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 2 Sun Jul 13 16:58:04 2008 MODEL 2 PARENT N/A ATOM 1 N GLU 22 21.417 28.876 30.864 1.00 0.00 ATOM 2 CA GLU 22 21.427 28.722 32.316 1.00 0.00 ATOM 3 CB GLU 22 22.870 28.668 32.836 1.00 0.00 ATOM 4 CG GLU 22 23.632 27.390 32.465 1.00 0.00 ATOM 5 CD GLU 22 25.075 27.366 32.991 1.00 0.00 ATOM 6 OE1 GLU 22 25.601 28.434 33.411 1.00 0.00 ATOM 7 OE2 GLU 22 25.684 26.279 32.876 1.00 0.00 ATOM 8 O GLU 22 20.950 31.056 32.386 1.00 0.00 ATOM 9 C GLU 22 20.782 29.961 32.922 1.00 0.00 ATOM 10 N THR 23 20.108 29.750 34.047 1.00 0.00 ATOM 11 CA THR 23 19.581 30.850 34.876 1.00 0.00 ATOM 12 CB THR 23 18.764 30.318 36.067 1.00 0.00 ATOM 13 CG2 THR 23 18.274 31.468 36.935 1.00 0.00 ATOM 14 OG1 THR 23 17.636 29.576 35.584 1.00 0.00 ATOM 15 O THR 23 20.679 32.945 35.239 1.00 0.00 ATOM 16 C THR 23 20.721 31.726 35.392 1.00 0.00 ATOM 17 N GLU 24 21.831 31.052 35.700 1.00 0.00 ATOM 18 CA GLU 24 23.073 31.717 36.157 1.00 0.00 ATOM 19 CB GLU 24 24.131 30.676 36.530 1.00 0.00 ATOM 20 CG GLU 24 23.829 29.900 37.803 1.00 0.00 ATOM 21 CD GLU 24 24.861 28.836 38.054 1.00 0.00 ATOM 22 OE1 GLU 24 25.729 28.673 37.230 1.00 0.00 ATOM 23 OE2 GLU 24 24.851 28.265 39.119 1.00 0.00 ATOM 24 O GLU 24 24.159 33.732 35.447 1.00 0.00 ATOM 25 C GLU 24 23.639 32.669 35.100 1.00 0.00 ATOM 26 N LEU 25 23.365 32.364 33.833 1.00 0.00 ATOM 27 CA LEU 25 23.784 33.190 32.691 1.00 0.00 ATOM 28 CB LEU 25 23.897 32.345 31.422 1.00 0.00 ATOM 29 CG LEU 25 25.098 31.397 31.483 1.00 0.00 ATOM 30 CD1 LEU 25 24.981 30.366 30.367 1.00 0.00 ATOM 31 CD2 LEU 25 26.408 32.155 31.257 1.00 0.00 ATOM 32 O LEU 25 23.221 35.220 31.544 1.00 0.00 ATOM 33 C LEU 25 22.887 34.402 32.406 1.00 0.00 ATOM 34 N GLY 26 21.658 34.303 32.899 1.00 0.00 ATOM 35 CA GLY 26 20.629 35.310 32.615 1.00 0.00 ATOM 36 O GLY 26 20.061 36.355 30.522 1.00 0.00 ATOM 37 C GLY 26 20.280 35.306 31.131 1.00 0.00 ATOM 38 N LEU 27 20.363 34.112 30.544 1.00 0.00 ATOM 39 CA LEU 27 20.099 33.933 29.119 1.00 0.00 ATOM 40 CB LEU 27 21.377 34.095 28.283 1.00 0.00 ATOM 41 CG LEU 27 21.665 35.610 28.181 1.00 0.00 ATOM 42 CD1 LEU 27 22.911 35.962 27.414 1.00 0.00 ATOM 43 CD2 LEU 27 20.580 36.358 27.429 1.00 0.00 ATOM 44 O LEU 27 19.526 31.715 28.289 1.00 0.00 ATOM 45 C LEU 27 19.165 32.778 28.811 1.00 0.00 ATOM 46 N TYR 28 17.957 32.992 29.321 1.00 0.00 ATOM 47 CA TYR 28 16.882 31.990 29.253 1.00 0.00 ATOM 48 CB TYR 28 16.913 31.087 30.487 1.00 0.00 ATOM 49 CG TYR 28 16.585 31.801 31.779 1.00 0.00 ATOM 50 CD1 TYR 28 15.343 31.656 32.379 1.00 0.00 ATOM 51 CD2 TYR 28 17.520 32.619 32.397 1.00 0.00 ATOM 52 CE1 TYR 28 15.038 32.307 33.559 1.00 0.00 ATOM 53 CE2 TYR 28 17.227 33.274 33.577 1.00 0.00 ATOM 54 CZ TYR 28 15.984 33.116 34.155 1.00 0.00 ATOM 55 OH TYR 28 15.687 33.766 35.331 1.00 0.00 ATOM 56 O TYR 28 14.492 32.041 29.549 1.00 0.00 ATOM 57 C TYR 28 15.491 32.625 29.126 1.00 0.00 ATOM 58 N LYS 29 15.414 33.781 28.496 1.00 0.00 ATOM 59 CA LYS 29 14.077 34.285 28.119 1.00 0.00 ATOM 60 CB LYS 29 13.637 35.401 29.068 1.00 0.00 ATOM 61 CG LYS 29 13.438 34.957 30.511 1.00 0.00 ATOM 62 CD LYS 29 13.004 36.117 31.393 1.00 0.00 ATOM 63 CE LYS 29 12.801 35.674 32.834 1.00 0.00 ATOM 64 NZ LYS 29 12.309 36.784 33.694 1.00 0.00 ATOM 65 O LYS 29 14.979 34.894 25.985 1.00 0.00 ATOM 66 C LYS 29 13.988 34.801 26.698 1.00 0.00 ATOM 67 N VAL 30 12.739 34.932 26.297 1.00 0.00 ATOM 68 CA VAL 30 12.396 35.372 24.938 1.00 0.00 ATOM 69 CB VAL 30 10.881 35.594 24.828 1.00 0.00 ATOM 70 CG1 VAL 30 10.499 36.158 23.462 1.00 0.00 ATOM 71 CG2 VAL 30 10.087 34.313 25.065 1.00 0.00 ATOM 72 O VAL 30 13.006 37.619 25.439 1.00 0.00 ATOM 73 C VAL 30 13.123 36.694 24.645 1.00 0.00 ATOM 74 N ASN 31 13.621 36.762 23.418 1.00 0.00 ATOM 75 CA ASN 31 14.207 37.937 22.758 1.00 0.00 ATOM 76 CB ASN 31 13.193 39.058 22.619 1.00 0.00 ATOM 77 CG ASN 31 12.089 38.759 21.643 1.00 0.00 ATOM 78 ND2 ASN 31 10.987 39.443 21.811 1.00 0.00 ATOM 79 OD1 ASN 31 12.259 37.970 20.706 1.00 0.00 ATOM 80 O ASN 31 15.960 39.585 23.165 1.00 0.00 ATOM 81 C ASN 31 15.474 38.496 23.470 1.00 0.00 ATOM 82 N GLU 32 16.173 37.554 24.118 1.00 0.00 ATOM 83 CA GLU 32 17.513 37.737 24.724 1.00 0.00 ATOM 84 CB GLU 32 17.635 36.922 26.012 1.00 0.00 ATOM 85 CG GLU 32 16.475 37.099 26.981 1.00 0.00 ATOM 86 CD GLU 32 16.599 38.383 27.754 1.00 0.00 ATOM 87 OE1 GLU 32 17.589 39.057 27.592 1.00 0.00 ATOM 88 OE2 GLU 32 15.660 38.746 28.420 1.00 0.00 ATOM 89 O GLU 32 18.636 36.243 23.210 1.00 0.00 ATOM 90 C GLU 32 18.635 37.345 23.751 1.00 0.00 ATOM 91 N TYR 33 19.511 38.276 23.425 1.00 0.00 ATOM 92 CA TYR 33 20.583 37.996 22.453 1.00 0.00 ATOM 93 CB TYR 33 21.152 39.301 21.892 1.00 0.00 ATOM 94 CG TYR 33 20.215 40.022 20.949 1.00 0.00 ATOM 95 CD1 TYR 33 19.430 41.077 21.392 1.00 0.00 ATOM 96 CD2 TYR 33 20.121 39.648 19.617 1.00 0.00 ATOM 97 CE1 TYR 33 18.572 41.739 20.535 1.00 0.00 ATOM 98 CE2 TYR 33 19.267 40.303 18.750 1.00 0.00 ATOM 99 CZ TYR 33 18.494 41.349 19.213 1.00 0.00 ATOM 100 OH TYR 33 17.643 42.005 18.354 1.00 0.00 ATOM 101 O TYR 33 22.270 37.433 24.128 1.00 0.00 ATOM 102 C TYR 33 21.736 37.157 23.056 1.00 0.00 ATOM 103 N VAL 34 22.015 36.057 22.368 1.00 0.00 ATOM 104 CA VAL 34 23.025 35.088 22.812 1.00 0.00 ATOM 105 CB VAL 34 22.327 33.925 23.509 1.00 0.00 ATOM 106 CG1 VAL 34 21.562 34.343 24.753 1.00 0.00 ATOM 107 CG2 VAL 34 21.378 33.109 22.617 1.00 0.00 ATOM 108 O VAL 34 23.512 34.929 20.482 1.00 0.00 ATOM 109 C VAL 34 23.839 34.590 21.606 1.00 0.00 ATOM 110 N ASP 35 24.759 33.671 21.862 1.00 0.00 ATOM 111 CA ASP 35 25.484 32.982 20.784 1.00 0.00 ATOM 112 CB ASP 35 26.895 33.555 20.634 1.00 0.00 ATOM 113 CG ASP 35 26.943 34.974 20.084 1.00 0.00 ATOM 114 OD1 ASP 35 26.661 35.887 20.824 1.00 0.00 ATOM 115 OD2 ASP 35 27.410 35.148 18.984 1.00 0.00 ATOM 116 O ASP 35 25.517 31.116 22.304 1.00 0.00 ATOM 117 C ASP 35 25.493 31.497 21.134 1.00 0.00 ATOM 118 N ALA 36 25.445 30.719 20.076 1.00 0.00 ATOM 119 CA ALA 36 25.376 29.249 20.211 1.00 0.00 ATOM 120 CB ALA 36 23.902 28.828 20.192 1.00 0.00 ATOM 121 O ALA 36 26.513 29.092 18.081 1.00 0.00 ATOM 122 C ALA 36 26.171 28.533 19.120 1.00 0.00 ATOM 123 N ARG 37 26.583 27.321 19.490 1.00 0.00 ATOM 124 CA ARG 37 27.249 26.422 18.538 1.00 0.00 ATOM 125 CB ARG 37 28.131 25.398 19.237 1.00 0.00 ATOM 126 CG ARG 37 29.116 24.677 18.330 1.00 0.00 ATOM 127 CD ARG 37 30.077 23.800 19.045 1.00 0.00 ATOM 128 NE ARG 37 29.485 22.609 19.632 1.00 0.00 ATOM 129 CZ ARG 37 30.125 21.767 20.466 1.00 0.00 ATOM 130 NH1 ARG 37 31.387 21.957 20.783 1.00 0.00 ATOM 131 NH2 ARG 37 29.458 20.728 20.938 1.00 0.00 ATOM 132 O ARG 37 25.309 25.054 18.108 1.00 0.00 ATOM 133 C ARG 37 26.201 25.771 17.635 1.00 0.00 ATOM 134 N ASP 38 26.364 26.024 16.346 1.00 0.00 ATOM 135 CA ASP 38 25.463 25.446 15.344 1.00 0.00 ATOM 136 CB ASP 38 25.621 26.159 14.009 1.00 0.00 ATOM 137 CG ASP 38 24.663 25.611 12.959 1.00 0.00 ATOM 138 OD1 ASP 38 23.880 24.674 13.217 1.00 0.00 ATOM 139 OD2 ASP 38 24.868 25.998 11.813 1.00 0.00 ATOM 140 O ASP 38 26.910 23.613 14.811 1.00 0.00 ATOM 141 C ASP 38 25.792 23.963 15.160 1.00 0.00 ATOM 142 N THR 39 24.846 23.113 15.490 1.00 0.00 ATOM 143 CA THR 39 25.044 21.666 15.327 1.00 0.00 ATOM 144 CB THR 39 23.820 20.869 15.814 1.00 0.00 ATOM 145 CG2 THR 39 23.565 21.132 17.289 1.00 0.00 ATOM 146 OG1 THR 39 22.664 21.255 15.058 1.00 0.00 ATOM 147 O THR 39 25.800 20.146 13.736 1.00 0.00 ATOM 148 C THR 39 25.330 21.248 13.882 1.00 0.00 ATOM 149 N ASN 40 24.939 22.039 12.892 1.00 0.00 ATOM 150 CA ASN 40 25.234 21.726 11.480 1.00 0.00 ATOM 151 CB ASN 40 24.397 22.570 10.537 1.00 0.00 ATOM 152 CG ASN 40 22.947 22.173 10.495 1.00 0.00 ATOM 153 ND2 ASN 40 22.133 23.062 9.985 1.00 0.00 ATOM 154 OD1 ASN 40 22.580 21.047 10.851 1.00 0.00 ATOM 155 O ASN 40 27.257 21.008 10.469 1.00 0.00 ATOM 156 C ASN 40 26.708 21.890 11.117 1.00 0.00 ATOM 157 N MET 41 27.309 22.949 11.631 1.00 0.00 ATOM 158 CA MET 41 28.694 23.281 11.247 1.00 0.00 ATOM 159 CB MET 41 28.722 24.580 10.443 1.00 0.00 ATOM 160 CG MET 41 27.991 24.511 9.109 1.00 0.00 ATOM 161 SD MET 41 28.044 26.070 8.206 1.00 0.00 ATOM 162 CE MET 41 29.752 26.093 