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 4 Sun Jul 13 16:58:04 2008 MODEL 4 PARENT N/A ATOM 1 N GLU 22 25.908 33.977 34.405 1.00 0.00 ATOM 2 CA GLU 22 25.854 33.371 35.739 1.00 0.00 ATOM 3 CB GLU 22 27.128 33.752 36.526 1.00 0.00 ATOM 4 CG GLU 22 27.298 35.193 37.016 1.00 0.00 ATOM 5 CD GLU 22 27.286 36.173 35.857 1.00 0.00 ATOM 6 OE1 GLU 22 27.966 35.901 34.834 1.00 0.00 ATOM 7 OE2 GLU 22 26.342 36.977 35.889 1.00 0.00 ATOM 8 O GLU 22 23.541 33.080 36.001 1.00 0.00 ATOM 9 C GLU 22 24.513 33.654 36.426 1.00 0.00 ATOM 10 N THR 23 24.472 34.610 37.353 1.00 0.00 ATOM 11 CA THR 23 23.271 35.025 38.103 1.00 0.00 ATOM 12 CB THR 23 23.687 35.868 39.311 1.00 0.00 ATOM 13 CG2 THR 23 22.514 36.231 40.221 1.00 0.00 ATOM 14 OG1 THR 23 24.571 35.062 40.044 1.00 0.00 ATOM 15 O THR 23 21.214 35.400 36.972 1.00 0.00 ATOM 16 C THR 23 22.354 35.829 37.190 1.00 0.00 ATOM 17 N GLU 24 22.916 36.854 36.543 1.00 0.00 ATOM 18 CA GLU 24 22.136 37.663 35.571 1.00 0.00 ATOM 19 CB GLU 24 22.910 38.902 35.142 1.00 0.00 ATOM 20 CG GLU 24 23.020 39.957 36.249 1.00 0.00 ATOM 21 CD GLU 24 23.855 41.187 35.859 1.00 0.00 ATOM 22 OE1 GLU 24 24.456 41.205 34.761 1.00 0.00 ATOM 23 OE2 GLU 24 23.867 42.113 36.697 1.00 0.00 ATOM 24 O GLU 24 20.805 37.127 33.614 1.00 0.00 ATOM 25 C GLU 24 21.743 36.832 34.350 1.00 0.00 ATOM 26 N LEU 25 22.475 35.738 34.204 1.00 0.00 ATOM 27 CA LEU 25 22.243 34.728 33.157 1.00 0.00 ATOM 28 CB LEU 25 23.555 34.456 32.429 1.00 0.00 ATOM 29 CG LEU 25 24.142 35.692 31.765 1.00 0.00 ATOM 30 CD1 LEU 25 25.530 35.352 31.238 1.00 0.00 ATOM 31 CD2 LEU 25 23.219 36.166 30.644 1.00 0.00 ATOM 32 O LEU 25 21.848 32.362 33.087 1.00 0.00 ATOM 33 C LEU 25 21.725 33.404 33.730 1.00 0.00 ATOM 34 N GLY 26 21.070 33.494 34.884 1.00 0.00 ATOM 35 CA GLY 26 20.518 32.310 35.536 1.00 0.00 ATOM 36 O GLY 26 19.256 30.545 34.494 1.00 0.00 ATOM 37 C GLY 26 19.390 31.742 34.691 1.00 0.00 ATOM 38 N LEU 27 18.593 32.679 34.166 1.00 0.00 ATOM 39 CA LEU 27 17.462 32.329 33.295 1.00 0.00 ATOM 40 CB LEU 27 16.190 33.065 33.741 1.00 0.00 ATOM 41 CG LEU 27 15.852 32.790 35.204 1.00 0.00 ATOM 42 CD1 LEU 27 14.588 33.554 35.533 1.00 0.00 ATOM 43 CD2 LEU 27 15.665 31.311 35.523 1.00 0.00 ATOM 44 O LEU 27 16.824 32.335 31.000 1.00 0.00 ATOM 45 C LEU 27 17.699 32.617 31.814 