOM 478 CG TYR 81 22.220 30.803 14.479 1.00 0.00 ATOM 479 CD1 TYR 81 22.815 29.630 14.061 1.00 0.00 ATOM 480 CD2 TYR 81 22.159 31.126 15.821 1.00 0.00 ATOM 481 CE1 TYR 81 23.378 28.780 14.985 1.00 0.00 ATOM 482 CE2 TYR 81 22.711 30.278 16.753 1.00 0.00 ATOM 483 CZ TYR 81 23.325 29.115 16.333 1.00 0.00 ATOM 484 OH TYR 81 23.701 28.201 17.248 1.00 0.00 ATOM 485 O TYR 81 19.810 33.213 11.643 1.00 0.00 ATOM 486 C TYR 81 20.481 33.593 12.610 1.00 0.00 ATOM 487 N ASP 82 21.440 34.502 12.548 1.00 0.00 ATOM 488 CA ASP 82 21.607 35.384 11.379 1.00 0.00 ATOM 489 CB ASP 82 22.164 36.747 11.783 1.00 0.00 ATOM 490 CG ASP 82 21.152 37.561 12.596 1.00 0.00 ATOM 491 OD1 ASP 82 19.940 37.238 12.551 1.00 0.00 ATOM 492 OD2 ASP 82 21.588 38.526 13.230 1.00 0.00 ATOM 493 O ASP 82 22.034 34.700 9.144 1.00 0.00 ATOM 494 C ASP 82 22.477 34.783 10.288 1.00 0.00 ATOM 495 N ASP 83 23.559 34.124 10.721 1.00 0.00 ATOM 496 CA ASP 83 24.572 33.558 9.806 1.00 0.00 ATOM 497 CB ASP 83 25.923 33.343 10.522 1.00 0.00 ATOM 498 CG ASP 83 26.645 34.668 10.802 1.00 0.00 ATOM 499 OD1 ASP 83 26.290 35.696 10.183 1.00 0.00 ATOM 500 OD2 ASP 83 27.612 34.660 11.594 1.00 0.00 ATOM 501 O ASP 83 24.472 32.082 7.888 1.00 0.00 ATOM 502 C ASP 83 24.146 32.297 9.052 1.00 0.00 ATOM 503 N TYR 84 23.471 31.399 9.766 1.00 0.00 ATOM 504 CA TYR 84 22.910 30.178 9.152 1.00 0.00 ATOM 505 CB TYR 84 22.732 29.174 10.306 1.00 0.00 ATOM 506 CG TYR 84 22.440 27.733 9.864 1.00 0.00 ATOM 507 CD1 TYR 84 23.436 26.917 9.382 1.00 0.00 ATOM 508 CD2 TYR 84 21.152 27.255 9.947 1.00 0.00 ATOM 509 CE1 TYR 84 23.166 25.633 8.940 1.00 0.00 ATOM 510 CE2 TYR 84 20.861 25.966 9.527 1.00 0.00 ATOM 511 CZ TYR 84 21.858 25.162 9.011 1.00 0.00 ATOM 512 OH TYR 84 21.585 23.897 8.604 1.00 0.00 ATOM 513 O TYR 84 20.615 30.644 9.302 1.00 0.00 ATOM 514 C TYR 84 21.565 30.608 8.534 1.00 0.00 ATOM 515 N PRO 85 21.445 31.135 7.200 1.00 0.00 ATOM 516 CA PRO 85 20.363 31.987 6.654 1.00 0.00 ATOM 517 CB PRO 85 20.409 31.641 5.174 1.00 0.00 ATOM 518 CG PRO 85 21.886 31.437 4.884 1.00 0.00 ATOM 519 CD PRO 85 22.309 30.640 6.103 1.00 0.00 ATOM 520 O PRO 85 18.680 32.053 8.438 1.00 0.00 ATOM 521 C PRO 85 18.924 31.938 7.241 1.00 0.00 ATOM 522 N GLU 86 17.922 31.998 6.369 1.00 0.00 ATOM 523 CA GLU 86 16.481 32.071 6.713 1.00 0.00 ATOM 524 CB GLU 86 15.735 32.423 5.432 1.00 0.00 ATOM 525 CG GLU 86 16.012 31.368 4.344 1.00 0.00 ATOM 526 CD GLU 86 15.270 31.666 3.056 1.00 0.00 ATOM 527 OE1 GLU 86 14.546 32.690 3.018 1.00 0.00 ATOM 528 OE2 GLU 86 15.371 30.753 2.202 1.00 0.00 ATOM 529 O GLU 86 16.505 29.704 7.125 1.00 0.00 ATOM 530 C GLU 86 15.895 30.763 7.227 1.00 0.00 ATOM 531 N ASN 87 14.684 30.830 7.792 1.00 0.00 ATOM 532 CA ASN 87 14.030 29.614 8.321 1.00 0.00 ATOM 533 CB ASN 87 13.636 28.687 7.162 1.00 0.00 ATOM 534 CG ASN 87 12.570 29.312 6.262 1.00 0.00 ATOM 535 ND2 ASN 87 12.540 28.986 5.001 1.00 0.00 ATOM 536 OD1 ASN 87 11.812 30.139 6.707 1.00 0.00 ATOM 537 O ASN 87 15.239 27.663 9.156 1.00 0.00 ATOM 538 C ASN 87 15.003 28.864 9.246 1.00 0.00 ATOM 539 N GLY 88 15.789 29.692 9.944 1.00 0.00 ATOM 540 CA GLY 88 16.935 29.230 10.742 1.00 0.00 ATOM 541 O GLY 88 15.590 29.276 12.711 1.00 0.00 ATOM 542 C GLY 88 16.485 28.707 12.065 1.00 0.00 ATOM 543 N VAL 89 17.167 27.673 12.574 1.00 0.00 ATOM 544 CA VAL 89 16.743 27.021 13.815 1.00 0.00 ATOM 545 CB VAL 89 15.620 25.987 13.497 1.00 0.00 ATOM 546 CG1 VAL 89 16.084 25.023 12.480 1.00 0.00 ATOM 547 CG2 VAL 89 15.112 25.300 14.697 1.00 0.00 ATOM 548 O VAL 89 18.824 25.852 14.013 1.00 0.00 ATOM 549 C VAL 89 17.927 26.459 14.593 1.00 0.00 ATOM 550 N VAL 90 17.949 26.720 15.929 1.00 0.00 ATOM 551 CA VAL 90 18.971 26.178 16.814 1.00 0.00 ATOM 552 CB VAL 90 20.090 27.229 16.982 1.00 0.00 ATOM 553 CG1 VAL 90 21.176 26.659 17.853 1.00 0.00 ATOM 554 CG2 VAL 90 20.653 27.643 15.641 1.00 0.00 ATOM 555 O VAL 90 17.709 26.785 18.767 1.00 0.00 ATOM 556 C VAL 90 18.237 25.884 18.113 1.00 0.00 ATOM 557 N GLN 91 18.047 24.594 18.309 1.00 0.00 ATOM 558 CA GLN 91 17.452 24.078 19.547 1.00 0.00 ATOM 559 CB GLN 91 16.754 22.761 19.159 1.00 0.00 ATOM 560 CG GLN 91 15.659 23.017 18.128 1.00 0.00 ATOM 561 CD GLN 91 14.791 21.815 17.755 1.00 0.00 ATOM 562 OE1 GLN 91 14.816 20.737 18.338 1.00 0.00 ATOM 563 NE2 GLN 91 14.025 21.969 16.711 1.00 0.00 ATOM 564 O GLN 91 19.586 23.224 20.218 1.00 0.00 ATOM 565 C GLN 91 18.611 23.900 20.541 1.00 0.00 ATOM 566 N MET 92 18.613 24.760 21.557 1.00 0.00 ATOM 567 CA MET 92 19.758 24.886 22.491 1.00 0.00 ATOM 568 CB MET 92 20.391 26.269 22.403 1.00 0.00 ATOM 569 CG MET 92 21.078 26.519 21.072 1.00 0.00 ATOM 570 SD MET 92 22.570 25.510 20.786 1.00 0.00 ATOM 571 CE MET 92 23.723 26.558 21.635 1.00 0.00 ATOM 572 O MET 92 18.508 25.213 24.516 1.00 0.00 ATOM 573 C MET 92 19.457 24.651 23.967 1.00 0.00 ATOM 574 N ASN 93 20.438 24.039 24.622 1.00 0.00 ATOM 575 CA ASN 93 20.476 23.961 26.082 1.00 0.00 ATOM 576 CB ASN 93 21.251 22.720 26.500 1.00 0.00 ATOM 577 CG ASN 93 20.508 21.429 26.228 1.00 0.00 ATOM 578 ND2 ASN 93 21.296 20.457 25.852 1.00 0.00 ATOM 579 OD1 ASN 93 19.317 21.238 26.354 1.00 0.00 ATOM 580 O ASN 93 21.983 25.838 25.963 