7.669 1.00 0.00 ATOM 163 O MET 41 30.879 23.624 12.179 1.00 0.00 ATOM 164 C MET 41 29.693 23.427 12.409 1.00 0.00 ATOM 165 N GLY 42 29.196 23.430 13.641 1.00 0.00 ATOM 166 CA GLY 42 29.960 23.567 14.890 1.00 0.00 ATOM 167 O GLY 42 31.614 25.067 15.803 1.00 0.00 ATOM 168 C GLY 42 30.663 24.927 15.044 1.00 0.00 ATOM 169 N ALA 43 30.053 25.925 14.423 1.00 0.00 ATOM 170 CA ALA 43 30.550 27.302 14.498 1.00 0.00 ATOM 171 CB ALA 43 30.582 27.887 13.088 1.00 0.00 ATOM 172 O ALA 43 28.480 27.801 15.624 1.00 0.00 ATOM 173 C ALA 43 29.646 28.129 15.401 1.00 0.00 ATOM 174 N TRP 44 30.243 29.163 15.981 1.00 0.00 ATOM 175 CA TRP 44 29.520 30.062 16.889 1.00 0.00 ATOM 176 CB TRP 44 30.458 30.591 17.975 1.00 0.00 ATOM 177 CG TRP 44 30.890 29.542 18.956 1.00 0.00 ATOM 178 CD1 TRP 44 32.080 28.880 18.967 1.00 0.00 ATOM 179 CD2 TRP 44 30.138 29.037 20.065 1.00 0.00 ATOM 180 CE2 TRP 44 30.935 28.072 20.705 1.00 0.00 ATOM 181 CE3 TRP 44 28.864 29.310 20.580 1.00 0.00 ATOM 182 NE1 TRP 44 32.118 27.992 20.014 1.00 0.00 ATOM 183 CZ2 TRP 44 30.506 27.377 21.825 1.00 0.00 ATOM 184 CZ3 TRP 44 28.435 28.616 21.705 1.00 0.00 ATOM 185 CH2 TRP 44 29.233 27.678 22.309 1.00 0.00 ATOM 186 O TRP 44 29.534 31.798 15.211 1.00 0.00 ATOM 187 C TRP 44 28.901 31.219 16.097 1.00 0.00 ATOM 188 N PHE 45 27.628 31.482 16.327 1.00 0.00 ATOM 189 CA PHE 45 26.896 32.520 15.564 1.00 0.00 ATOM 190 CB PHE 45 25.870 31.861 14.650 1.00 0.00 ATOM 191 CG PHE 45 26.514 31.022 13.556 1.00 0.00 ATOM 192 CD1 PHE 45 26.697 31.575 12.301 1.00 0.00 ATOM 193 CD2 PHE 45 26.830 29.699 13.825 1.00 0.00 ATOM 194 CE1 PHE 45 27.158 30.774 11.266 1.00 0.00 ATOM 195 CE2 PHE 45 27.331 28.917 12.796 1.00 0.00 ATOM 196 CZ PHE 45 27.474 29.453 11.526 1.00 0.00 ATOM 197 O PHE 45 25.544 32.970 17.467 1.00 0.00 ATOM 198 C PHE 45 26.112 33.446 16.484 1.00 0.00 ATOM 199 N GLU 46 26.024 34.719 16.074 1.00 0.00 ATOM 200 CA GLU 46 25.172 35.679 16.783 1.00 0.00 ATOM 201 CB GLU 46 25.404 37.096 16.253 1.00 0.00 ATOM 202 CG GLU 46 24.618 38.177 16.979 1.00 0.00 ATOM 203 CD GLU 46 24.942 39.543 16.443 1.00 0.00 ATOM 204 OE1 GLU 46 25.738 39.632 15.539 1.00 0.00 ATOM 205 OE2 GLU 46 24.312 40.487 16.857 1.00 0.00 ATOM 206 O GLU 46 23.284 34.680 15.625 1.00 0.00 ATOM 207 C GLU 46 23.705 35.258 16.621 1.00 0.00 ATOM 208 N ALA 47 23.005 35.440 17.726 1.00 0.00 ATOM 209 CA ALA 47 21.652 34.916 17.856 1.00 0.00 ATOM 210 CB ALA 47 21.905 33.504 18.349 1.00 0.00 ATOM 211 O ALA 47 21.232 36.435 19.701 1.00 0.00 ATOM 212 C ALA 47 20.775 35.745 18.802 1.00 0.00 ATOM 213 N GLN 48 19.478 35.655 18.526 1.00 0.00 ATOM 214 CA GLN 48 18.416 36.233 19.346 1.00 0.00 ATOM 215 CB GLN 48 17.640 37.288 18.553 1.00 0.00 ATOM 216 CG GLN 48 16.541 37.979 19.344 1.00 0.00 ATOM 217 CD GLN 48 15.846 39.064 18.544 1.00 0.00 ATOM 218 OE1 GLN 48 16.088 39.221 17.344 1.00 0.00 ATOM 219 NE2 GLN 48 14.980 39.821 19.205 1.00 0.00 ATOM 220 O GLN 48 17.007 34.323 19.026 1.00 0.00 ATOM 221 C GLN 48 17.480 35.126 19.827 1.00 0.00 ATOM 222 N VAL 49 17.268 35.053 21.130 1.00 0.00 ATOM 223 CA VAL 49 16.349 34.033 21.681 1.00 0.00 ATOM 224 CB VAL 49 16.555 33.865 23.203 1.00 0.00 ATOM 225 CG1 VAL 49 15.623 32.823 23.810 1.00 0.00 ATOM 226 CG2 VAL 49 17.978 33.361 23.483 1.00 0.00 ATOM 227 O VAL 49 14.588 35.594 21.135 1.00 0.00 ATOM 228 C VAL 49 14.933 34.427 21.245 1.00 0.00 ATOM 229 N VAL 50 14.192 33.455 20.752 1.00 0.00 ATOM 230 CA VAL 50 12.839 33.749 20.257 1.00 0.00 ATOM 231 CB VAL 50 12.615 33.171 18.847 1.00 0.00 ATOM 232 CG1 VAL 50 11.178 33.398 18.401 1.00 0.00 ATOM 233 CG2 VAL 50 13.584 33.795 17.854 1.00 0.00 ATOM 234 O VAL 50 10.818 33.833 21.512 1.00 0.00 ATOM 235 C VAL 50 11.801 33.184 21.215 1.00 0.00 ATOM 236 N ARG 51 12.107 32.093 21.881 1.00 0.00 ATOM 237 CA ARG 51 11.205 31.573 22.918 1.00 0.00 ATOM 238 CB ARG 51 10.058 30.766 22.329 1.00 0.00 ATOM 239 CG ARG 51 10.480 29.542 21.531 1.00 0.00 ATOM 240 CD ARG 51 9.370 28.866 20.812 1.00 0.00 ATOM 241 NE ARG 51 8.813 29.631 19.707 1.00 0.00 ATOM 242 CZ ARG 51 7.783 29.226 18.940 1.00 0.00 ATOM 243 NH1 ARG 51 7.219 28.054 19.126 1.00 0.00 ATOM 244 NH2 ARG 51 7.369 30.031 17.977 1.00 0.00 ATOM 245 O ARG 51 13.116 30.331 23.703 1.00 0.00 ATOM 246 C ARG 51 11.995 30.789 23.932 1.00 0.00 ATOM 247 N VAL 52 11.381 30.737 25.084 1.00 0.00 ATOM 248 CA VAL 52 11.837 29.830 26.136 1.00 0.00 ATOM 249 CB VAL 52 12.243 30.599 27.407 1.00 0.00 ATOM 250 CG1 VAL 52 11.065 31.398 27.946 1.00 0.00 ATOM 251 CG2 VAL 52 12.762 29.639 28.468 1.00 0.00 ATOM 252 O VAL 52 9.555 29.174 26.585 1.00 0.00 ATOM 253 C VAL 52 10.741 28.838 26.458 1.00 0.00 ATOM 254 N THR 53 11.212 27.624 26.646 1.00 0.00 ATOM 255 CA THR 53 10.346 26.538 27.125 1.00 0.00 ATOM 256 CB THR 53 10.298 25.370 26.122 1.00 0.00 ATOM 257 CG2 THR 53 9.309 24.311 26.584 1.00 0.00 ATOM 258 OG1 THR 53 9.903 25.859 24.833 1.00 0.00 ATOM 259 O THR 53 11.555 25.078 28.634 1.00 0.00 ATOM 260 C THR 53 10.900 26.091 28.474 1.00 0.00 ATOM 261 N ARG 54 10.432 26.863 29.451 1.00 0.00 ATOM 262 CA ARG 54 10.907 26.877 30.842 1.00 0.00 ATOM 263 CB ARG 54 10.284 28.005 31.651 1.00 0.00 ATOM 264 CG ARG 54 10.769 29.398 31.285 1.00 0.00 ATOM 265 CD ARG 54 10.380 30.456 32.252 1.00 0.00 ATOM 266 NE ARG 54 8.949 30.694 32.342 1.00 0.00 ATOM 267 CZ ARG 54 8.261 31.536 31.544 1.00 0.00 ATOM 268 NH1 ARG 54 8.874 32.249 30.625 1.00 0.00 ATOM 269 NH2 ARG 54 6.957 31.644 31.728 1.00 0.00 ATOM 270 O ARG 54 11.305 25.306 32.518 1.00 0.00 ATOM 271 C ARG 54 10.690 25.529 31.506 1.00 0.00 ATOM 272 N LYS 55 9.573 24.893 31.155 1.00 0.00 ATOM 273 CA LYS 55 9.107 23.657 31.819 1.00 0.00 ATOM 274 CB LYS 55 7.639 23.389 31.483 1.00 0.00 ATOM 275 CG LYS 55 6.661 24.375 32.108 1.00 0.00 ATOM 276 CD LYS 55 5.224 24.041 31.735 1.00 0.00 ATOM 277 CE LYS 55 4.247 25.027 32.357 1.00 0.00 ATOM 278 NZ LYS 55 2.837 24.722 31.988 1.00 0.00 ATOM 279 O LYS 55 9.825 21.442 32.300 1.00 0.00 ATOM 280 C LYS 55 9.875 22.377 31.508 1.00 0.00 ATOM 281 N ALA 56 10.422 22.269 30.288 1.00 0.00 ATOM 282 CA ALA 56 11.097 21.034 29.859 1.00 0.00 ATOM 283 CB ALA 56 10.104 19.866 29.709 1.00 0.00 ATOM 284 O ALA 56 11.664 22.262 27.888 1.00 0.00 ATOM 285 C ALA 56 11.870 21.240 28.564 1.00 0.00 ATOM 286 N PRO 57 12.792 20.322 28.236 1.00 0.00 ATOM 287 CA PRO 57 13.464 20.393 26.948 1.00 0.00 ATOM 288 CB PRO 57 14.598 19.398 27.128 1.00 0.00 ATOM 289 CG PRO 57 14.173 18.379 28.168 1.00 0.00 ATOM 290 CD PRO 57 13.378 19.282 29.103 1.00 0.00 ATOM 291 O PRO 57 11.634 21.078 25.516 1.00 0.00 ATOM 292 C PRO 57 12.517 20.247 25.738 1.00 0.00 ATOM 293 N SER 58 12.767 19.265 24.878 1.00 0.00 ATOM 294 CA SER 58 11.940 19.079 23.666 1.00 0.00 ATOM 295 CB SER 58 12.611 19.730 22.471 1.00 0.00 ATOM 296 OG SER 58 11.768 19.773 21.353 1.00 0.00 ATOM 297 O SER 58 11.906 16.800 24.337 1.00 0.00 ATOM 298 C SER 58 11.712 17.595 23.430 1.00 0.00 ATOM 299 N ARG 59 11.212 17.218 22.257 1.00 0.00 ATOM 300 CA ARG 59 11.010 15.798 21.913 1.00 0.00 ATOM 301 CB ARG 59 10.659 15.690 20.438 1.00 0.00 ATOM 302 CG ARG 59 9.327 16.360 20.147 1.00 0.00 ATOM 303 CD ARG 59 9.067 16.234 18.662 1.00 0.00 ATOM 304 NE ARG 59 7.778 16.822 18.325 1.00 0.00 ATOM 305 CZ ARG 59 7.295 16.887 17.093 1.00 0.00 ATOM 306 NH1 ARG 59 6.130 17.455 16.852 1.00 0.00 ATOM 307 NH2 ARG 59 7.959 16.416 16.048 1.00 0.00 ATOM 308 O ARG 59 13.315 15.403 22.563 1.00 0.00 ATOM 309 C ARG 59 12.239 14.915 22.194 1.00 0.00 ATOM 310 N ASP 60 12.087 13.645 21.865 1.00 0.00 ATOM 311 CA ASP 60 13.155 12.652 21.991 1.00 0.00 ATOM 312 CB ASP 60 12.570 11.238 22.034 1.00 0.00 ATOM 313 CG ASP 60 11.800 10.914 23.307 1.00 0.00 ATOM 314 OD1 ASP 60 11.937 11.641 24.261 1.00 0.00 ATOM 315 OD2 ASP 60 10.967 10.041 23.267 1.00 0.00 ATOM 316 O ASP 60 14.547 11.806 20.221 1.00 0.00 ATOM 317 C ASP 60 14.151 12.790 20.827 1.00 0.00 ATOM 318 N GLU 61 14.563 14.027 20.591 1.00 0.00 ATOM 319 CA GLU 61 15.506 14.410 19.527 1.00 0.00 ATOM 320 CB GLU 61 14.882 15.466 18.612 1.00 0.00 ATOM 321 CG GLU 61 13.665 14.985 17.835 1.00 0.00 ATOM 322 CD GLU 61 13.145 16.055 16.916 1.00 0.00 ATOM 323 OE1 GLU 61 13.722 17.116 16.885 1.00 0.00 ATOM 324 OE2 GLU 61 12.241 15.777 16.163 