1.00 0.00 ATOM 46 N TYR 28 18.872 33.174 31.511 1.00 0.00 ATOM 47 CA TYR 28 19.309 33.471 30.140 1.00 0.00 ATOM 48 CB TYR 28 19.223 32.192 29.274 1.00 0.00 ATOM 49 CG TYR 28 20.032 31.067 29.942 1.00 0.00 ATOM 50 CD1 TYR 28 19.481 30.234 30.911 1.00 0.00 ATOM 51 CD2 TYR 28 21.406 31.097 29.809 1.00 0.00 ATOM 52 CE1 TYR 28 20.307 29.477 31.719 1.00 0.00 ATOM 53 CE2 TYR 28 22.231 30.340 30.617 1.00 0.00 ATOM 54 CZ TYR 28 21.693 29.514 31.585 1.00 0.00 ATOM 55 OH TYR 28 22.522 28.736 32.336 1.00 0.00 ATOM 56 O TYR 28 19.272 35.741 29.506 1.00 0.00 ATOM 57 C TYR 28 18.607 34.723 29.578 1.00 0.00 ATOM 58 N LYS 29 17.267 34.708 29.554 1.00 0.00 ATOM 59 CA LYS 29 16.397 35.795 29.057 1.00 0.00 ATOM 60 CB LYS 29 16.630 37.124 29.776 1.00 0.00 ATOM 61 CG LYS 29 16.264 37.050 31.259 1.00 0.00 ATOM 62 CD LYS 29 16.519 38.423 31.847 1.00 0.00 ATOM 63 CE LYS 29 16.117 38.490 33.307 1.00 0.00 ATOM 64 NZ LYS 29 16.378 39.844 33.798 1.00 0.00 ATOM 65 O LYS 29 17.455 35.831 26.868 1.00 0.00 ATOM 66 C LYS 29 16.457 36.040 27.541 1.00 0.00 ATOM 67 N VAL 30 15.311 36.521 27.059 1.00 0.00 ATOM 68 CA VAL 30 14.887 36.890 25.687 1.00 0.00 ATOM 69 CB VAL 30 13.576 37.716 25.764 1.00 0.00 ATOM 70 CG1 VAL 30 12.605 37.311 24.651 1.00 0.00 ATOM 71 CG2 VAL 30 12.852 37.817 27.112 1.00 0.00 ATOM 72 O VAL 30 15.576 37.560 23.500 1.00 0.00 ATOM 73 C VAL 30 15.807 37.673 24.698 1.00 0.00 ATOM 74 N ASN 31 16.665 38.590 25.162 1.00 0.00 ATOM 75 CA ASN 31 17.331 39.584 24.262 1.00 0.00 ATOM 76 CB ASN 31 16.946 41.003 24.630 1.00 0.00 ATOM 77 CG ASN 31 15.462 41.263 24.516 1.00 0.00 ATOM 78 ND2 ASN 31 14.922 41.552 25.662 1.00 0.00 ATOM 79 OD1 ASN 31 14.811 41.239 23.486 1.00 0.00 ATOM 80 O ASN 31 19.405 40.614 23.551 1.00 0.00 ATOM 81 C ASN 31 18.864 39.666 24.133 1.00 0.00 ATOM 82 N GLU 32 19.561 38.666 24.623 1.00 0.00 ATOM 83 CA GLU 32 21.032 38.672 24.622 1.00 0.00 ATOM 84 CB GLU 32 21.641 38.414 26.007 1.00 0.00 ATOM 85 CG GLU 32 21.235 39.439 27.062 1.00 0.00 ATOM 86 CD GLU 32 20.007 39.014 27.894 1.00 0.00 ATOM 87 OE1 GLU 32 19.148 38.248 27.394 1.00 0.00 ATOM 88 OE2 GLU 32 19.849 39.571 28.995 1.00 0.00 ATOM 89 O GLU 32 20.976 36.458 23.688 1.00 0.00 ATOM 90 C GLU 32 21.529 37.558 23.730 1.00 0.00 ATOM 91 N TYR 33 22.618 37.847 23.040 1.00 0.00 ATOM 92 CA TYR 