1.00 0.00 ATOM 581 C ASN 93 21.199 25.183 26.650 1.00 0.00 ATOM 582 N SER 94 21.147 25.271 27.980 1.00 0.00 ATOM 583 CA SER 94 21.753 26.405 28.722 1.00 0.00 ATOM 584 CB SER 94 21.345 26.386 30.179 1.00 0.00 ATOM 585 OG SER 94 19.944 26.554 30.275 1.00 0.00 ATOM 586 O SER 94 23.928 27.410 28.601 1.00 0.00 ATOM 587 C SER 94 23.277 26.378 28.773 1.00 0.00 ATOM 588 N ARG 95 23.843 25.200 29.008 1.00 0.00 ATOM 589 CA ARG 95 25.293 25.057 29.075 1.00 0.00 ATOM 590 CB ARG 95 25.628 23.627 29.510 1.00 0.00 ATOM 591 CG ARG 95 25.351 22.589 28.425 1.00 0.00 ATOM 592 CD ARG 95 25.942 21.248 28.827 1.00 0.00 ATOM 593 NE ARG 95 25.661 20.241 27.785 1.00 0.00 ATOM 594 CZ ARG 95 24.457 19.771 27.473 1.00 0.00 ATOM 595 NH1 ARG 95 24.297 18.877 26.531 1.00 0.00 ATOM 596 NH2 ARG 95 23.373 20.175 28.125 1.00 0.00 ATOM 597 O ARG 95 27.136 25.588 27.615 1.00 0.00 ATOM 598 C ARG 95 25.916 25.449 27.723 1.00 0.00 ATOM 599 N ASP 96 25.078 25.623 26.706 1.00 0.00 ATOM 600 CA ASP 96 25.563 25.998 25.383 1.00 0.00 ATOM 601 CB ASP 96 24.884 25.083 24.366 1.00 0.00 ATOM 602 CG ASP 96 25.315 23.626 24.454 1.00 0.00 ATOM 603 OD1 ASP 96 26.529 23.361 24.622 1.00 0.00 ATOM 604 OD2 ASP 96 24.419 22.782 24.630 1.00 0.00 ATOM 605 O ASP 96 25.822 27.899 23.942 1.00 0.00 ATOM 606 C ASP 96 25.304 27.440 24.961 1.00 0.00 ATOM 607 N VAL 97 24.502 28.154 25.746 1.00 0.00 ATOM 608 CA VAL 97 24.174 29.581 25.441 1.00 0.00 ATOM 609 CB VAL 97 22.707 29.932 25.779 1.00 0.00 ATOM 610 CG1 VAL 97 22.413 31.407 25.553 1.00 0.00 ATOM 611 CG2 VAL 97 21.730 29.128 24.921 1.00 0.00 ATOM 612 O VAL 97 24.991 30.761 27.343 1.00 0.00 ATOM 613 C VAL 97 25.125 30.510 26.144 1.00 0.00 ATOM 614 N ARG 98 26.121 30.998 25.412 1.00 0.00 ATOM 615 CA ARG 98 27.128 31.876 25.994 1.00 0.00 ATOM 616 CB ARG 98 28.537 31.494 25.531 1.00 0.00 ATOM 617 CG ARG 98 28.985 30.117 26.018 1.00 0.00 ATOM 618 CD ARG 98 30.295 29.699 25.378 1.00 0.00 ATOM 619 NE ARG 98 30.628 28.364 25.866 1.00 0.00 ATOM 620 CZ ARG 98 31.275 28.093 27.001 1.00 0.00 ATOM 621 NH1 ARG 98 31.539 26.841 27.327 1.00 0.00 ATOM 622 NH2 ARG 98 31.669 29.048 27.823 1.00 0.00 ATOM 623 O ARG 98 26.550 33.618 24.468 1.00 0.00 ATOM 624 C ARG 98 26.690 33.289 25.622 1.00 0.00 ATOM 625 N ALA 99 26.025 33.954 26.551 1.00 0.00 ATOM 626 CA ALA 99 25.396 35.252 26.243 1.00 0.00 ATOM 627 CB ALA 99 24.786 35.781 27.528 1.00 0.00 ATOM 628 O ALA 99 27.396 36.583 26.280 1.00 0.00 ATOM 629 C ALA 99 26.347 36.334 25.703 1.00 0.00 ATOM 630 N ARG 100 25.790 37.146 24.813 1.00 0.00 ATOM 631 CA ARG 100 26.478 38.395 24.441 1.00 0.00 ATOM 632 CB ARG 100 26.260 38.800 22.995 1.00 0.00 ATOM 633 CG ARG 100 26.700 37.792 21.943 1.00 0.00 ATOM 634 CD ARG 100 26.498 38.360 20.534 1.00 0.00 ATOM 635 NE ARG 100 27.301 39.571 20.272 1.00 0.00 ATOM 636 CZ ARG 100 27.168 40.335 19.191 1.00 0.00 ATOM 637 NH1 ARG 100 27.902 41.411 18.999 1.00 0.00 ATOM 638 NH2 ARG 100 26.338 40.042 18.226 1.00 0.00 ATOM 639 O ARG 100 26.566 40.629 25.340 1.00 0.00 ATOM 640 C ARG 100 25.953 39.568 25.272 1.00 0.00 ATOM 641 N ALA 101 24.817 39.377 25.945 1.00 0.00 ATOM 642 CA ALA 101 24.325 40.338 26.952 1.00 0.00 ATOM 643 CB ALA 101 22.991 39.899 27.527 1.00 0.00 ATOM 644 O ALA 101 25.506 41.423 28.728 1.00 0.00 ATOM 645 C ALA 101 25.308 40.378 28.115 1.00 0.00 ATOM 646 N ARG 102 26.052 39.287 28.283 1.00 0.00 ATOM 647 CA ARG 102 27.158 39.344 29.243 1.00 0.00 ATOM 648 CB ARG 102 27.312 38.058 30.048 1.00 0.00 ATOM 649 CG ARG 102 27.682 36.809 29.257 1.00 0.00 ATOM 650 CD ARG 102 27.772 35.576 30.143 1.00 0.00 ATOM 651 NE ARG 102 28.742 35.828 31.214 1.00 0.00 ATOM 652 CZ ARG 102 29.176 34.914 32.070 1.00 0.00 ATOM 653 NH1 ARG 102 28.768 33.672 31.983 1.00 0.00 ATOM 654 NH2 ARG 102 30.022 35.205 33.038 1.00 0.00 ATOM 655 O ARG 102 29.367 39.179 28.225 1.00 0.00 ATOM 656 C ARG 102 28.370 39.848 28.466 1.00 0.00 ATOM 657 N THR 103 28.162 41.069 28.004 1.00 0.00 ATOM 658 CA THR 103 29.266 41.827 27.395 1.00 0.00 ATOM 659 CB THR 103 29.064 42.175 25.921 1.00 0.00 ATOM 660 CG2 THR 103 29.317 40.850 25.217 1.00 0.00 ATOM 661 OG1 THR 103 27.786 42.687 25.386 1.00 0.00 ATOM 662 O THR 103 29.056 44.231 27.716 1.00 0.00 ATOM 663 C THR 103 29.280 43.141 28.212 1.00 0.00 ATOM 664 N ILE 104 29.628 42.751 29.590 1.00 0.00 ATOM 665 CA ILE 104 29.394 43.634 30.762 1.00 0.00 ATOM 666 CB ILE 104 28.931 42.777 32.002 1.00 0.00 ATOM 667 CG1 ILE 104 28.378 41.370 31.693 1.00 0.00 ATOM 668 CG2 ILE 104 27.794 43.485 32.776 1.00 0.00 ATOM 669 CD1 ILE 104 28.228 40.382 32.860 1.00 0.00 ATOM 670 O ILE 104 30.413 45.164 32.327 1.00 0.00 ATOM 671 C ILE 104 30.448 44.727 31.169 1.00 0.00 ATOM 672 N ILE 105 31.260 45.356 30.282 1.00 0.00 ATOM 673 CA ILE 105 32.021 46.616 30.590 1.00 0.00 ATOM 674 CB ILE 105 33.034 47.046 29.469 1.00 0.00 ATOM 675 CG1 ILE 105 34.094 45.983 29.199 1.00 0.00 ATOM 676 CG2 ILE 105 33.828 48.369 29.633 1.00 0.00 ATOM 677 CD1 ILE 105 35.039 45.657 30.353 1.00 0.00 ATOM 678 O ILE 105 29.756 47.462 30.794 1.00 0.00 ATOM 679 C ILE 105 30.957 47.720 30.768 1.00 0.00 ATOM 680 N LYS 106 31.397 48.959 30.934 1.00 0.00 ATOM 681 CA LYS 106 30.663 50.191 31.275 