1.00 0.00 ATOM 325 O GLU 61 16.906 16.095 20.526 1.00 0.00 ATOM 326 C GLU 61 16.808 14.927 20.150 1.00 0.00 ATOM 327 N PRO 62 17.792 14.034 20.333 1.00 0.00 ATOM 328 CA PRO 62 19.083 14.378 20.950 1.00 0.00 ATOM 329 CB PRO 62 19.893 13.085 20.987 1.00 0.00 ATOM 330 CG PRO 62 18.776 12.060 21.126 1.00 0.00 ATOM 331 CD PRO 62 17.699 12.573 20.182 1.00 0.00 ATOM 332 O PRO 62 20.518 15.297 19.198 1.00 0.00 ATOM 333 C PRO 62 19.824 15.470 20.199 1.00 0.00 ATOM 334 N CYS 63 19.741 16.657 20.774 1.00 0.00 ATOM 335 CA CYS 63 20.510 17.795 20.240 1.00 0.00 ATOM 336 CB CYS 63 19.923 19.110 20.731 1.00 0.00 ATOM 337 SG CYS 63 18.191 19.152 20.162 1.00 0.00 ATOM 338 O CYS 63 22.759 17.215 19.690 1.00 0.00 ATOM 339 C CYS 63 21.993 17.577 20.574 1.00 0.00 ATOM 340 N SER 64 22.252 17.577 21.878 1.00 0.00 ATOM 341 CA SER 64 23.568 17.278 22.493 1.00 0.00 ATOM 342 CB SER 64 24.789 17.735 21.665 1.00 0.00 ATOM 343 OG SER 64 26.010 17.518 22.374 1.00 0.00 ATOM 344 O SER 64 24.177 19.035 24.057 1.00 0.00 ATOM 345 C SER 64 23.678 17.926 23.875 1.00 0.00 ATOM 346 N SER 65 23.208 17.192 24.870 1.00 0.00 ATOM 347 CA SER 65 23.536 17.585 26.252 1.00 0.00 ATOM 348 CB SER 65 22.395 17.225 27.183 1.00 0.00 ATOM 349 OG SER 65 22.182 15.841 27.244 1.00 0.00 ATOM 350 O SER 65 25.174 17.007 27.901 1.00 0.00 ATOM 351 C SER 65 24.837 16.927 26.728 1.00 0.00 ATOM 352 N THR 66 25.553 16.278 25.801 1.00 0.00 ATOM 353 CA THR 66 26.878 15.662 26.032 1.00 0.00 ATOM 354 CB THR 66 27.922 16.710 26.461 1.00 0.00 ATOM 355 CG2 THR 66 29.313 16.097 26.487 1.00 0.00 ATOM 356 OG1 THR 66 27.906 17.810 25.541 1.00 0.00 ATOM 357 O THR 66 27.767 14.504 27.945 1.00 0.00 ATOM 358 C THR 66 26.882 14.547 27.096 1.00 0.00 ATOM 359 N SER 67 25.822 13.726 27.138 1.00 0.00 ATOM 360 CA SER 67 25.669 12.627 28.125 1.00 0.00 ATOM 361 CB SER 67 26.758 11.592 27.924 1.00 0.00 ATOM 362 OG SER 67 26.693 10.998 26.657 1.00 0.00 ATOM 363 O SER 67 25.935 12.389 30.557 1.00 0.00 ATOM 364 C SER 67 25.693 13.114 29.591 1.00 0.00 ATOM 365 N ARG 68 25.476 14.406 29.710 1.00 0.00 ATOM 366 CA ARG 68 25.342 15.126 30.992 1.00 0.00 ATOM 367 CB ARG 68 26.361 16.246 31.130 1.00 0.00 ATOM 368 CG ARG 68 27.808 15.787 31.224 1.00 0.00 ATOM 369 CD ARG 68 28.805 16.887 31.150 1.00 0.00 ATOM 370 NE ARG 68 30.185 16.458 31.307 1.00 0.00 ATOM 371 CZ ARG 68 31.250 17.285 31.281 1.00 0.00 ATOM 372 NH1 ARG 68 31.102 18.573 31.068 1.00 0.00 ATOM 373 NH2 ARG 68 32.451 16.759 31.452 1.00 0.00 ATOM 374 O ARG 68 23.511 16.436 30.225 1.00 0.00 ATOM 375 C ARG 68 23.872 15.556 31.010 1.00 0.00 ATOM 376 N PRO 69 22.996 14.867 31.736 1.00 0.00 ATOM 377 CA PRO 69 21.553 15.156 31.789 1.00 0.00 ATOM 378 CB PRO 69 20.980 14.004 32.587 1.00 0.00 ATOM 379 CG PRO 69 22.119 13.573 33.481 1.00 0.00 ATOM 380 CD PRO 69 23.332 13.719 32.577 1.00 0.00 ATOM 381 O PRO 69 20.045 16.610 33.006 1.00 0.00 ATOM 382 C PRO 69 21.145 16.461 32.473 1.00 0.00 ATOM 383 N ALA 70 22.021 17.436 32.329 1.00 0.00 ATOM 384 CA ALA 70 21.838 18.767 32.940 1.00 0.00 ATOM 385 CB ALA 70 23.135 19.525 32.764 1.00 0.00 ATOM 386 O ALA 70 19.932 20.247 33.013 1.00 0.00 ATOM 387 C ALA 70 20.645 19.517 32.325 1.00 0.00 ATOM 388 N LEU 71 20.341 19.210 31.066 1.00 0.00 ATOM 389 CA LEU 71 19.170 19.795 30.407 1.00 0.00 ATOM 390 CB LEU 71 19.077 19.304 28.957 1.00 0.00 ATOM 391 CG LEU 71 18.020 20.008 28.096 1.00 0.00 ATOM 392 CD1 LEU 71 18.228 21.516 28.144 1.00 0.00 ATOM 393 CD2 LEU 71 18.107 19.498 26.665 1.00 0.00 ATOM 394 O LEU 71 17.028 20.347 31.377 1.00 0.00 ATOM 395 C LEU 71 17.855 19.481 31.137 1.00 0.00 ATOM 396 N GLU 72 17.716 18.219 31.496 1.00 0.00 ATOM 397 CA GLU 72 16.514 17.713 32.171 1.00 0.00 ATOM 398 CB GLU 72 16.595 16.195 32.344 1.00 0.00 ATOM 399 CG GLU 72 16.459 15.406 31.050 1.00 0.00 ATOM 400 CD GLU 72 16.653 13.934 31.284 1.00 0.00 ATOM 401 OE1 GLU 72 16.948 13.562 32.395 1.00 0.00 ATOM 402 OE2 GLU 72 16.395 13.171 30.382 1.00 0.00 ATOM 403 O GLU 72 15.220 18.603 33.977 1.00 0.00 ATOM 404 C GLU 72 16.345 18.406 33.527 1.00 0.00 ATOM 405 N GLU 73 17.464 18.734 34.171 1.00 0.00 ATOM 406 CA GLU 73 17.460 19.474 35.454 1.00 0.00 ATOM 407 CB GLU 73 18.825 19.371 36.138 1.00 0.00 ATOM 408 CG GLU 73 19.162 17.981 36.661 1.00 0.00 ATOM 409 CD GLU 73 20.554 17.933 37.225 1.00 0.00 ATOM 410 OE1 GLU 73 21.242 18.923 37.146 1.00 0.00 ATOM 411 OE2 GLU 73 20.893 16.946 37.834 1.00 0.00 ATOM 412 O GLU 73 16.532 21.525 36.227 1.00 0.00 ATOM 413 C GLU 73 17.089 20.960 35.288 1.00 0.00 ATOM 414 N ASP 74 17.584 21.559 34.204 1.00 0.00 ATOM 415 CA ASP 74 17.442 22.998 33.877 1.00 0.00 ATOM 416 CB ASP 74 18.561 23.810 34.534 1.00 0.00 ATOM 417 CG ASP 74 18.453 25.315 34.323 1.00 0.00 ATOM 418 OD1 ASP 74 17.601 25.731 33.575 1.00 0.00 ATOM 419 OD2 ASP 74 19.114 26.041 35.027 1.00 0.00 ATOM 420 O ASP 74 18.464 23.019 31.676 1.00 0.00 ATOM 421 C ASP 74 17.448 23.222 32.338 1.00 0.00 ATOM 422 N VAL 75 16.288 23.586 31.808 1.00 0.00 ATOM 423 CA VAL 75 15.924 23.380 30.361 1.00 0.00 ATOM 424 CB VAL 75 14.444 22.983 30.276 1.00 0.00 ATOM 425 CG1 VAL 75 14.113 21.840 31.223 1.00 0.00 ATOM 426 CG2 VAL 75 13.527 24.169 30.548 1.00 0.00 ATOM 427 O VAL 75 17.253 25.085 29.191 1.00 0.00 ATOM 428 C VAL 75 16.308 24.301 29.155 1.00 0.00 ATOM 429 N ILE 76 15.536 24.204 28.057 1.00 0.00 ATOM 430 CA ILE 76 15.833 24.794 26.725 1.00 0.00 ATOM 431 CB ILE 76 15.511 23.810 25.586 1.00 0.00 ATOM 432 CG1 ILE 76 14.003 23.565 25.502 1.00 0.00 ATOM 433 CG2 ILE 76 16.256 22.499 25.790 1.00 0.00 ATOM 434 CD1 ILE 76 13.555 22.956 24.193 1.00 0.00 ATOM 435 O ILE 76 14.132 26.579 26.763 1.00 0.00 ATOM 436 C ILE 76 15.157 26.117 26.261 1.00 0.00 ATOM 437 N TYR 77 15.675 26.529 25.098 1.00 0.00 ATOM 438 CA TYR 77 15.118 27.604 24.261 1.00 0.00 ATOM 439 CB TYR 77 15.796 28.938 24.581 1.00 0.00 ATOM 440 CG TYR 77 17.269 28.973 24.241 1.00 0.00 ATOM 441 CD1 TYR 77 17.730 29.675 23.136 1.00 0.00 ATOM 442 CD2 TYR 77 18.197 28.305 25.027 1.00 0.00 ATOM 443 CE1 TYR 77 19.075 29.710 22.822 1.00 0.00 ATOM 444 CE2 TYR 77 19.544 28.333 24.722 1.00 0.00 ATOM 445 CZ TYR 77 19.979 29.038 23.618 1.00 0.00 ATOM 446 OH TYR 77 21.320 29.070 23.310 1.00 0.00 ATOM 447 O TYR 77 15.967 26.460 22.295 1.00 0.00 ATOM 448 C TYR 77 15.238 27.342 22.748 1.00 0.00 ATOM 449 N HIS 78 14.635 28.265 21.999 1.00 0.00 ATOM 450 CA HIS 78 14.805 28.340 20.540 1.00 0.00 ATOM 451 CB HIS 78 13.456 28.191 19.829 1.00 0.00 ATOM 452 CG HIS 78 12.842 26.834 19.984 1.00 0.00 ATOM 453 CD2 HIS 78 12.769 25.786 19.130 1.00 0.00 ATOM 454 ND1 HIS 78 12.204 26.434 21.139 1.00 0.00 ATOM 455 CE1 HIS 78 11.764 25.196 20.989 1.00 0.00 ATOM 456 NE2 HIS 78 12.094 24.781 19.779 1.00 0.00 ATOM 457 O HIS 78 15.018 30.742 20.642 1.00 0.00 ATOM 458 C HIS 78 15.474 29.679 20.217 1.00 0.00 ATOM 459 N VAL 79 16.528 29.573 19.434 1.00 0.00 ATOM 460 CA VAL 79 17.319 30.733 19.039 1.00 0.00 ATOM 461 CB VAL 79 18.730 30.543 19.579 1.00 0.00 ATOM 462 CG1 VAL 79 19.544 29.379 19.009 1.00 0.00 ATOM 463 CG2 VAL 79 19.475 31.856 19.521 1.00 0.00 ATOM 464 O VAL 79 17.489 30.024 16.748 1.00 0.00 ATOM 465 C VAL 79 17.314 30.963 17.521 1.00 0.00 ATOM 466 N LYS 80 17.232 32.233 17.172 1.00 0.00 ATOM 467 CA LYS 80 17.282 32.646 15.757 1.00 0.00 ATOM 468 CB LYS 80 16.176 33.657 15.454 1.00 0.00 ATOM 469 CG LYS 80 16.093 34.082 13.995 1.00 0.00 ATOM 470 CD LYS 80 14.997 35.114 13.778 1.00 0.00 ATOM 471 CE LYS 80 14.920 35.544 12.321 1.00 0.00 ATOM 472 NZ LYS 80 13.837 36.540 12.092 1.00 0.00 ATOM 473 O LYS 80 19.079 34.188 16.083 1.00 0.00 ATOM 474 C LYS 80 18.656 33.228 15.446 1.00 0.00 ATOM 475 N TYR 81 19.296 32.633 14.455 1.00 0.00 ATOM 476 CA TYR 81 20.608 33.098 13.972 1.00 0.00 ATOM 477 CB TYR 81 21.213 32.081 13.001 1.00 0.00 ATOM 478 CG TYR 81 21.652 30.792 13.661 1.00 0.00 ATOM 479 CD1 TYR 81 21.723 30.685 15.042 1.00 0.00 ATOM 480 CD2 TYR 81 21.992 29.684 12.898 1.00 0.00 ATOM 481 CE1 TYR 81 22.124 29.511 15.648 1.00 0.00 ATOM 482 CE2 TYR 81 22.394 28.505 13.493 1.00 0.00 ATOM 483 CZ TYR 81 22.457 28.421 14.869 1.00 0.00 ATOM 484 OH TYR 81 22.856 27.248 15.467 1.00 0.00 ATOM 485 O TYR 81 19.842 34.583 12.258 1.00 0.00 ATOM 486 C TYR 81 