33 23.257 36.840 22.194 1.00 0.00 ATOM 93 CB TYR 33 24.061 37.579 21.137 1.00 0.00 ATOM 94 CG TYR 33 23.154 38.301 20.135 1.00 0.00 ATOM 95 CD1 TYR 33 22.762 39.619 20.338 1.00 0.00 ATOM 96 CD2 TYR 33 22.703 37.637 19.000 1.00 0.00 ATOM 97 CE1 TYR 33 21.961 40.275 19.414 1.00 0.00 ATOM 98 CE2 TYR 33 21.900 38.283 18.077 1.00 0.00 ATOM 99 CZ TYR 33 21.520 39.610 18.288 1.00 0.00 ATOM 100 OH TYR 33 20.678 40.225 17.423 1.00 0.00 ATOM 101 O TYR 33 24.692 36.261 24.069 1.00 0.00 ATOM 102 C TYR 33 24.078 35.876 23.067 1.00 0.00 ATOM 103 N VAL 34 23.973 34.594 22.740 1.00 0.00 ATOM 104 CA VAL 34 24.654 33.532 23.505 1.00 0.00 ATOM 105 CB VAL 34 23.635 32.576 24.152 1.00 0.00 ATOM 106 CG1 VAL 34 22.718 33.396 25.064 1.00 0.00 ATOM 107 CG2 VAL 34 22.813 31.761 23.142 1.00 0.00 ATOM 108 O VAL 34 25.368 32.744 21.370 1.00 0.00 ATOM 109 C VAL 34 25.593 32.757 22.585 1.00 0.00 ATOM 110 N ASP 35 26.477 31.990 23.189 1.00 0.00 ATOM 111 CA ASP 35 27.278 31.048 22.416 1.00 0.00 ATOM 112 CB ASP 35 28.777 31.153 22.711 1.00 0.00 ATOM 113 CG ASP 35 29.377 32.511 22.332 1.00 0.00 ATOM 114 OD1 ASP 35 28.682 33.326 21.690 1.00 0.00 ATOM 115 OD2 ASP 35 30.492 32.767 22.834 1.00 0.00 ATOM 116 O ASP 35 26.301 29.387 23.870 1.00 0.00 ATOM 117 C ASP 35 26.751 29.652 22.748 1.00 0.00 ATOM 118 N ALA 36 26.724 28.831 21.720 1.00 0.00 ATOM 119 CA ALA 36 26.157 27.483 21.853 1.00 0.00 ATOM 120 CB ALA 36 25.088 27.290 20.779 1.00 0.00 ATOM 121 O ALA 36 27.934 26.203 20.825 1.00 0.00 ATOM 122 C ALA 36 27.225 26.403 21.810 1.00 0.00 ATOM 123 N ARG 37 27.365 25.754 22.958 1.00 0.00 ATOM 124 CA ARG 37 28.297 24.629 23.113 1.00 0.00 ATOM 125 CB ARG 37 28.696 24.632 24.585 1.00 0.00 ATOM 126 CG ARG 37 29.812 23.653 24.879 1.00 0.00 ATOM 127 CD ARG 37 30.271 23.762 26.331 1.00 0.00 ATOM 128 NE ARG 37 29.210 23.306 27.241 1.00 0.00 ATOM 129 CZ ARG 37 29.251 23.441 28.566 1.00 0.00 ATOM 130 NH1 ARG 37 30.238 24.107 29.168 1.00 0.00 ATOM 131 NH2 ARG 37 28.342 22.821 29.314 1.00 0.00 ATOM 132 O ARG 37 26.562 23.014 23.357 1.00 0.00 ATOM 133 C ARG 37 27.560 23.348 22.725 1.00 0.00 ATOM 134 N ASP 38 28.047 22.664 21.700 1.00 0.00 ATOM 135 CA ASP 38 27.408 21.405 21.232 1.00 0.00 ATOM 136 CB ASP 38 28.094 20.887 19.966 1.00 0.00 ATOM 137 CG ASP 38 27.529 19.558 19.456 1.00 0.00 ATOM 