1.00 0.00 ATOM 682 CB LYS 106 29.154 50.321 30.994 1.00 0.00 ATOM 683 CG LYS 106 28.761 50.525 29.529 1.00 0.00 ATOM 684 CD LYS 106 27.279 50.920 29.416 1.00 0.00 ATOM 685 CE LYS 106 26.836 51.009 27.954 1.00 0.00 ATOM 686 NZ LYS 106 25.443 51.425 27.808 1.00 0.00 ATOM 687 O LYS 106 31.301 51.393 33.234 1.00 0.00 ATOM 688 C LYS 106 30.946 50.322 32.767 1.00 0.00 ATOM 689 N TRP 107 30.656 48.944 33.469 1.00 0.00 ATOM 690 CA TRP 107 31.376 48.715 34.730 1.00 0.00 ATOM 691 CB TRP 107 31.257 47.183 35.081 1.00 0.00 ATOM 692 CG TRP 107 29.868 46.652 35.335 1.00 0.00 ATOM 693 CD1 TRP 107 28.682 47.339 35.261 1.00 0.00 ATOM 694 CD2 TRP 107 29.523 45.301 35.661 1.00 0.00 ATOM 695 CE2 TRP 107 28.113 45.237 35.767 1.00 0.00 ATOM 696 CE3 TRP 107 30.270 44.135 35.875 1.00 0.00 ATOM 697 NE1 TRP 107 27.626 46.492 35.521 1.00 0.00 ATOM 698 CZ2 TRP 107 27.434 44.049 36.077 1.00 0.00 ATOM 699 CZ3 TRP 107 29.599 42.954 36.186 1.00 0.00 ATOM 700 CH2 TRP 107 28.191 42.922 36.283 1.00 0.00 ATOM 701 O TRP 107 33.341 49.642 35.566 1.00 0.00 ATOM 702 C TRP 107 32.863 49.098 34.582 1.00 0.00 ATOM 703 N GLN 108 33.499 48.846 33.411 1.00 0.00 ATOM 704 CA GLN 108 34.905 49.130 33.007 1.00 0.00 ATOM 705 CB GLN 108 35.057 50.471 32.269 1.00 0.00 ATOM 706 CG GLN 108 34.526 51.662 33.081 1.00 0.00 ATOM 707 CD GLN 108 34.538 52.997 32.332 1.00 0.00 ATOM 708 OE1 GLN 108 34.354 53.199 31.145 1.00 0.00 ATOM 709 NE2 GLN 108 34.865 54.015 33.049 1.00 0.00 ATOM 710 O GLN 108 35.885 49.716 35.105 1.00 0.00 ATOM 711 C GLN 108 35.974 49.023 34.098 1.00 0.00 ATOM 712 N ASP 109 37.003 48.220 33.821 1.00 0.00 ATOM 713 CA ASP 109 38.046 47.861 34.812 1.00 0.00 ATOM 714 CB ASP 109 37.515 47.684 36.257 1.00 0.00 ATOM 715 CG ASP 109 36.151 47.036 36.531 1.00 0.00 ATOM 716 OD1 ASP 109 35.581 46.434 35.603 1.00 0.00 ATOM 717 OD2 ASP 109 35.836 46.915 37.744 1.00 0.00 ATOM 718 O ASP 109 39.088 45.655 35.019 1.00 0.00 ATOM 719 C ASP 109 38.833 46.626 34.318 1.00 0.00 ATOM 720 N LEU 110 39.436 46.796 33.161 1.00 0.00 ATOM 721 CA LEU 110 40.209 45.715 32.524 1.00 0.00 ATOM 722 CB LEU 110 40.086 45.783 30.998 1.00 0.00 ATOM 723 CG LEU 110 38.667 45.680 30.457 1.00 0.00 ATOM 724 CD1 LEU 110 38.776 45.649 28.944 1.00 0.00 ATOM 725 CD2 LEU 110 38.008 44.384 30.892 1.00 0.00 ATOM 726 O LEU 110 42.582 45.771 32.039 1.00 0.00 ATOM 727 C LEU 110 41.695 45.737 32.890 1.00 0.00 ATOM 728 N GLU 111 41.955 45.690 34.198 1.00 0.00 ATOM 729 CA GLU 111 43.341 45.711 34.716 1.00 0.00 ATOM 730 CB GLU 111 43.324 45.418 36.203 1.00 0.00 ATOM 731 CG GLU 111 42.570 46.515 36.960 1.00 0.00 ATOM 732 CD GLU 111 43.108 47.934 36.783 1.00 0.00 ATOM 733 OE1 GLU 111 42.268 48.850 36.687 1.00 0.00 ATOM 734 OE2 GLU 111 44.341 48.073 36.733 1.00 0.00 ATOM 735 O GLU 111 43.762 43.562 33.728 1.00 0.00 ATOM 736 C GLU 111 44.201 44.666 34.011 1.00 0.00 ATOM 737 N VAL 112 45.418 45.056 33.645 1.00 0.00 ATOM 738 CA VAL 112 46.318 44.111 32.962 1.00 0.00 ATOM 739 CB VAL 112 47.704 44.732 32.773 1.00 0.00 ATOM 740 CG1 VAL 112 48.674 43.665 32.288 1.00 0.00 ATOM 741 CG2 VAL 112 47.602 45.851 31.750 1.00 0.00 ATOM 742 O VAL 112 46.715 43.179 35.147 1.00 0.00 ATOM 743 C VAL 112 46.650 42.978 33.938 1.00 0.00 ATOM 744 N GLY 113 46.701 41.798 33.347 1.00 0.00 ATOM 745 CA GLY 113 46.770 40.550 34.087 1.00 0.00 ATOM 746 O GLY 113 45.266 38.685 33.952 1.00 0.00 ATOM 747 C GLY 113 45.388 39.908 34.033 1.00 0.00 ATOM 748 N GLN 114 44.348 40.735 34.077 1.00 0.00 ATOM 749 CA GLN 114 42.942 40.227 34.028 1.00 0.00 ATOM 750 CB GLN 114 41.989 41.265 34.747 1.00 0.00 ATOM 751 CG GLN 114 42.326 41.589 36.199 1.00 0.00 ATOM 752 CD GLN 114 41.389 42.607 36.809 1.00 0.00 ATOM 753 OE1 GLN 114 40.902 43.497 36.122 1.00 0.00 ATOM 754 NE2 GLN 114 41.152 42.495 38.109 1.00 0.00 ATOM 755 O GLN 114 42.530 40.466 31.678 1.00 0.00 ATOM 756 C GLN 114 42.539 39.712 32.652 1.00 0.00 ATOM 757 N VAL 115 42.204 38.428 32.573 1.00 0.00 ATOM 758 CA VAL 115 41.801 37.830 31.306 1.00 0.00 ATOM 759 CB VAL 115 42.054 36.311 31.333 1.00 0.00 ATOM 760 CG1 VAL 115 43.561 36.025 31.449 1.00 0.00 ATOM 761 CG2 VAL 115 41.251 35.550 32.385 1.00 0.00 ATOM 762 O VAL 115 39.525 38.363 31.912 1.00 0.00 ATOM 763 C VAL 115 40.350 38.264 31.002 1.00 0.00 ATOM 764 N VAL 116 40.054 38.518 29.731 1.00 0.00 ATOM 765 CA VAL 116 38.713 38.932 29.336 1.00 0.00 ATOM 766 CB VAL 116 38.663 40.338 28.754 1.00 0.00 ATOM 767 CG1 VAL 116 38.859 41.314 29.912 1.00 0.00 ATOM 768 CG2 VAL 116 39.449 40.508 27.451 1.00 0.00 ATOM 769 O VAL 116 38.757 37.335 27.541 1.00 0.00 ATOM 770 C VAL 116 38.065 38.048 28.279 1.00 0.00 ATOM 771 N MET 117 36.757 38.148 28.171 1.00 0.00 ATOM 772 CA MET 117 36.056 37.644 27.001 1.00 0.00 ATOM 773 CB MET 117 34.697 37.101 27.418 1.00 0.00 ATOM 774 CG MET 117 33.932 36.453 26.253 1.00 0.00 ATOM 775 SD MET 117 32.289 35.847 26.771 1.00 0.00 ATOM 776 CE MET 117 32.782 34.436 27.738 1.00 0.00 ATOM 777 O MET 117 35.654 39.911 26.326 1.00 0.00 ATOM 778 C MET 117 36.014 38.782 25.988 1.00 0.00 ATOM 779 N LEU 118 36.381 38.485 24.744 1.00 0.00 ATOM 780 CA LEU 118 36.378 39.500 23.686 1.00 0.00 ATOM 781 CB LEU 118 37.716 39.459 