20.495 34.468 13.294 1.00 0.00 ATOM 487 N ASP 82 21.079 35.481 13.931 1.00 0.00 ATOM 488 CA ASP 82 21.079 36.854 13.383 1.00 0.00 ATOM 489 CB ASP 82 21.828 37.836 14.309 1.00 0.00 ATOM 490 CG ASP 82 21.580 39.300 13.909 1.00 0.00 ATOM 491 OD1 ASP 82 20.876 39.523 12.893 1.00 0.00 ATOM 492 OD2 ASP 82 21.709 40.168 14.787 1.00 0.00 ATOM 493 O ASP 82 22.658 36.182 11.711 1.00 0.00 ATOM 494 C ASP 82 21.707 36.910 11.976 1.00 0.00 ATOM 495 N ASP 83 20.871 37.313 11.021 1.00 0.00 ATOM 496 CA ASP 83 21.241 37.484 9.594 1.00 0.00 ATOM 497 CB ASP 83 22.541 38.284 9.468 1.00 0.00 ATOM 498 CG ASP 83 22.474 39.688 10.051 1.00 0.00 ATOM 499 OD1 ASP 83 21.514 40.374 9.787 1.00 0.00 ATOM 500 OD2 ASP 83 23.296 40.009 10.875 1.00 0.00 ATOM 501 O ASP 83 21.390 36.191 7.597 1.00 0.00 ATOM 502 C ASP 83 21.403 36.174 8.833 1.00 0.00 ATOM 503 N TYR 84 21.116 35.066 9.524 1.00 0.00 ATOM 504 CA TYR 84 21.148 33.719 8.933 1.00 0.00 ATOM 505 CB TYR 84 22.224 32.864 9.606 1.00 0.00 ATOM 506 CG TYR 84 23.617 33.443 9.509 1.00 0.00 ATOM 507 CD1 TYR 84 24.222 34.037 10.607 1.00 0.00 ATOM 508 CD2 TYR 84 24.326 33.393 8.317 1.00 0.00 ATOM 509 CE1 TYR 84 25.494 34.568 10.523 1.00 0.00 ATOM 510 CE2 TYR 84 25.599 33.920 8.221 1.00 0.00 ATOM 511 CZ TYR 84 26.180 34.507 9.327 1.00 0.00 ATOM 512 OH TYR 84 27.449 35.033 9.237 1.00 0.00 ATOM 513 O TYR 84 19.667 31.900 9.580 1.00 0.00 ATOM 514 C TYR 84 19.785 32.998 9.031 1.00 0.00 ATOM 515 N PRO 85 18.720 33.579 8.439 1.00 0.00 ATOM 516 CA PRO 85 17.352 33.014 8.478 1.00 0.00 ATOM 517 CB PRO 85 16.460 34.103 7.901 1.00 0.00 ATOM 518 CG PRO 85 17.379 34.842 6.943 1.00 0.00 ATOM 519 CD PRO 85 18.723 34.820 7.648 1.00 0.00 ATOM 520 O PRO 85 16.304 30.889 8.111 1.00 0.00 ATOM 521 C PRO 85 17.162 31.700 7.728 1.00 0.00 ATOM 522 N GLU 86 18.006 31.465 6.732 1.00 0.00 ATOM 523 CA GLU 86 17.952 30.261 5.900 1.00 0.00 ATOM 524 CB GLU 86 18.947 30.365 4.741 1.00 0.00 ATOM 525 CG GLU 86 18.563 31.381 3.674 1.00 0.00 ATOM 526 CD GLU 86 19.627 31.491 2.618 1.00 0.00 ATOM 527 OE1 GLU 86 20.642 30.851 2.755 1.00 0.00 ATOM 528 OE2 GLU 86 19.381 32.125 1.618 1.00 0.00 ATOM 529 O GLU 86 17.562 27.993 6.318 1.00 0.00 ATOM 530 C GLU 86 18.223 28.961 6.633 1.00 0.00 ATOM 531 N ASN 87 18.955 29.028 7.732 1.00 0.00 ATOM 532 CA ASN 87 19.243 27.808 8.523 1.00 0.00 ATOM 533 CB ASN 87 20.480 28.013 9.363 1.00 0.00 ATOM 534 CG ASN 87 21.712 28.027 8.453 1.00 0.00 ATOM 535 ND2 ASN 87 22.711 28.659 8.960 1.00 0.00 ATOM 536 OD1 ASN 87 21.828 27.516 7.347 1.00 0.00 ATOM 537 O ASN 87 18.097 26.147 9.827 1.00 0.00 ATOM 538 C ASN 87 18.081 27.286 9.371 1.00 0.00 ATOM 539 N GLY 88 17.066 28.123 9.553 1.00 0.00 ATOM 540 CA GLY 88 15.905 27.774 10.407 1.00 0.00 ATOM 541 O GLY 88 17.303 26.941 12.193 1.00 0.00 ATOM 542 C GLY 88 16.396 27.685 11.849 1.00 0.00 ATOM 543 N VAL 89 15.848 28.593 12.666 1.00 0.00 ATOM 544 CA VAL 89 16.180 28.687 14.108 1.00 0.00 ATOM 545 CB VAL 89 15.076 29.417 14.896 1.00 0.00 ATOM 546 CG1 VAL 89 14.802 30.784 14.288 1.00 0.00 ATOM 547 CG2 VAL 89 13.804 28.584 14.926 1.00 0.00 ATOM 548 O VAL 89 15.658 26.401 14.371 1.00 0.00 ATOM 549 C VAL 89 16.397 27.302 14.716 1.00 0.00 ATOM 550 N VAL 90 17.170 27.245 15.772 1.00 0.00 ATOM 551 CA VAL 90 17.455 25.952 16.424 1.00 0.00 ATOM 552 CB VAL 90 18.953 25.601 16.351 1.00 0.00 ATOM 553 CG1 VAL 90 19.392 25.439 14.904 1.00 0.00 ATOM 554 CG2 VAL 90 19.786 26.668 17.043 1.00 0.00 ATOM 555 O VAL 90 16.986 26.958 18.567 1.00 0.00 ATOM 556 C VAL 90 17.025 25.936 17.892 1.00 0.00 ATOM 557 N GLN 91 16.631 24.747 18.334 1.00 0.00 ATOM 558 CA GLN 91 16.580 24.452 19.773 1.00 0.00 ATOM 559 CB GLN 91 15.672 23.275 20.097 1.00 0.00 ATOM 560 CG GLN 91 16.081 21.972 19.403 1.00 0.00 ATOM 561 CD GLN 91 15.184 20.769 19.712 1.00 0.00 ATOM 562 OE1 GLN 91 15.430 19.611 19.439 1.00 0.00 ATOM 563 NE2 GLN 91 14.019 21.064 20.180 1.00 0.00 ATOM 564 O GLN 91 18.831 23.460 19.863 1.00 0.00 ATOM 565 C GLN 91 17.979 24.211 20.354 1.00 0.00 ATOM 566 N MET 92 18.194 24.877 21.459 1.00 0.00 ATOM 567 CA MET 92 19.466 24.760 22.182 1.00 0.00 ATOM 568 CB MET 92 20.299 26.027 21.993 1.00 0.00 ATOM 569 CG MET 92 20.904 26.182 20.604 1.00 0.00 ATOM 570 SD MET 92 22.401 25.201 20.385 1.00 0.00 ATOM 571 CE MET 92 21.760 23.806 19.463 1.00 0.00 ATOM 572 O MET 92 18.156 24.924 24.180 1.00 0.00 ATOM 573 C MET 92 19.184 24.499 23.646 1.00 0.00 ATOM 574 N ASN 93 20.076 23.729 24.260 1.00 0.00 ATOM 575 CA ASN 93 20.086 23.674 25.723 1.00 0.00 ATOM 576 CB ASN 93 20.916 22.509 26.229 1.00 0.00 ATOM 577 CG ASN 93 22.247 22.371 25.543 1.00 0.00 ATOM 578 ND2 ASN 93 23.269 22.151 26.331 1.00 0.00 ATOM 579 OD1 ASN 93 22.337 22.391 24.309 1.00 0.00 ATOM 580 O ASN 93 21.649 25.510 25.770 1.00 0.00 ATOM 581 C ASN 93 20.609 25.032 26.225 1.00 0.00 ATOM 582 N SER 94 19.872 25.628 27.160 1.00 0.00 ATOM 583 CA SER 94 20.307 26.894 27.801 1.00 0.00 ATOM 584 CB SER 94 19.382 27.243 28.950 1.00 0.00 ATOM 585 OG SER 94 19.586 26.413 30.061 1.00 0.00 ATOM 586 O SER 94 22.473 27.839 28.256 1.00 0.00 ATOM 587 C SER 94 21.761 26.843 28.312 1.00 0.00 ATOM 588 N ARG 95 22.186 25.684 28.817 1.00 0.00 ATOM 589 CA ARG 95 23.547 25.377 29.330 1.00 0.00 ATOM 590 CB ARG 95 23.660 23.946 29.838 1.00 0.00 ATOM 591 CG ARG 95 25.009 23.586 30.439 1.00 0.00 ATOM 592 CD ARG 95 25.071 22.224 31.029 1.00 0.00 ATOM 593 NE ARG 95 26.348 21.891 31.641 1.00 0.00 ATOM 594 CZ ARG 95 27.409 21.396 30.975 1.00 0.00 ATOM 595 NH1 ARG 95 27.341 21.139 29.688 1.00 0.00 ATOM 596 NH2 ARG 95 28.515 21.151 31.657 1.00 0.00 ATOM 597 O ARG 95 25.812 25.938 28.654 1.00 0.00 ATOM 598 C ARG 95 24.657 25.669 28.307 1.00 0.00 ATOM 599 N ASP 96 24.305 25.569 27.038 1.00 0.00 ATOM 600 CA ASP 96 25.268 25.636 25.918 1.00 0.00 ATOM 601 CB ASP 96 24.858 24.675 24.800 1.00 0.00 ATOM 602 CG ASP 96 25.795 24.670 23.600 1.00 0.00 ATOM 603 OD1 ASP 96 26.975 24.496 23.793 1.00 0.00 ATOM 604 OD2 ASP 96 25.312 24.682 22.493 1.00 0.00 ATOM 605 O ASP 96 26.415 27.274 24.580 1.00 0.00 ATOM 606 C ASP 96 25.452 27.025 25.302 1.00 0.00 ATOM 607 N VAL 97 24.632 27.975 25.775 1.00 0.00 ATOM 608 CA VAL 97 24.697 29.366 25.337 1.00 0.00 ATOM 609 CB VAL 97 23.427 30.117 25.773 1.00 0.00 ATOM 610 CG1 VAL 97 23.330 30.510 27.243 1.00 0.00 ATOM 611 CG2 VAL 97 23.371 31.382 24.963 1.00 0.00 ATOM 612 O VAL 97 26.415 29.937 26.967 1.00 0.00 ATOM 613 C VAL 97 25.978 30.075 25.825 1.00 0.00 ATOM 614 N ARG 98 26.471 30.952 24.975 1.00 0.00 ATOM 615 CA ARG 98 27.631 31.784 25.318 1.00 0.00 ATOM 616 CB ARG 98 28.901 31.309 24.631 1.00 0.00 ATOM 617 CG ARG 98 29.373 29.923 25.042 1.00 0.00 ATOM 618 CD ARG 98 29.978 29.860 26.398 1.00 0.00 ATOM 619 NE ARG 98 30.510 28.556 26.759 1.00 0.00 ATOM 620 CZ ARG 98 29.798 27.576 27.348 1.00 0.00 ATOM 621 NH1 ARG 98 28.539 27.757 27.676 1.00 0.00 ATOM 622 NH2 ARG 98 30.407 26.432 27.609 1.00 0.00 ATOM 623 O ARG 98 26.972 33.600 23.875 1.00 0.00 ATOM 624 C ARG 98 27.278 33.239 25.004 1.00 0.00 ATOM 625 N ALA 99 26.923 33.874 26.101 1.00 0.00 ATOM 626 CA ALA 99 26.258 35.176 26.166 1.00 0.00 ATOM 627 CB ALA 99 26.029 35.404 27.645 1.00 0.00 ATOM 628 O ALA 99 28.138 36.667 26.066 1.00 0.00 ATOM 629 C ALA 99 27.050 36.345 25.588 1.00 0.00 ATOM 630 N ARG 100 26.349 37.118 24.771 1.00 0.00 ATOM 631 CA ARG 100 26.842 38.434 24.362 1.00 0.00 ATOM 632 CB ARG 100 26.214 38.902 23.058 1.00 0.00 ATOM 633 CG ARG 100 26.759 40.215 22.519 1.00 0.00 ATOM 634 CD ARG 100 26.234 40.595 21.183 1.00 0.00 ATOM 635 NE ARG 100 26.775 41.837 20.653 1.00 0.00 ATOM 636 CZ ARG 100 26.382 42.411 19.500 1.00 0.00 ATOM 637 NH1 ARG 100 25.477 41.844 18.734 1.00 0.00 ATOM 638 NH2 ARG 100 26.950 43.550 19.145 1.00 0.00 ATOM 639 O ARG 100 27.541 40.236 25.756 1.00 0.00 ATOM 640 C ARG 100 26.648 39.461 25.490 1.00 0.00 ATOM 641 N ALA 101 25.555 39.321 26.228 1.00 0.00 ATOM 642 CA ALA 101 25.259 40.200 27.381 1.00 0.00 ATOM 643 CB ALA 101 23.883 39.857 27.958 1.00 0.00 ATOM 644 O ALA 101 26.570 41.152 29.182 1.00 0.00 ATOM 645 C ALA 101 26.340 40.166 28.479 1.00 0.00 ATOM 646 N ARG 102 27.122 39.079 28.507 1.00 0.00 ATOM 647 CA ARG 102 28.303 38.964 29.409 1.00 0.00 ATOM 648 CB ARG 102 