22.956 1.00 0.00 ATOM 782 CG LEU 118 38.928 39.885 23.780 1.00 0.00 ATOM 783 CD1 LEU 118 40.144 39.663 22.905 1.00 0.00 ATOM 784 CD2 LEU 118 38.817 41.354 24.220 1.00 0.00 ATOM 785 O LEU 118 34.902 38.319 22.222 1.00 0.00 ATOM 786 C LEU 118 35.276 39.411 22.653 1.00 0.00 ATOM 787 N ASN 119 34.750 40.563 22.250 1.00 0.00 ATOM 788 CA ASN 119 33.683 40.600 21.256 1.00 0.00 ATOM 789 CB ASN 119 32.918 41.874 21.569 1.00 0.00 ATOM 790 CG ASN 119 31.911 42.188 20.491 1.00 0.00 ATOM 791 ND2 ASN 119 31.645 43.387 20.086 1.00 0.00 ATOM 792 OD1 ASN 119 31.320 41.274 20.045 1.00 0.00 ATOM 793 O ASN 119 34.399 41.842 19.336 1.00 0.00 ATOM 794 C ASN 119 34.195 40.733 19.818 1.00 0.00 ATOM 795 N TYR 120 33.802 39.810 18.974 1.00 0.00 ATOM 796 CA TYR 120 34.084 39.964 17.531 1.00 0.00 ATOM 797 CB TYR 120 33.387 38.779 16.973 1.00 0.00 ATOM 798 CG TYR 120 33.456 38.602 15.489 1.00 0.00 ATOM 799 CD1 TYR 120 34.543 37.927 15.016 1.00 0.00 ATOM 800 CD2 TYR 120 32.459 39.097 14.674 1.00 0.00 ATOM 801 CE1 TYR 120 34.631 37.749 13.655 1.00 0.00 ATOM 802 CE2 TYR 120 32.530 38.907 13.316 1.00 0.00 ATOM 803 CZ TYR 120 33.625 38.243 12.841 1.00 0.00 ATOM 804 OH TYR 120 33.682 38.019 11.540 1.00 0.00 ATOM 805 O TYR 120 34.429 41.628 15.846 1.00 0.00 ATOM 806 C TYR 120 33.692 41.228 16.746 1.00 0.00 ATOM 807 N ASN 121 32.494 41.748 16.997 1.00 0.00 ATOM 808 CA ASN 121 31.863 42.763 16.124 1.00 0.00 ATOM 809 CB ASN 121 30.367 42.480 16.039 1.00 0.00 ATOM 810 CG ASN 121 29.662 43.464 15.115 1.00 0.00 ATOM 811 ND2 ASN 121 28.369 43.574 15.285 1.00 0.00 ATOM 812 OD1 ASN 121 30.251 44.217 14.356 1.00 0.00 ATOM 813 O ASN 121 31.620 44.552 17.677 1.00 0.00 ATOM 814 C ASN 121 32.141 44.183 16.624 1.00 0.00 ATOM 815 N PRO 122 32.950 44.968 15.906 1.00 0.00 ATOM 816 CA PRO 122 33.206 46.378 16.282 1.00 0.00 ATOM 817 CB PRO 122 34.610 46.660 15.752 1.00 0.00 ATOM 818 CG PRO 122 34.666 45.818 14.470 1.00 0.00 ATOM 819 CD PRO 122 33.886 44.549 14.839 1.00 0.00 ATOM 820 O PRO 122 32.219 48.566 15.943 1.00 0.00 ATOM 821 C PRO 122 32.180 47.369 15.654 1.00 0.00 ATOM 822 N ASP 123 31.285 46.859 14.813 1.00 0.00 ATOM 823 CA ASP 123 30.282 47.704 14.175 1.00 0.00 ATOM 824 CB ASP 123 29.669 46.935 13.006 1.00 0.00 ATOM 825 CG ASP 123 30.656 46.665 11.870 1.00 0.00 ATOM 826 OD1 ASP 123 31.402 47.614 11.549 1.00 0.00 ATOM 827 OD2 ASP 123 30.616 45.549 11.320 1.00 0.00 ATOM 828 O ASP 123 28.891 47.490 16.148 1.00 0.00 ATOM 829 C ASP 123 29.195 48.145 15.147 1.00 0.00 ATOM 830 N ASN 124 28.541 49.233 14.779 1.00 0.00 ATOM 831 CA ASN 124 27.330 49.681 15.511 1.00 0.00 ATOM 832 CB ASN 124 26.794 50.994 14.968 1.00 0.00 ATOM 833 CG ASN 124 27.770 52.116 15.247 1.00 0.00 ATOM 834 ND2 ASN 124 27.684 53.082 14.414 1.00 0.00 ATOM 835 OD1 ASN 124 28.693 52.096 16.051 1.00 0.00 ATOM 836 O ASN 124 25.475 48.514 16.467 1.00 0.00 ATOM 837 C ASN 124 26.186 48.648 15.475 1.00 0.00 ATOM 838 N PRO 125 25.932 48.029 14.306 1.00 0.00 ATOM 839 CA PRO 125 24.888 47.004 14.182 1.00 0.00 ATOM 840 CB PRO 125 24.626 46.889 12.678 1.00 0.00 ATOM 841 CG PRO 125 25.912 47.304 11.997 1.00 0.00 ATOM 842 CD PRO 125 26.493 48.320 12.973 1.00 0.00 ATOM 843 O PRO 125 26.391 45.133 14.351 1.00 0.00 ATOM 844 C PRO 125 25.374 45.682 14.775 1.00 0.00 ATOM 845 N LYS 126 24.552 45.133 15.659 1.00 0.00 ATOM 846 CA LYS 126 24.852 43.814 16.266 1.00 0.00 ATOM 847 CB LYS 126 24.006 43.450 17.489 1.00 0.00 ATOM 848 CG LYS 126 24.133 44.437 18.656 1.00 0.00 ATOM 849 CD LYS 126 23.097 44.105 19.716 1.00 0.00 ATOM 850 CE LYS 126 23.122 45.089 20.885 1.00 0.00 ATOM 851 NZ LYS 126 22.093 44.772 21.890 1.00 0.00 ATOM 852 O LYS 126 25.149 41.529 15.601 1.00 0.00 ATOM 853 C LYS 126 24.713 42.641 15.302 1.00 0.00 ATOM 854 N GLU 127 24.104 42.890 14.147 1.00 0.00 ATOM 855 CA GLU 127 23.910 41.825 13.121 1.00 0.00 ATOM 856 CB GLU 127 23.037 42.372 12.005 1.00 0.00 ATOM 857 CG GLU 127 21.621 42.730 12.458 1.00 0.00 ATOM 858 CD GLU 127 20.711 43.180 11.302 1.00 0.00 ATOM 859 OE1 GLU 127 21.197 43.409 10.177 1.00 0.00 ATOM 860 OE2 GLU 127 19.563 43.518 11.645 1.00 0.00 ATOM 861 O GLU 127 25.287 40.329 11.782 1.00 0.00 ATOM 862 C GLU 127 25.277 41.263 12.584 1.00 0.00 ATOM 863 N ARG 128 26.389 41.839 13.034 1.00 0.00 ATOM 864 CA ARG 128 27.704 41.386 12.597 1.00 0.00 ATOM 865 CB ARG 128 28.605 42.631 12.311 1.00 0.00 ATOM 866 CG ARG 128 28.140 43.845 11.452 1.00 0.00 ATOM 867 CD ARG 128 28.451 43.756 9.963 1.00 0.00 ATOM 868 NE ARG 128 28.072 44.963 9.211 1.00 0.00 ATOM 869 CZ ARG 128 28.173 45.064 7.879 1.00 0.00 ATOM 870 NH1 ARG 128 27.792 46.144 7.216 1.00 0.00 ATOM 871 NH2 ARG 128 28.660 44.066 7.156 1.00 0.00 ATOM 872 O ARG 128 29.186 39.520 12.579 1.00 0.00 ATOM 873 C ARG 128 28.328 40.151 13.213 1.00 0.00 ATOM 874 N GLY 129 28.284 39.922 14.552 1.00 0.00 ATOM 875 CA GLY 129 28.939 38.773 15.174 1.00 0.00 ATOM 876 O GLY 129 29.859 39.584 17.226 1.00 0.00 ATOM 877 C GLY 129 29.754 38.643 16.441 1.00 0.00 ATOM 878 N PHE 130 30.674 37.230 16.598 1.00 0.00 ATOM 879 CA PHE 130 31.492 36.900 17.759 1.00 0.00 ATOM 880 CB PHE 130 30.519 36.562 18.952 1.00 0.00 ATOM 881 CG PHE 130 31.186 36.155 20.242 1.00 0.00 ATOM 882 CD1 PHE 130 31.484 37.097 21.218 1.00 0.00 ATOM 883 CD2 PHE 130 31.495 34.818 20.495 1.00 0.00 ATOM 884 CE1 PHE 130 32.078 36.711 22.430 1.00 0.00 ATOM 885 CE2 PHE 130 32.092 34.427 21.711 1.00 0.00 ATOM 886 CZ PHE 130 32.379 35.375 22.670 1.00 0.00 ATOM 887 O PHE 130 32.272 34.643 17.387 1.00 0.00 ATOM 888 C PHE 130 32.485 35.733 17.920 1.00 0.00 ATOM 889 N TRP 131 33.969 35.850 19.037 1.00 0.00 ATOM 890 CA TRP 131 34.923 34.826 19.492 1.00 0.00 ATOM 891 CB TRP 131 36.148 35.323 18.627 1.00 0.00 ATOM 892 CG TRP 131 37.436 34.565 18.132 1.00 0.00 ATOM 893 CD1 TRP 131 38.634 34.583 18.739 1.00 0.00 ATOM 894 CD2 TRP 131 37.661 33.827 16.949 1.00 0.00 ATOM 895 CE2 TRP 131 38.987 33.396 16.969 1.00 0.00 ATOM 896 CE3 TRP 131 36.877 33.472 15.863 1.00 0.00 ATOM 897 NE1 TRP 131 39.542 33.879 18.069 1.00 0.00 ATOM 898 CZ2 TRP 131 39.514 32.587 15.956 1.00 0.00 ATOM 899 CZ3 TRP 131 37.392 32.670 14.839 1.00 0.00 ATOM 900 CH2 TRP 131 38.701 32.223 14.891 1.00 0.00 ATOM 901 O TRP 131 35.235 36.314 21.366 1.00 0.00 ATOM 902 C TRP 131 35.391 35.179 20.905 1.00 0.00 ATOM 903 N TYR 132 36.214 34.122 21.831 1.00 0.00 ATOM 904 CA TYR 132 36.679 34.340 23.194 1.00 0.00 ATOM 905 CB TYR 132 37.820 34.935 22.427 1.00 0.00 ATOM 906 CG TYR 132 39.029 34.044 22.414 1.00 0.00 ATOM 907 CD1 TYR 132 38.981 32.708 22.046 1.00 0.00 ATOM 908 CD2 TYR 132 40.191 34.697 22.742 1.00 0.00 ATOM 909 CE1 TYR 132 40.158 32.005 22.021 1.00 0.00 ATOM 910 CE2 TYR 132 41.369 33.981 22.699 1.00 0.00 ATOM 911 CZ TYR 132 41.342 32.641 22.352 1.00 0.00 ATOM 912 OH TYR 132 42.480 31.923 22.330 1.00 0.00 ATOM 913 O TYR 132 36.871 35.687 25.155 1.00 0.00 ATOM 914 C TYR 132 37.071 34.589 24.630 1.00 0.00 ATOM 915 N ASP 133 38.050 33.570 25.344 1.00 0.00 ATOM 916 CA ASP 133 38.699 33.758 26.624 1.00 0.00 ATOM 917 CB ASP 133 38.964 32.481 27.417 1.00 0.00 ATOM 918 CG ASP 133 37.716 32.007 28.171 1.00 0.00 ATOM 919 OD1 ASP 133 36.693 32.727 28.231 1.00 0.00 ATOM 920 OD2 ASP 133 37.709 30.817 28.528 1.00 0.00 ATOM 921 O ASP 133 40.854 33.619 25.595 1.00 0.00 ATOM 922 C ASP 133 40.077 34.308 26.238 1.00 0.00 ATOM 923 N ALA 134 40.501 35.422 26.832 1.00 0.00 ATOM 924 CA ALA 134 41.740 36.100 26.392 1.00 0.00 ATOM 925 CB ALA 134 41.348 37.370 25.629 1.00 0.00 ATOM 926 O ALA 134 42.209 37.098 28.499 1.00 0.00 ATOM 927 C ALA 134 42.679 36.607 27.488 1.00 0.00 ATOM 928 N GLU 135 43.944 36.749 27.129 1.00 0.00 ATOM 929 CA GLU 135 44.981 37.382 27.956 1.00 0.00 ATOM 930 CB GLU 135 46.169 36.438 27.791 1.00 0.00 ATOM 931 CG GLU 135 47.297 36.668 28.785 1.00 0.00 ATOM 932 CD GLU 135 48.551 35.811 28.573 1.00 0.00 ATOM 933 OE1 GLU 135 48.549 34.960 27.675 1.00 0.00 ATOM 934 OE2 GLU 135 49.496 36.012 29.361 1.00 0.00 ATOM 935 O GLU 135 45.963 39.169 26.583 1.00 0.00 ATOM 936 C GLU 135 45.299 38.842 27.555 1.00 0.00 ATOM 937 N ILE 136 44.898 39.792 28.367 1.00 0.00 ATOM 938 CA ILE 136 45.185 41.204 28.078 1.00 0.00 ATOM 939 CB ILE 136 44.062 42.069 28.603 1.00 0.00 ATOM 940 CG1 ILE 136 42.763 41.565 27.989 1.00 0.00 ATOM 941 CG2 ILE 136 44.311 43.569 28.300 1.00 0.00 ATOM 942 CD1 ILE 136 41.703 42.299 28.782 1.00 0.00 ATOM 943 O ILE 136 46.713 41.592 29.902 1.00 0.00 ATOM 944 C ILE 136 46.530 41.636 28.676 1.00 0.00 ATOM 945 N SER 137 47.356 42.238 27.817 1.00 0.00 ATOM 946 CA SER 137 48.728 42.624 28.209 1.00 0.00 ATOM 947 CB SER 137 49.721 42.258 27.079 1.00 0.00 ATOM 948 OG SER 137 51.055 42.384 27.530 1.00 0.00 ATOM 949 O SER 137 49.385 44.458 29.557 1.00 0.00 ATOM 950 C SER 137 48.876 44.105 28.510 1.00 0.00 ATOM 951 N ARG 138 48.727 44.906 27.469 1.00 0.00 ATOM 952 CA ARG 138 48.840 46.369 27.610 1.00 0.00 ATOM 953 CB ARG 138 50.078 46.984 26.955 1.00 0.00 ATOM 954 CG ARG 138 50.143 48.510 27.055 1.00 0.00 ATOM 955 CD ARG 138 51.464 49.033 26.517 1.00 0.00 ATOM 956 NE ARG 138 51.572 50.490 26.714 1.00 0.00 ATOM 957 CZ ARG 138 52.505 51.261 26.156 1.00 0.00 ATOM 958 NH1 ARG 138 52.534 52.549 26.398 1.00 0.00 ATOM 959 NH2 ARG 138 53.405 50.794 25.304 1.00 0.00 ATOM 960 O ARG 138 47.267 46.817 25.839 1.00 0.00 ATOM 961 C ARG 138 47.577 46.954 27.024 1.00 0.00 ATOM 962 N LYS 139 46.944 47.680 27.925 1.00 0.00 ATOM 963 CA LYS 139 45.785 48.515 27.611 1.00 0.00 ATOM 964 CB LYS 139 45.320 49.179 28.901 1.00 0.00 ATOM 965 CG LYS 139 46.241 50.263 29.450 1.00 0.00 ATOM 966 CD LYS 139 45.588 50.954 30.633 1.00 0.00 ATOM 967 CE LYS 139 46.584 51.922 31.239 1.00 0.00 ATOM 968 NZ LYS 139 46.070 52.480 32.477 1.00 0.00 ATOM 969 O LYS 139 45.393 50.337 26.103 1.00 0.00 ATOM 970 C LYS 139 46.224 49.662 26.683 1.00 0.00 ATOM 971 N ARG 140 47.538 49.864 26.542 1.00 0.00 ATOM 972 CA ARG 140 48.108 50.982 25.782 1.00 0.00 ATOM 973 CB ARG 140 47.749 51.208 24.327 1.00 0.00 ATOM 974 CG ARG 140 47.697 49.962 23.492 1.00 0.00 ATOM 975 CD ARG 140 46.944 50.310 22.214 1.00 0.00 ATOM 976 NE ARG 140 47.117 49.171 21.324 1.00 0.00 ATOM 977 CZ ARG 140 48.213 48.941 20.594 1.00 0.00 ATOM 978 NH1 ARG 140 48.261 47.894 19.786 1.00 0.00 ATOM 979 NH2 ARG 140 49.232 49.790 20.592 1.00 0.00 ATOM 980 O ARG 140 49.144 52.783 26.644 1.00 0.00 ATOM 981 C ARG 140 48.019 52.321 