28.991 37.612 29.286 1.00 0.00 ATOM 649 CG ARG 102 28.329 36.485 30.063 1.00 0.00 ATOM 650 CD ARG 102 29.151 35.253 30.174 1.00 0.00 ATOM 651 NE ARG 102 29.256 34.485 28.943 1.00 0.00 ATOM 652 CZ ARG 102 30.089 33.441 28.761 1.00 0.00 ATOM 653 NH1 ARG 102 30.915 33.061 29.711 1.00 0.00 ATOM 654 NH2 ARG 102 30.069 32.824 27.593 1.00 0.00 ATOM 655 O ARG 102 29.920 40.590 30.111 1.00 0.00 ATOM 656 C ARG 102 29.286 40.121 29.177 1.00 0.00 ATOM 657 N THR 103 29.439 40.426 27.889 1.00 0.00 ATOM 658 CA THR 103 30.317 41.471 27.362 1.00 0.00 ATOM 659 CB THR 103 30.170 41.616 25.836 1.00 0.00 ATOM 660 CG2 THR 103 31.067 42.729 25.317 1.00 0.00 ATOM 661 OG1 THR 103 30.528 40.383 25.199 1.00 0.00 ATOM 662 O THR 103 30.885 43.696 27.917 1.00 0.00 ATOM 663 C THR 103 30.031 42.832 28.024 1.00 0.00 ATOM 664 N ILE 104 28.957 42.968 28.811 1.00 0.00 ATOM 665 CA ILE 104 28.584 44.269 29.414 1.00 0.00 ATOM 666 CB ILE 104 27.278 44.163 30.224 1.00 0.00 ATOM 667 CG1 ILE 104 26.664 45.550 30.431 1.00 0.00 ATOM 668 CG2 ILE 104 27.535 43.485 31.560 1.00 0.00 ATOM 669 CD1 ILE 104 25.251 45.519 30.966 1.00 0.00 ATOM 670 O ILE 104 29.327 46.029 30.915 1.00 0.00 ATOM 671 C ILE 104 29.589 44.951 30.363 1.00 0.00 ATOM 672 N ILE 105 30.668 44.246 30.673 1.00 0.00 ATOM 673 CA ILE 105 31.796 44.855 31.388 1.00 0.00 ATOM 674 CB ILE 105 33.008 43.908 31.442 1.00 0.00 ATOM 675 CG1 ILE 105 32.694 42.688 32.312 1.00 0.00 ATOM 676 CG2 ILE 105 34.232 44.641 31.970 1.00 0.00 ATOM 677 CD1 ILE 105 32.387 43.028 33.753 1.00 0.00 ATOM 678 O ILE 105 32.547 46.268 29.560 1.00 0.00 ATOM 679 C ILE 105 32.222 46.182 30.731 1.00 0.00 ATOM 680 N LYS 106 32.087 47.221 31.517 1.00 0.00 ATOM 681 CA LYS 106 32.492 48.555 31.066 1.00 0.00 ATOM 682 CB LYS 106 31.888 49.632 31.967 1.00 0.00 ATOM 683 CG LYS 106 30.370 49.740 31.889 1.00 0.00 ATOM 684 CD LYS 106 29.847 50.852 32.785 1.00 0.00 ATOM 685 CE LYS 106 28.331 50.961 32.705 1.00 0.00 ATOM 686 NZ LYS 106 27.807 52.061 33.559 1.00 0.00 ATOM 687 O LYS 106 34.800 48.013 31.643 1.00 0.00 ATOM 688 C LYS 106 34.018 48.724 31.023 1.00 0.00 ATOM 689 N TRP 107 34.327 49.893 30.480 1.00 0.00 ATOM 690 CA TRP 107 35.629 50.571 30.390 1.00 0.00 ATOM 691 CB TRP 107 35.363 52.071 30.161 1.00 0.00 ATOM 692 CG TRP 107 33.926 52.441 29.739 1.00 0.00 ATOM 693 CD1 TRP 107 32.824 52.441 30.486 1.00 0.00 ATOM 694 CD2 TRP 107 33.519 52.596 28.418 1.00 0.00 ATOM 695 CE2 TRP 107 32.146 52.698 28.445 1.00 0.00 ATOM 696 CE3 TRP 107 34.205 52.705 27.241 1.00 0.00 ATOM 697 NE1 TRP 107 31.756 52.574 29.697 1.00 0.00 ATOM 698 CZ2 TRP 107 31.431 52.925 27.265 1.00 0.00 ATOM 699 CZ3 TRP 107 33.500 52.922 26.060 1.00 0.00 ATOM 700 CH2 TRP 107 32.118 53.046 26.080 1.00 0.00 ATOM 701 O TRP 107 37.490 49.932 31.802 1.00 0.00 ATOM 702 C TRP 107 36.377 50.437 31.714 1.00 0.00 ATOM 703 N GLN 108 35.675 50.924 32.730 1.00 0.00 ATOM 704 CA GLN 108 36.151 51.112 34.117 1.00 0.00 ATOM 705 CB GLN 108 35.154 51.955 34.917 1.00 0.00 ATOM 706 CG GLN 108 35.071 53.406 34.477 1.00 0.00 ATOM 707 CD GLN 108 34.052 54.197 35.276 1.00 0.00 ATOM 708 OE1 GLN 108 33.407 53.665 36.183 1.00 0.00 ATOM 709 NE2 GLN 108 33.900 55.472 34.941 1.00 0.00 ATOM 710 O GLN 108 37.178 49.837 35.860 1.00 0.00 ATOM 711 C GLN 108 36.399 49.832 34.904 1.00 0.00 ATOM 712 N ASP 109 35.828 48.761 34.399 1.00 0.00 ATOM 713 CA ASP 109 35.841 47.463 35.076 1.00 0.00 ATOM 714 CB ASP 109 34.487 46.765 34.926 1.00 0.00 ATOM 715 CG ASP 109 33.350 47.426 35.694 1.00 0.00 ATOM 716 OD1 ASP 109 33.628 48.199 36.580 1.00 0.00 ATOM 717 OD2 ASP 109 32.221 47.276 35.291 1.00 0.00 ATOM 718 O ASP 109 36.996 45.336 34.905 1.00 0.00 ATOM 719 C ASP 109 36.943 46.521 34.570 1.00 0.00 ATOM 720 N LEU 110 37.777 47.042 33.673 1.00 0.00 ATOM 721 CA LEU 110 38.895 46.292 33.085 1.00 0.00 ATOM 722 CB LEU 110 38.715 46.175 31.566 1.00 0.00 ATOM 723 CG LEU 110 37.553 45.281 31.114 1.00 0.00 ATOM 724 CD1 LEU 110 37.403 45.346 29.600 1.00 0.00 ATOM 725 CD2 LEU 110 37.803 43.852 31.571 1.00 0.00 ATOM 726 O LEU 110 40.369 48.191 33.315 1.00 0.00 ATOM 727 C LEU 110 40.224 46.971 33.426 1.00 0.00 ATOM 728 N GLU 111 41.218 46.114 33.628 1.00 0.00 ATOM 729 CA GLU 111 42.587 46.600 33.921 1.00 0.00 ATOM 730 CB GLU 111 43.029 46.149 35.315 1.00 0.00 ATOM 731 CG GLU 111 42.142 46.650 36.447 1.00 0.00 ATOM 732 CD GLU 111 42.335 48.122 36.682 1.00 0.00 ATOM 733 OE1 GLU 111 43.270 48.672 36.151 1.00 0.00 ATOM 734 OE2 GLU 111 41.485 48.721 37.298 1.00 0.00 ATOM 735 O GLU 111 43.331 45.077 32.196 1.00 0.00 ATOM 736 C GLU 111 43.563 46.094 32.854 1.00 0.00 ATOM 737 N VAL 112 44.604 46.876 32.608 1.00 0.00 ATOM 738 CA VAL 112 45.720 46.443 31.729 1.00 0.00 ATOM 739 CB VAL 112 46.808 47.528 31.621 1.00 0.00 ATOM 740 CG1 VAL 112 47.502 47.723 32.961 1.00 0.00 ATOM 741 CG2 VAL 112 47.820 47.163 30.546 1.00 0.00 ATOM 742 O VAL 112 46.574 45.157 33.521 1.00 0.00 ATOM 743 C VAL 112 46.278 45.141 32.334 1.00 0.00 ATOM 744 N GLY 113 46.426 44.120 31.511 1.00 0.00 ATOM 745 CA GLY 113 46.972 42.823 31.952 1.00 0.00 ATOM 746 O GLY 113 46.227 40.648 32.647 1.00 0.00 ATOM 747 C GLY 113 45.901 41.802 32.361 1.00 0.00 ATOM 748 N GLN 114 44.650 42.239 32.394 1.00 0.00 ATOM 749 CA GLN 114 43.512 41.380 32.762 1.00 0.00 ATOM 750 CB GLN 114 42.256 42.224 32.994 1.00 0.00 ATOM 751 CG GLN 114 41.037 41.423 33.417 1.00 0.00 ATOM 752 CD GLN 114 41.183 40.840 34.809 1.00 0.00 ATOM 753 OE1 GLN 114 41.649 41.512 35.734 1.00 0.00 ATOM 754 NE2 GLN 114 40.788 39.581 34.967 1.00 0.00 ATOM 755 O GLN 114 42.887 40.683 30.542 1.00 0.00 ATOM 756 C GLN 114 43.243 40.332 31.675 1.00 0.00 ATOM 757 N VAL 115 43.413 39.075 32.063 1.00 0.00 ATOM 758 CA VAL 115 42.980 37.944 31.215 1.00 0.00 ATOM 759 CB VAL 115 43.566 36.593 31.667 1.00 0.00 ATOM 760 CG1 VAL 115 43.087 36.137 33.038 1.00 0.00 ATOM 761 CG2 VAL 115 43.355 35.511 30.597 1.00 0.00 ATOM 762 O VAL 115 40.706 38.310 32.004 1.00 0.00 ATOM 763 C VAL 115 41.456 37.990 31.067 1.00 0.00 ATOM 764 N VAL 116 41.094 38.041 29.809 1.00 0.00 ATOM 765 CA VAL 116 39.720 38.338 29.344 1.00 0.00 ATOM 766 CB VAL 116 39.629 39.779 28.815 1.00 0.00 ATOM 767 CG1 VAL 116 39.746 40.808 29.941 1.00 0.00 ATOM 768 CG2 VAL 116 40.634 40.064 27.683 1.00 0.00 ATOM 769 O VAL 116 40.064 36.740 27.581 1.00 0.00 ATOM 770 C VAL 116 39.261 37.372 28.253 1.00 0.00 ATOM 771 N MET 117 37.961 37.403 28.033 1.00 0.00 ATOM 772 CA MET 117 37.351 36.796 26.836 1.00 0.00 ATOM 773 CB MET 117 36.205 35.869 27.240 1.00 0.00 ATOM 774 CG MET 117 35.509 35.184 26.073 1.00 0.00 ATOM 775 SD MET 117 34.205 34.056 26.606 1.00 0.00 ATOM 776 CE MET 117 35.175 32.697 27.251 1.00 0.00 ATOM 777 O MET 117 36.084 38.768 26.283 1.00 0.00 ATOM 778 C MET 117 36.869 37.900 25.907 1.00 0.00 ATOM 779 N LEU 118 37.464 37.928 24.728 1.00 0.00 ATOM 780 CA LEU 118 37.145 38.962 23.752 1.00 0.00 ATOM 781 CB LEU 118 38.417 39.758 23.491 1.00 0.00 ATOM 782 CG LEU 118 38.352 40.877 22.455 1.00 0.00 ATOM 783 CD1 LEU 118 39.481 41.828 22.812 1.00 0.00 ATOM 784 CD2 LEU 118 38.576 40.341 21.033 1.00 0.00 ATOM 785 O LEU 118 36.753 37.240 22.075 1.00 0.00 ATOM 786 C LEU 118 36.487 38.365 22.503 1.00 0.00 ATOM 787 N ASN 119 35.431 39.071 22.143 1.00 0.00 ATOM 788 CA ASN 119 34.685 38.828 20.913 1.00 0.00 ATOM 789 CB ASN 119 33.302 39.452 20.970 1.00 0.00 ATOM 790 CG ASN 119 32.506 39.272 19.708 1.00 0.00 ATOM 791 ND2 ASN 119 31.302 38.781 19.866 1.00 0.00 ATOM 792 OD1 ASN 119 32.946 39.643 18.613 1.00 0.00 ATOM 793 O ASN 119 35.885 40.538 19.716 1.00 0.00 ATOM 794 C ASN 119 35.505 39.368 19.733 1.00 0.00 ATOM 795 N TYR 120 35.702 38.513 18.754 1.00 0.00 ATOM 796 CA TYR 120 36.421 38.944 17.554 1.00 0.00 ATOM 797 CB TYR 120 37.297 37.858 16.953 1.00 0.00 ATOM 798 CG TYR 120 38.699 38.410 17.027 1.00 0.00 ATOM 799 CD1 TYR 120 39.109 39.501 16.278 1.00 0.00 ATOM 800 CD2 TYR 120 39.514 37.862 17.990 1.00 0.00 ATOM 801 CE1 TYR 120 40.363 40.060 16.508 1.00 0.00 ATOM 802 CE2 TYR 120 40.758 38.411 18.217 1.00 0.00 ATOM 803 CZ TYR 120 41.177 39.510 17.481 1.00 0.00 ATOM 804 OH TYR 120 42.378 40.069 17.759 1.00 0.00 ATOM 805 O TYR 120 35.288 40.657 16.349 1.00 0.00 ATOM 806 C TYR 120 35.449 39.463 16.535 1.00 0.00 ATOM 807 N ASN 121 34.753 38.502 15.944 1.00 0.00 ATOM 808 CA ASN 121 33.747 38.885 14.986 1.00 0.00 ATOM 809 CB ASN 121 34.403 38.844 13.601 1.00 0.00 ATOM 810 CG ASN 121 35.200 40.117 13.302 1.00 0.00 ATOM 811 ND2 ASN 121 35.997 40.031 12.274 1.00 0.00 ATOM 812 OD1 ASN 121 34.979 41.191 13.824 1.00 0.00 ATOM 813 O ASN 121 32.338 37.228 15.978 1.00 0.00 ATOM 814 C ASN 121 32.393 38.244 15.286 1.00 0.00 ATOM 815 N PRO 122 31.366 39.076 15.149 1.00 0.00 ATOM 816 CA PRO 122 30.023 38.795 15.679 1.00 0.00 ATOM 817 CB PRO 122 29.374 40.181 15.640 1.00 0.00 ATOM 818 CG PRO 122 29.968 40.807 14.383 1.00 0.00 ATOM 819 CD PRO 122 31.420 40.415 14.525 1.00 0.00 ATOM 820 O PRO 122 28.505 36.965 15.891 1.00 0.00 ATOM 821 C PRO 122 29.213 37.603 15.114 1.00 0.00 ATOM 822 N ASP 123 29.556 37.154 13.912 1.00 0.00 ATOM 823 CA ASP 123 28.702 36.242 13.087 1.00 0.00 ATOM 824 CB ASP 123 27.737 36.997 12.159 1.00 0.00 ATOM 825 CG ASP 123 28.260 38.226 11.384 1.00 0.00 ATOM 826 OD1 ASP 123 29.340 38.804 11.670 1.00 0.00 ATOM 827 OD2 ASP 123 27.434 38.753 10.621 1.00 0.00 ATOM 828 O ASP 123 29.600 35.324 11.018 1.00 0.00 ATOM 829 C ASP 123 29.453 35.231 12.228 1.00 0.00 ATOM 830 N ASN 124 30.119 34.310 12.920 1.00 0.00 ATOM 831 CA ASN 124 30.999 33.331 12.250 1.00 0.00 ATOM 832 CB ASN 124 30.199 32.208 11.615 1.00 0.00 ATOM 833 CG ASN 124 31.046 31.077 11.101 1.00 0.00 ATOM 834 ND2 ASN 124 30.605 30.488 10.019 1.00 0.00 ATOM 835 OD1 ASN 124 32.123 30.789 11.635 1.00 0.00 ATOM 836 O ASN 124 32.252 33.160 10.185 1.00 0.00 ATOM 837 C ASN 124 31.965 33.875 11.150 1.00 0.00 ATOM 838 N PRO 125 32.584 35.051 11.353 1.00 0.00 ATOM 839 CA PRO 125 33.396 35.712 10.320 1.00 0.00 ATOM 840 CB PRO 125 33.494 37.173 10.759 1.00 0.00 ATOM 841 CG PRO 125 32.329 37.268 11.737 1.00 0.00 ATOM 842 CD PRO 125 32.498 35.963 12.494 1.00 0.00 ATOM 843 O PRO 125 35.255 34.442 11.138 1.00 0.00 ATOM 844 C PRO 125 34.760 35.059 10.197 1.00 0.00 ATOM 845 N LYS 126 35.386 35.257 9.035 1.00 0.00 ATOM 846 CA LYS 126 36.729 34.707 8.758 1.00 0.00 ATOM 847 CB LYS 126 37.159 35.040 7.329 1.00 0.00 ATOM 848 CG LYS 126 37.430 36.517 7.080 1.00 0.00 ATOM 849 CD LYS 126 37.801 36.776 5.628 1.00 0.00 ATOM 850 CE LYS 126 38.099 38.247 5.385 1.00 0.00 ATOM 851 NZ LYS 126 38.472 38.514 3.970 1.00 0.00 ATOM 852 O LYS 126 38.940 34.577 9.705 1.00 0.00 ATOM 853 C LYS 126 37.863 35.159 9.686 1.00 0.00 ATOM 854 N GLU 127 37.623 36.257 10.387 1.00 0.00 ATOM 855 CA GLU 127 38.631 36.849 11.275 1.00 0.00 ATOM 856 CB GLU 127 38.665 38.370 11.108 1.00 0.00 ATOM 857 CG GLU 127 39.090 38.840 9.723 1.00 0.00 ATOM 858 CD GLU 127 39.086 40.341 9.631 1.00 0.00 ATOM 859 OE1 GLU 127 38.713 40.974 10.589 1.00 0.00 ATOM 860 OE2 GLU 127 39.560 40.857 8.647 1.00 0.00 ATOM 861 O GLU 127 39.193 36.802 13.631 1.00 0.00 ATOM 862 C GLU 127 38.388 36.506 12.745 1.00 0.00 ATOM 863 N ARG 128 37.207 35.944 13.010 1.00 0.00 ATOM 864 CA ARG 128 36.860 35.476 14.345 1.00 0.00 ATOM 865 CB ARG 128 35.355 35.391 14.551 1.00 0.00 ATOM 866 CG ARG 128 34.923 34.976 15.948 1.00 0.00 ATOM 867 CD ARG 128 33.453 34.862 16.125 1.00 0.00 ATOM 868 NE ARG 128 33.033 34.532 17.478 1.00 0.00 ATOM 869 CZ ARG 128 32.912 35.426 18.480 1.00 0.00 ATOM 870 NH1 ARG 128 33.213 36.692 18.298 1.00 0.00 ATOM 871 NH2 ARG 128 32.505 34.989 19.659 1.00 0.00 ATOM 872 O ARG 128 37.058 33.096 14.240 1.00 0.00 ATOM 873 C ARG 128 37.555 34.138 14.643 1.00 0.00 ATOM 874 N GLY 129 38.402 34.222 15.660 1.00 0.00 ATOM 875 CA GLY 129 38.938 33.012 16.314 1.00 0.00 ATOM 876 O GLY 129 37.120 31.388 16.369 1.00 0.00 ATOM 877 C GLY 129 37.774 32.245 16.966 1.00 0.00 ATOM 878 N PHE 130 37.255 32.941 17.965 1.00 0.00 ATOM 879 CA PHE 130 36.209 32.484 18.895 1.00 0.00 ATOM 880 CB PHE 130 37.005 31.776 19.987 1.00 0.00 ATOM 881 CG PHE 130 37.353 30.300 20.011 1.00 0.00 ATOM 882 CD1 PHE 130 37.346 29.448 18.918 1.00 0.00 ATOM 883 CD2 PHE 130 37.905 29.903 21.217 1.00 0.00 ATOM 884 CE1 PHE 130 37.921 28.187 19.041 1.00 0.00 ATOM 885 CE2 PHE 130 38.490 28.654 21.333 1.00 0.00 ATOM 886 CZ PHE 130 38.493 27.790 20.249 1.00 0.00 ATOM 887 O PHE 130 35.827 34.858 19.070 1.00 0.00 ATOM 888 C PHE 130 35.621 33.742 19.559 1.00 0.00 ATOM 889 N TRP 131 34.928 33.582 20.684 1.00 0.00 ATOM 890 CA TRP 131 35.280 34.405 21.871 1.00 0.00 ATOM 891 CB TRP 131 34.256 34.364 23.013 1.00 0.00 ATOM 892 CG TRP 131 32.889 34.909 22.632 1.00 0.00 ATOM 893 CD1 TRP 131 31.992 34.263 21.902 1.00 0.00 ATOM 894 CD2 TRP 131 32.294 36.087 23.044 1.00 0.00 ATOM 895 CE2 TRP 131 31.021 36.083 22.510 1.00 0.00 ATOM 896 CE3 TRP 131 32.731 37.162 23.818 1.00 0.00 ATOM 897 NE1 TRP 131 30.849 34.944 21.850 1.00 0.00 ATOM 898 CZ2 TRP 131 30.157 37.140 22.717 1.00 0.00 ATOM 899 CZ3 TRP 131 31.866 38.226 24.037 1.00 0.00 ATOM 900 CH2 TRP 131 30.584 38.226 23.483 1.00 0.00 ATOM 901 O TRP 131 36.566 32.631 22.837 1.00 0.00 ATOM 902 C TRP 131 36.555 33.803 22.470 1.00 0.00 ATOM 903 N TYR 132 37.624 34.582 22.430 1.00 0.00 ATOM 904 CA TYR 132 38.976 34.083 22.737 1.00 0.00 ATOM 905 CB TYR 132 39.902 34.580 21.615 1.00 0.00 ATOM 906 CG TYR 132 41.137 33.691 21.445 1.00 0.00 ATOM 907 CD1 TYR 132 42.291 33.941 22.167 1.00 0.00 ATOM 908 CD2 TYR 132 41.142 32.700 20.477 1.00 0.00 ATOM 909 CE1 TYR 132 43.440 33.210 21.923 1.00 0.00 ATOM 910 CE2 TYR 132 42.291 31.969 20.233 1.00 0.00 ATOM 911 CZ TYR 132 43.446 32.219 20.955 1.00 0.00 ATOM 912 OH TYR 132 44.463 31.322 20.914 1.00 0.00 ATOM 913 O TYR 132 39.140 35.675 24.538 1.00 0.00 ATOM 914 C TYR 132 39.476 34.573 24.098 1.00 0.00 ATOM 915 N ASP 133 40.370 33.768 24.684 1.00 0.00 ATOM 916 CA ASP 133 41.076 34.131 25.927 1.00 0.00 ATOM 917 CB ASP 133 41.439 32.876 26.723 1.00 0.00 ATOM 918 CG ASP 133 42.121 33.152 28.057 1.00 0.00 ATOM 919 OD1 ASP 133 42.407 34.293 28.330 1.00 0.00 ATOM 920 OD2 ASP 133 42.208 32.250 28.855 1.00 0.00 ATOM 921 O ASP 133 43.266 34.521 24.945 1.00 0.00 ATOM 922 C ASP 133 42.330 34.943 25.637 1.00 0.00 ATOM 923 N ALA 134 42.284 36.174 26.101 1.00 0.00 ATOM 924 CA ALA 134 43.300 37.196 25.781 1.00 0.00 ATOM 925 CB ALA 134 42.724 38.142 24.731 1.00 0.00 ATOM 926 O ALA 134 43.182 38.002 28.054 1.00 0.00 ATOM 927 C ALA 134 43.801 37.994 26.992 1.00 0.00 ATOM 928 N GLU 135 44.852 38.755 26.752 1.00 0.00 ATOM 929 CA GLU 135 45.415 39.661 27.744 1.00 0.00 ATOM 930 CB GLU 135 46.828 39.218 28.131 1.00 0.00 ATOM 931 CG GLU 135 46.892 37.879 28.852 1.00 0.00 ATOM 932 CD GLU 135 48.303 37.534 29.238 1.00 0.00 ATOM 933 OE1 GLU 135 49.186 38.302 28.939 1.00 0.00 ATOM 934 OE2 GLU 135 48.487 36.560 29.930 1.00 0.00 ATOM 935 O GLU 135 45.683 41.300 25.997 1.00 0.00 ATOM 936 C GLU 135 45.417 41.078 27.184 1.00 0.00 ATOM 937 N ILE 136 45.096 42.027 28.054 1.00 0.00 ATOM 938 CA ILE 136 45.057 43.446 27.677 1.00 0.00 ATOM 939 CB ILE 136 44.036 44.227 28.523 1.00 0.00 ATOM 940 CG1 ILE 136 42.637 43.628 28.360 1.00 0.00 ATOM 941 CG2 ILE 136 44.037 45.698 28.133 1.00 0.00 ATOM 942 CD1 ILE 136 41.613 44.197 29.314 1.00 0.00 ATOM 943 O ILE 136 46.803 44.586 28.887 1.00 0.00 ATOM 944 C ILE 136 46.474 44.016 27.857 1.00 0.00 ATOM 945 N SER 137 47.224 43.973 26.774 1.00 0.00 ATOM 946 CA SER 137 48.593 44.503 26.708 1.00 0.00 ATOM 947 CB SER 137 49.193 44.232 25.342 1.00 0.00 ATOM 948 OG SER 137 50.494 44.739 25.227 1.00 0.00 ATOM 949 O SER 137 49.556 46.493 27.706 1.00 0.00 ATOM 950 C SER 137 48.658 46.013 27.011 1.00 0.00 ATOM 951 N ARG 138 47.768 46.751 26.360 1.00 0.00 ATOM 952 CA ARG 138 47.798 48.218 26.387 1.00 0.00 ATOM 953 CB ARG 138 48.434 48.802 25.133 1.00 0.00 ATOM 954 CG ARG 138 49.872 48.373 24.888 1.00 0.00 ATOM 955 CD ARG 138 50.871 49.058 25.749 1.00 0.00 ATOM 956 NE ARG 138 52.238 48.595 25.571 1.00 0.00 ATOM 957 CZ ARG 138 53.267 48.924 26.375 1.00 0.00 ATOM 958 NH1 ARG 138 53.100 49.745 27.388 1.00 0.00 ATOM 959 NH2 ARG 138 54.458 48.417 26.104 1.00 0.00 ATOM 960 O ARG 138 45.516 48.646 25.868 1.00 0.00 ATOM 961 C ARG 138 46.458 48.899 26.620 1.00 0.00 ATOM 962 N LYS 139 46.514 49.960 27.401 1.00 0.00 ATOM 963 CA LYS 139 45.335 50.793 27.645 1.00 0.00 ATOM 964 CB LYS 139 44.907 50.700 29.110 1.00 0.00 