26.483 1.00 0.00 ATOM 982 N GLU 141 46.776 52.856 27.029 1.00 0.00 ATOM 983 CA GLU 141 46.565 53.922 28.071 1.00 0.00 ATOM 984 CB GLU 141 47.935 54.431 28.495 1.00 0.00 ATOM 985 CG GLU 141 48.773 53.664 29.484 1.00 0.00 ATOM 986 CD GLU 141 50.147 54.320 29.596 1.00 0.00 ATOM 987 OE1 GLU 141 50.435 55.372 28.982 1.00 0.00 ATOM 988 OE2 GLU 141 50.930 53.696 30.333 1.00 0.00 ATOM 989 O GLU 141 44.456 55.104 27.790 1.00 0.00 ATOM 990 C GLU 141 45.676 55.192 27.894 1.00 0.00 ATOM 991 N THR 142 46.261 56.359 28.259 1.00 0.00 ATOM 992 CA THR 142 45.672 57.708 28.249 1.00 0.00 ATOM 993 CB THR 142 46.698 58.760 28.478 1.00 0.00 ATOM 994 CG2 THR 142 46.025 60.132 28.505 1.00 0.00 ATOM 995 OG1 THR 142 47.324 58.433 29.725 1.00 0.00 ATOM 996 O THR 142 43.844 58.341 26.818 1.00 0.00 ATOM 997 C THR 142 44.992 57.929 26.895 1.00 0.00 ATOM 998 N ARG 143 45.654 57.481 25.840 1.00 0.00 ATOM 999 CA ARG 143 45.108 57.661 24.473 1.00 0.00 ATOM 1000 CB ARG 143 46.323 56.910 23.525 1.00 0.00 ATOM 1001 CG ARG 143 46.533 57.304 22.052 1.00 0.00 ATOM 1002 CD ARG 143 47.746 56.616 21.477 1.00 0.00 ATOM 1003 NE ARG 143 47.563 55.175 21.348 1.00 0.00 ATOM 1004 CZ ARG 143 46.815 54.593 20.414 1.00 0.00 ATOM 1005 NH1 ARG 143 46.174 55.336 19.517 1.00 0.00 ATOM 1006 NH2 ARG 143 46.714 53.266 20.367 1.00 0.00 ATOM 1007 O ARG 143 43.081 57.087 23.339 1.00 0.00 ATOM 1008 C ARG 143 43.985 56.710 24.091 1.00 0.00 ATOM 1009 N THR 144 44.082 55.472 24.577 1.00 0.00 ATOM 1010 CA THR 144 43.139 54.404 24.196 1.00 0.00 ATOM 1011 CB THR 144 43.426 53.053 24.813 1.00 0.00 ATOM 1012 CG2 THR 144 44.725 52.650 24.208 1.00 0.00 ATOM 1013 OG1 THR 144 43.585 53.084 26.221 1.00 0.00 ATOM 1014 O THR 144 40.819 54.251 23.845 1.00 0.00 ATOM 1015 C THR 144 41.707 54.636 24.582 1.00 0.00 ATOM 1016 N ALA 145 41.519 55.136 25.782 1.00 0.00 ATOM 1017 CA ALA 145 40.165 55.334 26.289 1.00 0.00 ATOM 1018 CB ALA 145 40.406 55.698 27.738 1.00 0.00 ATOM 1019 O ALA 145 38.220 56.281 25.241 1.00 0.00 ATOM 1020 C ALA 145 39.419 56.388 25.467 1.00 0.00 ATOM 1021 N ARG 146 40.172 57.298 24.865 1.00 0.00 ATOM 1022 CA ARG 146 39.630 58.283 23.903 1.00 0.00 ATOM 1023 CB ARG 146 40.752 59.259 23.540 1.00 0.00 ATOM 1024 CG ARG 146 40.220 60.378 22.645 1.00 0.00 ATOM 1025 CD ARG 146 41.375 61.309 22.351 1.00 0.00 ATOM 1026 NE ARG 146 40.967 62.390 21.463 1.00 0.00 ATOM 1027 CZ ARG 146 41.778 63.334 21.012 1.00 0.00 ATOM 1028 NH1 ARG 146 41.306 64.220 20.150 1.00 0.00 ATOM 1029 NH2 ARG 146 43.047 63.444 21.374 1.00 0.00 ATOM 1030 O ARG 146 37.961 57.873 22.245 1.00 0.00 ATOM 1031 C ARG 146 39.105 57.637 22.614 1.00 0.00 ATOM 1032 N GLU 147 39.941 56.820 21.993 1.00 0.00 ATOM 1033 CA GLU 147 39.555 56.090 20.762 1.00 0.00 ATOM 1034 CB GLU 147 40.844 55.788 19.888 1.00 0.00 ATOM 1035 CG GLU 147 41.641 57.010 19.391 1.00 0.00 ATOM 1036 CD GLU 147 40.882 57.931 18.435 1.00 0.00 ATOM 1037 OE1 GLU 147 39.690 57.683 18.126 1.00 0.00 ATOM 1038 OE2 GLU 147 41.493 58.930 17.985 1.00 0.00 ATOM 1039 O GLU 147 37.885 54.443 20.240 1.00 0.00 ATOM 1040 C GLU 147 38.621 54.924 21.077 1.00 0.00 ATOM 1041 N LEU 148 38.718 54.435 22.306 1.00 0.00 ATOM 1042 CA LEU 148 38.128 53.165 22.786 1.00 0.00 ATOM 1043 CB LEU 148 36.602 53.162 22.679 1.00 0.00 ATOM 1044 CG LEU 148 35.846 54.292 23.356 1.00 0.00 ATOM 1045 CD1 LEU 148 34.349 54.148 23.081 1.00 0.00 ATOM 1046 CD2 LEU 148 36.064 54.138 24.837 1.00 0.00 ATOM 1047 O LEU 148 37.885 51.113 21.532 1.00 0.00 ATOM 1048 C LEU 148 38.638 51.903 22.071 1.00 0.00 ATOM 1049 N TYR 149 39.895 51.542 22.270 1.00 0.00 ATOM 1050 CA TYR 149 40.430 50.265 21.752 1.00 0.00 ATOM 1051 CB TYR 149 41.162 50.476 20.432 1.00 0.00 ATOM 1052 CG TYR 149 40.276 50.863 19.265 1.00 0.00 ATOM 1053 CD1 TYR 149 39.486 49.913 18.621 1.00 0.00 ATOM 1054 CD2 TYR 149 40.274 52.167 18.783 1.00 0.00 ATOM 1055 CE1 TYR 149 38.678 50.262 17.545 1.00 0.00 ATOM 1056 CE2 TYR 149 39.480 52.534 17.694 1.00 0.00 ATOM 1057 CZ TYR 149 38.688 51.584 17.086 1.00 0.00 ATOM 1058 OH TYR 149 37.910 51.974 16.009 1.00 0.00 ATOM 1059 O TYR 149 42.276 50.592 23.249 1.00 0.00 ATOM 1060 C TYR 149 41.591 49.786 22.617 1.00 0.00 ATOM 1061 N ALA 150 41.812 48.476 22.643 1.00 0.00 ATOM 1062 CA ALA 150 42.902 47.903 23.437 1.00 0.00 ATOM 1063 CB ALA 150 42.394 47.479 24.805 1.00 0.00 ATOM 1064 O ALA 150 43.068 45.902 22.127 1.00 0.00 ATOM 1065 C ALA 150 43.659 46.742 22.809 1.00 0.00 ATOM 1066 N ASN 151 44.968 46.693 23.037 1.00 0.00 ATOM 1067 CA ASN 151 45.791 45.623 22.487 1.00 0.00 ATOM 1068 CB ASN 151 47.264 46.028 22.471 1.00 0.00 ATOM 1069 CG ASN 151 48.060 45.010 21.662 1.00 0.00 ATOM 1070 ND2 ASN 151 49.194 45.434 21.225 1.00 0.00 ATOM 1071 OD1 ASN 151 47.729 43.865 21.399 1.00 0.00 ATOM 1072 O ASN 151 46.192 44.271 24.418 1.00 0.00 ATOM 1073 C ASN 151 45.642 44.355 23.325 1.00 0.00 ATOM 1074 N VAL 152 44.964 43.367 22.737 1.00 0.00 ATOM 1075 CA VAL 152 44.733 42.098 23.442 1.00 0.00 ATOM 1076 CB VAL 152 43.316 41.606 23.164 1.00 0.00 ATOM 1077 CG1 VAL 152 43.073 40.312 23.923 1.00 0.00 ATOM 1078 CG2 VAL 152 42.327 42.681 23.599 1.00 0.00 ATOM 1079 O VAL 152 45.694 40.810 21.637 1.00 0.00 ATOM 1080 C VAL 152 45.634 41.029 22.848 1.00 0.00 ATOM 1081 N VAL 153 46.178 40.263 23.781 1.00 0.00 ATOM 1082 CA VAL 153 46.854 39.001 23.471 1.00 0.00 ATOM 1083 CB VAL 153 48.207 38.952 24.201 1.00 0.00 ATOM 1084 CG1 VAL 153 48.962 37.654 23.950 1.00 0.00 ATOM 1085 CG2 VAL 153 49.082 40.143 23.800 1.00 0.00 ATOM 1086 O VAL 153 44.834 38.154 24.550 1.00 0.00 ATOM 1087 C VAL 153 45.851 37.909 23.907 1.00 0.00 ATOM 1088 N LEU 154 45.881 36.788 23.242 1.00 0.00 ATOM 1089 CA LEU 154 44.874 35.758 23.533 1.00 0.00 ATOM 1090 CB LEU 154 44.547 34.974 22.304 1.00 0.00 ATOM 1091 CG LEU 154 43.864 35.754 21.205 1.00 0.00 ATOM 1092 CD1 LEU 154 43.287 34.658 20.338 1.00 0.00 ATOM 1093 CD2 LEU 154 42.708 36.680 21.546 1.00 0.00 ATOM 1094 O LEU 154 46.357 34.557 24.995 1.00 0.00 ATOM 1095 C LEU 154 45.189 34.718 24.574 1.00 0.00 ATOM 1096 N GLY 155 44.153 33.978 24.924 1.00 0.00 ATOM 1097 CA GLY 155 44.288 32.707 25.632 1.00 0.00 ATOM 1098 O GLY 155 44.960 32.142 23.425 1.00 0.00 ATOM 1099 C GLY 155 44.543 31.714 24.493 1.00 0.00 ATOM 1100 N ASP 156 44.091 30.475 24.625 1.00 0.00 ATOM 1101 CA ASP 156 44.371 29.444 23.607 1.00 0.00 ATOM 1102 CB ASP 156 43.102 28.808 23.047 1.00 0.00 ATOM 1103 CG ASP 156 42.631 27.847 24.153 1.00 0.00 ATOM 1104 OD1 ASP 156 43.479 27.402 24.967 1.00 0.00 ATOM 1105 OD2 ASP 156 41.414 27.659 24.243 1.00 0.00 ATOM 1106 O ASP 156 45.996 28.490 22.096 1.00 0.00 ATOM 1107 C ASP 156 45.797 29.210 23.082 1.00 0.00 ATOM 1108 N ASP 157 46.654 29.856 23.742 1.00 0.00 ATOM 1109 CA ASP 157 48.044 29.765 23.340 1.00 0.00 ATOM 1110 CB ASP 157 48.674 28.441 23.882 1.00 0.00 ATOM 1111 CG ASP 157 48.828 28.421 25.419 1.00 0.00 ATOM 1112 OD1 ASP 157 48.795 29.496 26.038 1.00 0.00 ATOM 1113 OD2 ASP 157 48.978 27.320 25.967 1.00 0.00 ATOM 1114 O ASP 157 48.589 29.052 21.112 1.00 0.00 ATOM 1115 C ASP 157 48.471 30.001 21.906 1.00 0.00 ATOM 1116 N SER 158 48.573 31.285 21.574 1.00 0.00 ATOM 1117 CA SER 158 48.966 31.696 20.221 1.00 0.00 ATOM 1118 CB SER 158 47.962 31.181 19.192 1.00 0.00 ATOM 1119 OG SER 158 48.305 31.477 17.840 1.00 0.00 ATOM 1120 O SER 158 48.045 33.887 20.549 1.00 0.00 ATOM 1121 C SER 158 48.954 33.213 20.066 1.00 0.00 ATOM 1122 N LEU 159 49.966 33.748 19.390 1.00 0.00 ATOM 1123 CA LEU 159 50.053 35.177 19.181 1.00 0.00 ATOM 1124 CB LEU 159 51.516 35.601 19.101 1.00 0.00 ATOM 1125 CG LEU 159 52.280 35.438 20.410 1.00 0.00 ATOM 1126 CD1 LEU 159 53.735 35.854 20.231 1.00 0.00 ATOM 1127 CD2 LEU 159 51.627 36.317 21.466 1.00 0.00 ATOM 1128 O LEU 159 49.242 36.865 17.657 1.00 0.00 ATOM 1129 C LEU 159 49.473 35.669 17.835 1.00 0.00 ATOM 1130 N ASN 160 49.244 34.745 16.907 1.00 0.00 ATOM 1131 CA ASN 160 48.696 35.103 15.604 1.00 0.00 ATOM 1132 CB ASN 160 48.583 33.896 14.672 1.00 0.00 ATOM 1133 CG ASN 160 49.981 33.448 14.311 1.00 0.00 ATOM 1134 ND2 ASN 160 50.109 32.202 13.957 1.00 0.00 ATOM 1135 OD1 ASN 160 50.888 34.239 14.152 1.00 0.00 ATOM 1136 O ASN 160 46.944 36.511 14.809 1.00 0.00 ATOM 1137 C ASN 160 47.293 35.663 15.634 1.00 0.00 ATOM 1138 N ASP 161 46.523 35.184 16.596 1.00 0.00 ATOM 1139 CA ASP 161 45.160 35.666 16.749 1.00 0.00 ATOM 1140 CB ASP 161 44.189 34.481 16.927 1.00 0.00 ATOM 1141 CG ASP 161 43.994 33.657 15.651 1.00 0.00 ATOM 1142 OD1 ASP 161 44.487 34.030 14.560 1.00 0.00 ATOM 1143 OD2 ASP 161 43.299 32.630 15.778 1.00 0.00 ATOM 1144 O ASP 161 44.081 36.904 18.486 1.00 0.00 ATOM 1145 C ASP 161 45.078 36.731 17.843 1.00 0.00 ATOM 1146 N CYS 162 46.001 37.667 17.889 1.00 0.00 ATOM 1147 CA CYS 162 45.920 38.775 18.858 1.00 0.00 ATOM 1148 CB CYS 162 47.396 38.788 19.595 1.00 0.00 ATOM 1149 SG CYS 162 48.517 39.530 18.358 1.00 0.00 ATOM 1150 O CYS 162 45.412 40.933 17.884 1.00 0.00 ATOM 1151 C CYS 162 44.976 39.924 18.434 1.00 0.00 ATOM 1152 N ARG 163 43.668 39.813 18.670 1.00 0.00 ATOM 1153 CA ARG 163 42.784 40.870 18.140 1.00 0.00 ATOM 1154 CB ARG 163 41.410 40.305 17.791 1.00 0.00 ATOM 1155 CG ARG 163 41.529 39.255 16.691 1.00 0.00 ATOM 1156 CD ARG 163 40.108 38.788 16.395 1.00 0.00 ATOM 1157 NE ARG 163 40.085 37.871 15.248 1.00 0.00 ATOM 1158 CZ ARG 163 39.012 37.274 14.753 1.00 0.00 ATOM 1159 NH1 ARG 163 39.115 36.336 13.823 1.00 0.00 ATOM 1160 NH2 ARG 163 37.803 37.650 15.128 1.00 0.00 ATOM 1161 O ARG 163 42.672 41.917 20.281 1.00 0.00 ATOM 1162 C ARG 163 42.659 42.068 19.060 1.00 0.00 ATOM 1163 N ILE 164 42.620 43.258 18.463 1.00 0.00 ATOM 1164 CA ILE 164 42.447 44.528 19.186 1.00 0.00 ATOM 1165 CB ILE 164 43.535 45.551 18.839 1.00 0.00 ATOM 1166 CG1 ILE 164 44.898 45.006 19.294 1.00 0.00 ATOM 1167 CG2 ILE 164 43.196 46.947 19.396 1.00 0.00 ATOM 1168 CD1 ILE 164 46.059 45.821 18.731 1.00 0.00 ATOM 1169 O ILE 164 40.944 45.608 17.666 1.00 0.00 ATOM 1170 C ILE 164 41.118 45.161 18.799 1.00 0.00 ATOM 1171 N ILE 165 40.263 45.213 19.777 1.00 0.00 ATOM 1172 CA ILE 165 38.935 45.740 19.491 1.00 0.00 ATOM 1173 CB ILE 165 37.846 44.664 19.350 1.00 0.00 ATOM 1174 CG1 ILE 165 37.805 43.955 20.693 1.00 0.00 ATOM 1175 CG2 ILE 165 38.103 43.759 18.153 1.00 0.00 ATOM 1176 CD1 ILE 165 36.710 42.947 20.916 1.00 0.00 ATOM 1177 O ILE 165 39.152 47.550 21.044 1.00 0.00 ATOM 1178 