ATOM 965 CG LYS 139 43.658 51.501 29.452 1.00 0.00 ATOM 966 CD LYS 139 43.255 51.304 30.906 1.00 0.00 ATOM 967 CE LYS 139 42.012 52.110 31.251 1.00 0.00 ATOM 968 NZ LYS 139 41.615 51.938 32.676 1.00 0.00 ATOM 969 O LYS 139 46.598 52.823 27.737 1.00 0.00 ATOM 970 C LYS 139 45.628 52.235 27.261 1.00 0.00 ATOM 971 N ARG 140 45.009 52.649 26.167 1.00 0.00 ATOM 972 CA ARG 140 45.196 54.028 25.692 1.00 0.00 ATOM 973 CB ARG 140 45.791 54.078 24.293 1.00 0.00 ATOM 974 CG ARG 140 47.220 53.566 24.186 1.00 0.00 ATOM 975 CD ARG 140 47.791 53.627 22.817 1.00 0.00 ATOM 976 NE ARG 140 49.167 53.170 22.718 1.00 0.00 ATOM 977 CZ ARG 140 49.877 53.120 21.574 1.00 0.00 ATOM 978 NH1 ARG 140 49.336 53.464 20.426 1.00 0.00 ATOM 979 NH2 ARG 140 51.127 52.695 21.632 1.00 0.00 ATOM 980 O ARG 140 42.819 54.301 25.422 1.00 0.00 ATOM 981 C ARG 140 43.885 54.801 25.783 1.00 0.00 ATOM 982 N GLU 141 44.057 56.014 26.285 1.00 0.00 ATOM 983 CA GLU 141 42.976 56.997 26.402 1.00 0.00 ATOM 984 CB GLU 141 42.834 57.466 27.851 1.00 0.00 ATOM 985 CG GLU 141 41.707 58.463 28.082 1.00 0.00 ATOM 986 CD GLU 141 41.628 58.873 29.526 1.00 0.00 ATOM 987 OE1 GLU 141 42.439 58.423 30.298 1.00 0.00 ATOM 988 OE2 GLU 141 40.826 59.722 29.838 1.00 0.00 ATOM 989 O GLU 141 44.382 58.732 25.478 1.00 0.00 ATOM 990 C GLU 141 43.287 58.159 25.458 1.00 0.00 ATOM 991 N THR 142 42.347 58.398 24.555 1.00 0.00 ATOM 992 CA THR 142 42.499 59.485 23.576 1.00 0.00 ATOM 993 CB THR 142 42.851 58.932 22.189 1.00 0.00 ATOM 994 CG2 THR 142 43.034 60.067 21.180 1.00 0.00 ATOM 995 OG1 THR 142 44.060 58.185 22.313 1.00 0.00 ATOM 996 O THR 142 40.122 59.761 23.675 1.00 0.00 ATOM 997 C THR 142 41.203 60.298 23.574 1.00 0.00 ATOM 998 N ARG 143 41.365 61.583 23.354 1.00 0.00 ATOM 999 CA ARG 143 40.234 62.523 23.285 1.00 0.00 ATOM 1000 CB ARG 143 40.593 63.893 23.841 1.00 0.00 ATOM 1001 CG ARG 143 40.858 63.927 25.338 1.00 0.00 ATOM 1002 CD ARG 143 41.246 65.262 25.861 1.00 0.00 ATOM 1003 NE ARG 143 41.501 65.297 27.292 1.00 0.00 ATOM 1004 CZ ARG 143 41.936 66.381 27.965 1.00 0.00 ATOM 1005 NH1 ARG 143 42.202 67.505 27.339 1.00 0.00 ATOM 1006 NH2 ARG 143 42.111 66.275 29.271 1.00 0.00 ATOM 1007 O ARG 143 38.501 62.975 21.697 1.00 0.00 ATOM 1008 C ARG 143 39.661 62.646 21.876 1.00 0.00 ATOM 1009 N THR 144 40.565 62.568 20.907 1.00 0.00 ATOM 1010 CA THR 144 40.171 62.480 19.484 1.00 0.00 ATOM 1011 CB THR 144 41.394 62.274 18.571 1.00 0.00 ATOM 1012 CG2 THR 144 40.958 62.133 17.120 1.00 0.00 ATOM 1013 OG1 THR 144 42.279 63.394 18.694 1.00 0.00 ATOM 1014 O THR 144 38.142 61.540 18.720 1.00 0.00 ATOM 1015 C THR 144 39.180 61.328 19.307 1.00 0.00 ATOM 1016 N ALA 145 39.388 60.297 20.124 1.00 0.00 ATOM 1017 CA ALA 145 38.465 59.155 20.188 1.00 0.00 ATOM 1018 CB ALA 145 39.350 57.928 20.305 1.00 0.00 ATOM 1019 O ALA 145 36.271 58.858 21.066 1.00 0.00 ATOM 1020 C ALA 145 37.413 59.222 21.300 1.00 0.00 ATOM 1021 N ARG 146 37.774 59.763 22.469 1.00 0.00 ATOM 1022 CA ARG 146 36.965 59.771 23.715 1.00 0.00 ATOM 1023 CB ARG 146 35.782 60.725 23.626 1.00 0.00 ATOM 1024 CG ARG 146 36.155 62.194 23.503 1.00 0.00 ATOM 1025 CD ARG 146 35.020 63.132 23.705 1.00 0.00 ATOM 1026 NE ARG 146 34.014 63.096 22.655 1.00 0.00 ATOM 1027 CZ ARG 146 32.747 63.534 22.793 1.00 0.00 ATOM 1028 NH1 ARG 146 32.316 64.006 23.942 1.00 0.00 ATOM 1029 NH2 ARG 146 31.942 63.455 21.750 1.00 0.00 ATOM 1030 O ARG 146 35.693 58.306 25.155 1.00 0.00 ATOM 1031 C ARG 146 36.458 58.400 24.194 1.00 0.00 ATOM 1032 N GLU 147 37.246 57.445 23.749 1.00 0.00 ATOM 1033 CA GLU 147 36.985 56.016 23.923 1.00 0.00 ATOM 1034 CB GLU 147 36.381 55.424 22.648 1.00 0.00 ATOM 1035 CG GLU 147 35.052 56.041 22.236 1.00 0.00 ATOM 1036 CD GLU 147 33.941 55.610 23.152 1.00 0.00 ATOM 1037 OE1 GLU 147 34.144 54.693 23.910 1.00 0.00 ATOM 1038 OE2 GLU 147 32.927 56.266 23.172 1.00 0.00 ATOM 1039 O GLU 147 39.386 55.758 23.931 1.00 0.00 ATOM 1040 C GLU 147 38.292 55.340 24.293 1.00 0.00 ATOM 1041 N LEU 148 38.097 54.360 25.149 1.00 0.00 ATOM 1042 CA LEU 148 39.215 53.580 25.671 1.00 0.00 ATOM 1043 CB LEU 148 38.909 53.103 27.096 1.00 0.00 ATOM 1044 CG LEU 148 38.918 54.201 28.167 1.00 0.00 ATOM 1045 CD1 LEU 148 38.741 53.584 29.549 1.00 0.00 ATOM 1046 CD2 LEU 148 40.223 54.979 28.087 1.00 0.00 ATOM 1047 O LEU 148 38.618 51.596 24.407 1.00 0.00 ATOM 1048 C LEU 148 39.458 52.422 24.722 1.00 0.00 ATOM 1049 N TYR 149 40.727 52.292 24.397 1.00 0.00 ATOM 1050 CA TYR 149 41.166 51.179 23.530 1.00 0.00 ATOM 1051 CB TYR 149 41.869 51.683 22.274 1.00 0.00 ATOM 1052 CG TYR 149 40.942 52.500 21.392 1.00 0.00 ATOM 1053 CD1 TYR 149 40.765 53.843 21.708 1.00 0.00 ATOM 1054 CD2 TYR 149 40.328 51.969 20.272 1.00 0.00 ATOM 1055 CE1 TYR 149 39.962 54.629 20.929 1.00 0.00 ATOM 1056 CE2 TYR 149 39.527 52.770 19.466 1.00 0.00 ATOM 1057 CZ TYR 149 39.348 54.095 19.819 1.00 0.00 ATOM 1058 OH TYR 149 38.593 54.915 19.070 1.00 0.00 ATOM 1059 O TYR 149 42.898 50.724 25.128 1.00 0.00 ATOM 1060 C TYR 149 42.099 50.263 24.299 1.00 0.00 ATOM 1061 N ALA 150 42.021 49.009 23.896 1.00 0.00 ATOM 1062 CA ALA 150 42.823 47.912 24.455 1.00 0.00 ATOM 1063 CB ALA 150 41.908 46.879 25.116 1.00 0.00 ATOM 1064 O ALA 150 43.048 46.700 22.368 1.00 0.00 ATOM 1065 C ALA 150 43.600 47.210 23.347 1.00 0.00 ATOM 1066 N ASN 151 44.916 47.262 23.462 1.00 0.00 ATOM 1067 CA ASN 151 45.759 46.463 22.572 1.00 0.00 ATOM 1068 CB ASN 151 47.061 47.175 22.253 1.00 0.00 ATOM 1069 CG ASN 151 47.957 46.409 21.320 1.00 0.00 ATOM 1070 ND2 ASN 151 49.230 46.707 21.389 1.00 0.00 ATOM 1071 OD1 ASN 151 47.513 45.507 20.601 1.00 0.00 ATOM 1072 O ASN 151 46.309 45.060 24.425 1.00 0.00 ATOM 1073 C ASN 151 45.992 45.104 23.249 1.00 0.00 ATOM 1074 N VAL 152 45.633 44.048 22.534 1.00 0.00 ATOM 1075 CA VAL 152 45.509 42.702 23.142 1.00 0.00 ATOM 1076 CB VAL 152 44.042 42.235 23.188 1.00 0.00 ATOM 1077 CG1 VAL 152 43.214 43.167 24.060 1.00 0.00 ATOM 1078 CG2 VAL 152 43.461 42.165 21.785 1.00 0.00 ATOM 1079 O VAL 152 46.478 41.643 21.211 1.00 0.00 ATOM 1080 C VAL 152 46.311 41.608 22.433 1.00 0.00 ATOM 1081 N VAL 153 46.790 40.681 23.246 1.00 0.00 ATOM 1082 CA VAL 153 47.457 39.454 22.777 1.00 0.00 ATOM 1083 CB VAL 153 48.809 39.217 23.489 1.00 0.00 ATOM 1084 CG1 VAL 153 49.473 37.899 23.062 1.00 0.00 ATOM 1085 CG2 VAL 153 49.755 40.377 23.194 1.00 0.00 ATOM 1086 O VAL 153 46.029 38.130 24.177 1.00 0.00 ATOM 1087 C VAL 153 46.532 38.277 23.059 1.00 0.00 ATOM 1088 N LEU 154 46.294 37.530 21.996 1.00 0.00 ATOM 1089 CA LEU 154 45.577 36.247 22.103 1.00 0.00 ATOM 1090 CB LEU 154 45.111 35.783 20.717 1.00 0.00 ATOM 1091 CG LEU 154 43.878 36.509 20.166 1.00 0.00 ATOM 1092 CD1 LEU 154 44.099 38.015 20.205 1.00 0.00 ATOM 1093 CD2 LEU 154 43.604 36.039 18.745 1.00 0.00 ATOM 1094 O LEU 154 47.578 34.952 22.320 1.00 0.00 ATOM 1095 C LEU 154 46.455 35.182 22.756 1.00 0.00 ATOM 1096 N GLY 155 45.978 34.683 23.893 1.00 0.00 ATOM 1097 CA GLY 155 46.669 33.624 24.659 1.00 0.00 ATOM 1098 O GLY 155 45.991 31.968 23.102 1.00 0.00 ATOM 1099 C GLY 155 46.918 32.399 23.789 1.00 0.00 ATOM 1100 N ASP 156 48.172 31.983 23.699 1.00 0.00 ATOM 1101 CA ASP 156 48.640 30.847 22.849 1.00 0.00 ATOM 1102 CB ASP 156 47.862 29.572 23.183 1.00 0.00 ATOM 1103 CG ASP 156 48.071 29.059 24.601 1.00 0.00 ATOM 1104 OD1 ASP 156 49.203 28.928 25.004 1.00 0.00 ATOM 1105 OD2 ASP 156 47.108 28.954 25.321 1.00 0.00 ATOM 1106 O ASP 156 48.481 30.234 20.530 1.00 0.00 ATOM 1107 C ASP 156 48.513 31.142 21.359 1.00 0.00 ATOM 1108 N ASP 157 48.590 32.416 21.040 1.00 0.00 ATOM 1109 CA ASP 157 48.629 32.864 19.653 1.00 0.00 ATOM 1110 CB ASP 157 47.297 33.504 19.258 1.00 0.00 ATOM 1111 CG ASP 157 47.147 33.777 17.767 1.00 0.00 ATOM 1112 OD1 ASP 157 48.018 33.393 17.023 1.00 0.00 ATOM 1113 OD2 ASP 157 46.097 34.222 17.368 1.00 0.00 ATOM 1114 O ASP 157 50.140 34.634 20.297 1.00 0.00 ATOM 1115 C ASP 157 49.760 33.833 19.441 1.00 0.00 ATOM 1116 N SER 158 50.363 33.664 18.271 1.00 0.00 ATOM 1117 CA SER 158 51.523 34.469 17.873 1.00 0.00 ATOM 1118 CB SER 158 51.923 34.138 16.449 1.00 0.00 ATOM 1119 OG SER 158 52.988 34.931 16.002 1.00 0.00 ATOM 1120 O SER 158 50.107 36.401 17.650 1.00 0.00 