C ILE 165 38.414 46.929 20.276 1.00 0.00 ATOM 1179 N PHE 166 37.034 47.137 20.133 1.00 0.00 ATOM 1180 CA PHE 166 36.409 48.241 20.845 1.00 0.00 ATOM 1181 CB PHE 166 35.253 48.419 19.884 1.00 0.00 ATOM 1182 CG PHE 166 34.535 49.742 20.118 1.00 0.00 ATOM 1183 CD1 PHE 166 33.169 49.740 20.308 1.00 0.00 ATOM 1184 CD2 PHE 166 35.216 50.948 20.124 1.00 0.00 ATOM 1185 CE1 PHE 166 32.494 50.931 20.528 1.00 0.00 ATOM 1186 CE2 PHE 166 34.553 52.139 20.333 1.00 0.00 ATOM 1187 CZ PHE 166 33.185 52.143 20.552 1.00 0.00 ATOM 1188 O PHE 166 35.705 46.660 22.552 1.00 0.00 ATOM 1189 C PHE 166 36.022 47.809 22.265 1.00 0.00 ATOM 1190 N VAL 167 36.431 48.692 23.173 1.00 0.00 ATOM 1191 CA VAL 167 36.058 48.592 24.601 1.00 0.00 ATOM 1192 CB VAL 167 37.089 49.345 25.462 1.00 0.00 ATOM 1193 CG1 VAL 167 38.504 48.777 25.321 1.00 0.00 ATOM 1194 CG2 VAL 167 37.086 50.845 25.176 1.00 0.00 ATOM 1195 O VAL 167 34.231 49.848 23.822 1.00 0.00 ATOM 1196 C VAL 167 34.629 49.159 24.747 1.00 0.00 ATOM 1197 N ASP 168 33.901 48.854 25.837 1.00 0.00 ATOM 1198 CA ASP 168 32.472 49.190 26.052 1.00 0.00 ATOM 1199 CB ASP 168 31.992 50.537 25.491 1.00 0.00 ATOM 1200 CG ASP 168 32.705 51.731 26.152 1.00 0.00 ATOM 1201 OD1 ASP 168 33.259 51.542 27.266 1.00 0.00 ATOM 1202 OD2 ASP 168 32.696 52.794 25.511 1.00 0.00 ATOM 1203 O ASP 168 30.698 47.558 26.218 1.00 0.00 ATOM 1204 C ASP 168 31.585 48.055 25.531 1.00 0.00 ATOM 1205 N GLU 169 32.072 47.526 24.413 1.00 0.00 ATOM 1206 CA GLU 169 31.554 46.315 23.785 1.00 0.00 ATOM 1207 CB GLU 169 31.434 46.587 22.285 1.00 0.00 ATOM 1208 CG GLU 169 30.280 47.546 21.980 1.00 0.00 ATOM 1209 CD GLU 169 29.800 47.492 20.525 1.00 0.00 ATOM 1210 OE1 GLU 169 29.998 46.429 19.897 1.00 0.00 ATOM 1211 OE2 GLU 169 29.071 48.425 20.120 1.00 0.00 ATOM 1212 O GLU 169 31.965 43.974 23.740 1.00 0.00 ATOM 1213 C GLU 169 32.368 45.051 24.122 1.00 0.00 ATOM 1214 N VAL 170 33.376 45.137 24.989 1.00 0.00 ATOM 1215 CA VAL 170 34.112 43.948 25.494 1.00 0.00 ATOM 1216 CB VAL 170 35.645 44.098 25.529 1.00 0.00 ATOM 1217 CG1 VAL 170 36.212 44.219 24.118 1.00 0.00 ATOM 1218 CG2 VAL 170 36.120 45.279 26.384 1.00 0.00 ATOM 1219 O VAL 170 32.701 44.120 27.456 1.00 0.00 ATOM 1220 C VAL 170 33.595 43.508 26.877 1.00 0.00 ATOM 1221 N PHE 171 34.141 42.412 27.372 1.00 0.00 ATOM 1222 CA PHE 171 33.745 41.831 28.660 1.00 0.00 ATOM 1223 CB PHE 171 33.161 40.442 28.407 1.00 0.00 ATOM 1224 CG PHE 171 32.678 39.725 29.671 1.00 0.00 ATOM 1225 CD1 PHE 171 31.406 39.986 30.126 1.00 0.00 ATOM 1226 CD2 PHE 171 33.418 38.726 30.301 1.00 0.00 ATOM 1227 CE1 PHE 171 30.880 39.264 31.177 1.00 0.00 ATOM 1228 CE2 PHE 171 32.892 38.017 31.370 1.00 0.00 ATOM 1229 CZ PHE 171 31.608 38.275 31.815 1.00 0.00 ATOM 1230 O PHE 171 36.089 41.650 28.947 1.00 0.00 ATOM 1231 C PHE 171 35.006 41.716 29.503 1.00 0.00 ATOM 1232 N LYS 172 34.834 41.755 30.809 1.00 0.00 ATOM 1233 CA LYS 172 35.915 41.558 31.790 1.00 0.00 ATOM 1234 CB LYS 172 35.819 42.726 32.759 1.00 0.00 ATOM 1235 CG LYS 172 36.880 42.662 33.855 1.00 0.00 ATOM 1236 CD LYS 172 36.689 43.860 34.767 1.00 0.00 ATOM 1237 CE LYS 172 37.601 43.690 35.976 1.00 0.00 ATOM 1238 NZ LYS 172 37.438 44.814 36.903 1.00 0.00 ATOM 1239 O LYS 172 34.541 40.089 33.070 1.00 0.00 ATOM 1240 C LYS 172 35.621 40.252 32.530 1.00 0.00 ATOM 1241 N ILE 173 36.525 39.290 32.449 1.00 0.00 ATOM 1242 CA ILE 173 36.297 38.031 33.180 1.00 0.00 ATOM 1243 CB ILE 173 37.083 36.854 32.500 1.00 0.00 ATOM 1244 CG1 ILE 173 36.588 36.609 31.068 1.00 0.00 ATOM 1245 CG2 ILE 173 36.984 35.593 33.316 1.00 0.00 ATOM 1246 CD1 ILE 173 37.407 35.592 30.291 1.00 0.00 ATOM 1247 O ILE 173 37.855 38.570 34.924 1.00 0.00 ATOM 1248 C ILE 173 36.705 38.233 34.635 1.00 0.00 ATOM 1249 N GLU 174 35.763 38.026 35.550 1.00 0.00 ATOM 1250 CA GLU 174 36.043 38.187 36.975 1.00 0.00 ATOM 1251 CB GLU 174 34.958 38.940 37.775 1.00 0.00 ATOM 1252 CG GLU 174 33.501 38.529 37.539 1.00 0.00 ATOM 1253 CD GLU 174 32.758 39.315 36.462 1.00 0.00 ATOM 1254 OE1 GLU 174 31.609 39.710 36.743 1.00 0.00 ATOM 1255 OE2 GLU 174 33.295 39.466 35.346 1.00 0.00 ATOM 1256 O GLU 174 36.647 36.818 38.850 1.00 0.00 ATOM 1257 C GLU 174 36.588 36.920 37.623 1.00 0.00 ATOM 1258 N ARG 175 36.986 35.956 36.800 1.00 0.00 ATOM 1259 CA ARG 175 37.526 34.701 37.311 1.00 0.00 ATOM 1260 CB ARG 175 36.516 33.548 37.165 1.00 0.00 ATOM 1261 CG ARG 175 36.004 33.279 35.774 1.00 0.00 ATOM 1262 CD ARG 175 34.493 33.445 35.731 1.00 0.00 ATOM 1263 NE ARG 175 33.818 32.864 36.891 1.00 0.00 ATOM 1264 CZ ARG 175 32.734 33.383 37.464 1.00 0.00 ATOM 1265 NH1 ARG 175 32.200 34.498 36.989 1.00 0.00 ATOM 1266 NH2 ARG 175 32.157 32.766 38.487 1.00 0.00 ATOM 1267 O ARG 175 39.207 35.011 35.600 1.00 0.00 ATOM 1268 C ARG 175 38.859 34.379 36.614 1.00 0.00 ATOM 1269 N PRO 176 39.640 33.416 37.159 1.00 0.00 ATOM 1270 CA PRO 176 40.934 33.054 36.574 1.00 0.00 ATOM 1271 CB PRO 176 41.269 31.721 37.252 1.00 0.00 ATOM 1272 CG PRO 176 40.592 31.840 38.586 1.00 0.00 ATOM 1273 CD PRO 176 39.249 32.431 38.194 1.00 0.00 ATOM 1274 O PRO 176 40.119 32.159 34.510 1.00 0.00 ATOM 1275 C PRO 176 40.915 32.923 35.064 1.00 0.00 TER END