ATOM 1121 C SER 158 51.185 35.958 18.026 1.00 0.00 ATOM 1122 N LEU 159 52.166 36.718 18.509 1.00 0.00 ATOM 1123 CA LEU 159 51.997 38.171 18.695 1.00 0.00 ATOM 1124 CB LEU 159 53.283 38.786 19.261 1.00 0.00 ATOM 1125 CG LEU 159 53.637 38.357 20.691 1.00 0.00 ATOM 1126 CD1 LEU 159 54.994 38.925 21.086 1.00 0.00 ATOM 1127 CD2 LEU 159 52.554 38.832 21.648 1.00 0.00 ATOM 1128 O LEU 159 51.003 39.970 17.516 1.00 0.00 ATOM 1129 C LEU 159 51.611 38.920 17.420 1.00 0.00 ATOM 1130 N ASN 160 51.859 38.294 16.277 1.00 0.00 ATOM 1131 CA ASN 160 51.453 38.893 14.989 1.00 0.00 ATOM 1132 CB ASN 160 51.860 38.017 13.817 1.00 0.00 ATOM 1133 CG ASN 160 53.336 38.035 13.532 1.00 0.00 ATOM 1134 ND2 ASN 160 53.771 37.078 12.752 1.00 0.00 ATOM 1135 OD1 ASN 160 54.060 38.944 13.954 1.00 0.00 ATOM 1136 O ASN 160 49.598 40.289 14.495 1.00 0.00 ATOM 1137 C ASN 160 49.948 39.183 14.894 1.00 0.00 ATOM 1138 N ASP 161 49.153 38.386 15.602 1.00 0.00 ATOM 1139 CA ASP 161 47.688 38.611 15.670 1.00 0.00 ATOM 1140 CB ASP 161 46.957 37.290 15.860 1.00 0.00 ATOM 1141 CG ASP 161 47.000 36.436 14.586 1.00 0.00 ATOM 1142 OD1 ASP 161 47.294 36.957 13.484 1.00 0.00 ATOM 1143 OD2 ASP 161 46.594 35.264 14.703 1.00 0.00 ATOM 1144 O ASP 161 46.040 39.903 16.875 1.00 0.00 ATOM 1145 C ASP 161 47.228 39.631 16.731 1.00 0.00 ATOM 1146 N CYS 162 48.193 40.165 17.461 1.00 0.00 ATOM 1147 CA CYS 162 47.959 41.258 18.427 1.00 0.00 ATOM 1148 CB CYS 162 49.248 41.723 19.100 1.00 0.00 ATOM 1149 SG CYS 162 48.953 43.074 20.292 1.00 0.00 ATOM 1150 O CYS 162 47.719 42.848 16.612 1.00 0.00 ATOM 1151 C CYS 162 47.306 42.442 17.700 1.00 0.00 ATOM 1152 N ARG 163 46.264 42.948 18.333 1.00 0.00 ATOM 1153 CA ARG 163 45.373 43.959 17.740 1.00 0.00 ATOM 1154 CB ARG 163 44.222 43.329 16.968 1.00 0.00 ATOM 1155 CG ARG 163 44.632 42.579 15.710 1.00 0.00 ATOM 1156 CD ARG 163 43.494 42.039 14.922 1.00 0.00 ATOM 1157 NE ARG 163 43.879 41.357 13.697 1.00 0.00 ATOM 1158 CZ ARG 163 43.013 40.847 12.800 1.00 0.00 ATOM 1159 NH1 ARG 163 41.715 40.905 13.004 1.00 0.00 ATOM 1160 NH2 ARG 163 43.503 40.264 11.720 1.00 0.00 ATOM 1161 O ARG 163 44.756 44.651 19.961 1.00 0.00 ATOM 1162 C ARG 163 44.844 44.957 18.761 1.00 0.00 ATOM 1163 N ILE 164 44.430 46.117 18.247 1.00 0.00 ATOM 1164 CA ILE 164 43.753 47.148 19.062 1.00 0.00 ATOM 1165 CB ILE 164 44.157 48.569 18.627 1.00 0.00 ATOM 1166 CG1 ILE 164 45.661 48.777 18.816 1.00 0.00 ATOM 1167 CG2 ILE 164 43.370 49.609 19.411 1.00 0.00 ATOM 1168 CD1 ILE 164 46.183 50.055 18.201 1.00 0.00 ATOM 1169 O ILE 164 41.706 46.965 17.813 1.00 0.00 ATOM 1170 C ILE 164 42.237 46.929 18.910 1.00 0.00 ATOM 1171 N ILE 165 41.583 46.806 20.056 1.00 0.00 ATOM 1172 CA ILE 165 40.125 46.602 20.125 1.00 0.00 ATOM 1173 CB ILE 165 39.776 45.162 20.545 1.00 0.00 ATOM 1174 CG1 ILE 165 40.509 44.154 19.656 1.00 0.00 ATOM 1175 CG2 ILE 165 38.272 44.940 20.480 1.00 0.00 ATOM 1176 CD1 ILE 165 40.056 44.168 18.214 1.00 0.00 ATOM 1177 O ILE 165 40.126 47.913 22.134 1.00 0.00 ATOM 1178 C ILE 165 39.518 47.596 21.111 1.00 0.00 ATOM 1179 N PHE 166 38.319 48.064 20.764 1.00 0.00 ATOM 1180 CA PHE 166 37.522 48.862 21.708 1.00 0.00 ATOM 1181 CB PHE 166 36.195 49.298 21.122 1.00 0.00 ATOM 1182 CG PHE 166 36.417 50.444 20.159 1.00 0.00 ATOM 1183 CD1 PHE 166 36.192 51.729 20.603 1.00 0.00 ATOM 1184 CD2 PHE 166 36.688 50.175 18.827 1.00 0.00 ATOM 1185 CE1 PHE 166 36.199 52.740 19.692 1.00 0.00 ATOM 1186 CE2 PHE 166 36.705 51.218 17.913 1.00 0.00 ATOM 1187 CZ PHE 166 36.441 52.503 18.355 1.00 0.00 ATOM 1188 O PHE 166 37.073 46.787 22.859 1.00 0.00 ATOM 1189 C PHE 166 37.169 48.011 22.920 1.00 0.00 ATOM 1190 N VAL 167 36.954 48.717 24.020 1.00 0.00 ATOM 1191 CA VAL 167 36.580 48.040 25.279 1.00 0.00 ATOM 1192 CB VAL 167 36.435 49.043 26.438 1.00 0.00 ATOM 1193 CG1 VAL 167 35.736 48.390 27.622 1.00 0.00 ATOM 1194 CG2 VAL 167 37.798 49.576 26.854 1.00 0.00 ATOM 1195 O VAL 167 35.145 46.196 25.800 1.00 0.00 ATOM 1196 C VAL 167 35.258 47.241 25.168 1.00 0.00 ATOM 1197 N ASP 168 34.370 47.636 24.250 1.00 0.00 ATOM 1198 CA ASP 168 33.050 46.996 24.111 1.00 0.00 ATOM 1199 CB ASP 168 32.166 47.792 23.147 1.00 0.00 ATOM 1200 CG ASP 168 31.658 49.114 23.706 1.00 0.00 ATOM 1201 OD1 ASP 168 31.780 49.322 24.891 1.00 0.00 ATOM 1202 OD2 ASP 168 31.300 49.965 22.928 1.00 0.00 ATOM 1203 O ASP 168 32.184 44.739 23.891 1.00 0.00 ATOM 1204 C ASP 168 33.085 45.534 23.629 1.00 0.00 ATOM 1205 N GLU 169 34.206 45.153 23.038 1.00 0.00 ATOM 1206 CA GLU 169 34.442 43.770 22.573 1.00 0.00 ATOM 1207 CB GLU 169 35.147 43.774 21.215 1.00 0.00 ATOM 1208 CG GLU 169 34.377 44.483 20.109 1.00 0.00 ATOM 1209 CD GLU 169 33.024 43.863 19.901 1.00 0.00 ATOM 1210 OE1 GLU 169 32.957 42.668 19.742 1.00 0.00 ATOM 1211 OE2 GLU 169 32.046 44.565 20.014 1.00 0.00 ATOM 1212 O GLU 169 35.425 41.726 23.362 1.00 0.00 ATOM 1213 C GLU 169 35.263 42.931 23.557 1.00 0.00 ATOM 1214 N VAL 170 35.730 43.564 24.629 1.00 0.00 ATOM 1215 CA VAL 170 36.509 42.883 25.685 1.00 0.00 ATOM 1216 CB VAL 170 37.711 43.707 26.163 1.00 0.00 ATOM 1217 CG1 VAL 170 38.578 42.812 27.025 1.00 0.00 ATOM 1218 CG2 VAL 170 38.557 44.344 25.056 1.00 0.00 ATOM 1219 O VAL 170 35.064 43.580 27.482 1.00 0.00 ATOM 1220 C VAL 170 35.580 42.646 26.883 1.00 0.00 ATOM 1221 N PHE 171 35.605 41.403 27.347 1.00 0.00 ATOM 1222 CA PHE 171 34.866 40.955 28.531 1.00 0.00 ATOM 1223 CB PHE 171 33.779 39.934 28.120 1.00 0.00 ATOM 1224 CG PHE 171 33.080 39.225 29.282 1.00 0.00 ATOM 1225 CD1 PHE 171 32.739 39.891 30.469 1.00 0.00 ATOM 1226 CD2 PHE 171 32.873 37.860 29.206 1.00 0.00 ATOM 1227 CE1 PHE 171 32.224 39.209 31.555 1.00 0.00 ATOM 1228 CE2 PHE 171 32.337 37.176 30.300 1.00 0.00 ATOM 1229 CZ PHE 171 32.008 37.837 31.467 1.00 0.00 ATOM 1230 O PHE 171 36.672 39.542 29.203 1.00 0.00 ATOM 1231 C PHE 171 35.807 40.330 29.568 1.00 0.00 ATOM 1232 N LYS 172 35.509 40.560 30.838 1.00 0.00 ATOM 1233 CA LYS 172 36.154 39.846 31.952 1.00 0.00 ATOM 1234 CB LYS 172 35.512 40.239 33.283 1.00 0.00 ATOM 1235 CG LYS 172 36.154 39.595 34.505 1.00 0.00 ATOM 1236 CD LYS 172 35.498 40.073 35.792 1.00 0.00 ATOM 1237 CE LYS 172 36.118 39.407 37.011 1.00 0.00 ATOM 1238 NZ LYS 172 35.464 39.842 38.275 1.00 0.00 ATOM 1239 O LYS 172 35.041 37.790 31.310 1.00 0.00 ATOM 1240 C LYS 172 36.064 38.327 31.737 1.00 0.00 ATOM 1241 N ILE 173 37.118 37.654 32.135 1.00 0.00 ATOM 1242 CA ILE 173 37.171 36.188 32.062 1.00 0.00 ATOM 1243 CB ILE 173 38.618 35.793 31.732 1.00 0.00 ATOM 1244 CG1 ILE 173 38.586 34.537 30.859 1.00 0.00 ATOM 1245 CG2 ILE 173 39.543 35.582 32.937 1.00 0.00 ATOM 1246 CD1 ILE 173 39.808 34.480 29.943 1.00 0.00 ATOM 1247 O ILE 173 37.081 35.913 34.415 1.00 0.00 ATOM 1248 C ILE 173 36.546 35.616 33.349 1.00 0.00 ATOM 1249 N GLU 174 35.257 35.314 33.253 1.00 0.00 ATOM 1250 CA GLU 174 34.441 34.787 34.375 1.00 0.00 ATOM 1251 CB GLU 174 32.953 34.813 34.015 1.00 0.00 ATOM 1252 CG GLU 174 32.027 34.351 35.131 1.00 0.00 ATOM 1253 CD GLU 174 30.584 34.461 34.724 1.00 0.00 ATOM 1254 OE1 GLU 174 30.328 34.891 33.625 1.00 0.00 ATOM 1255 OE2 GLU 174 29.743 34.013 35.466 1.00 0.00 ATOM 1256 O GLU 174 34.863 32.987 35.931 1.00 0.00 ATOM 1257 C GLU 174 34.849 33.355 34.770 1.00 0.00 ATOM 1258 N ARG 175 35.139 32.563 33.738 1.00 0.00 ATOM 1259 CA ARG 175 35.622 31.178 33.870 1.00 0.00 ATOM 1260 CB ARG 175 34.608 30.165 33.359 1.00 0.00 ATOM 1261 CG ARG 175 33.306 30.112 34.142 1.00 0.00 ATOM 1262 CD ARG 175 32.301 29.165 33.595 1.00 0.00 ATOM 1263 NE ARG 175 31.066 29.091 34.359 1.00 0.00 ATOM 1264 CZ ARG 175 29.977 28.388 33.987 1.00 0.00 ATOM 1265 NH1 ARG 175 29.952 27.731 32.849 1.00 0.00 ATOM 1266 NH2 ARG 175 28.925 28.397 34.787 1.00 0.00 ATOM 1267 O ARG 175 37.229 31.759 32.220 1.00 0.00 ATOM 1268 C ARG 175 36.991 31.033 33.179 1.00 0.00 ATOM 1269 N PRO 176 37.829 30.096 33.662 1.00 0.00 ATOM 1270 CA PRO 176 39.076 29.758 32.964 1.00 0.00 ATOM 1271 CB PRO 176 39.742 28.698 33.831 1.00 0.00 ATOM 1272 CG PRO 176 38.611 28.080 34.650 1.00 0.00 ATOM 1273 CD PRO 176 37.628 29.232 34.839 1.00 0.00 ATOM 1274 O PRO 176 37.612 28.963 31.239 1.00 0.00 ATOM 1275 C PRO 176 38.808 29.216 31.565 1.00 0.00 TER END