138 OD1 ASP 38 26.417 19.185 19.877 1.00 0.00 ATOM 139 OD2 ASP 38 28.238 18.928 18.644 1.00 0.00 ATOM 140 O ASP 38 28.556 20.024 22.840 1.00 0.00 ATOM 141 C ASP 38 27.468 20.338 22.333 1.00 0.00 ATOM 142 N THR 39 26.329 19.714 22.605 1.00 0.00 ATOM 143 CA THR 39 26.207 18.701 23.675 1.00 0.00 ATOM 144 CB THR 39 24.807 18.108 23.792 1.00 0.00 ATOM 145 CG2 THR 39 23.798 19.169 24.220 1.00 0.00 ATOM 146 OG1 THR 39 24.423 17.502 22.552 1.00 0.00 ATOM 147 O THR 39 27.689 16.994 24.439 1.00 0.00 ATOM 148 C THR 39 27.106 17.499 23.468 1.00 0.00 ATOM 149 N ASN 40 27.136 17.004 22.230 1.00 0.00 ATOM 150 CA ASN 40 27.907 15.789 21.941 1.00 0.00 ATOM 151 CB ASN 40 27.439 15.180 20.614 1.00 0.00 ATOM 152 CG ASN 40 26.015 14.611 20.769 1.00 0.00 ATOM 153 ND2 ASN 40 25.290 14.547 19.698 1.00 0.00 ATOM 154 OD1 ASN 40 25.554 14.154 21.802 1.00 0.00 ATOM 155 O ASN 40 30.164 15.095 22.009 1.00 0.00 ATOM 156 C ASN 40 29.407 16.055 22.077 1.00 0.00 ATOM 157 N MET 41 29.797 17.275 22.482 1.00 0.00 ATOM 158 CA MET 41 31.212 17.570 22.770 1.00 0.00 ATOM 159 CB MET 41 31.917 17.514 21.415 1.00 0.00 ATOM 160 CG MET 41 33.395 17.892 21.442 1.00 0.00 ATOM 161 SD MET 41 34.140 17.527 19.833 1.00 0.00 ATOM 162 CE MET 41 33.156 18.657 18.878 1.00 0.00 ATOM 163 O MET 41 32.814 18.509 24.280 1.00 0.00 ATOM 164 C MET 41 31.767 18.707 23.658 1.00 0.00 ATOM 165 N GLY 42 31.265 19.928 23.568 1.00 0.00 ATOM 166 CA GLY 42 31.867 21.048 24.315 1.00 0.00 ATOM 167 O GLY 42 33.130 23.066 23.974 1.00 0.00 ATOM 168 C GLY 42 32.560 22.102 23.444 1.00 0.00 ATOM 169 N ALA 43 32.450 21.937 22.137 1.00 0.00 ATOM 170 CA ALA 43 32.950 22.892 21.129 1.00 0.00 ATOM 171 CB ALA 43 33.192 22.149 19.821 1.00 0.00 ATOM 172 O ALA 43 30.724 23.743 21.155 1.00 0.00 ATOM 173 C ALA 43 31.899 23.998 20.933 1.00 0.00 ATOM 174 N TRP 44 32.327 25.140 20.385 1.00 0.00 ATOM 175 CA TRP 44 31.520 26.379 20.408 1.00 0.00 ATOM 176 CB TRP 44 32.305 27.490 21.086 1.00 0.00 ATOM 177 CG TRP 44 32.564 27.160 22.541 1.00 0.00 ATOM 178 CD1 TRP 44 33.660 26.609 23.027 1.00 0.00 ATOM 179 CD2 TRP 44 31.703 27.413 23.596 1.00 0.00 ATOM 180 CE2 TRP 44 32.363 27.001 24.730 1.00 0.00 ATOM 181 CE3 TRP 44 30.431 27.956 23.677 1.00 0.00 ATOM 182 NE1 TRP 44 33.525 26.513 24.329 1.00 0.00 ATOM 183 CZ2 TRP 44 31.803 27.136 25.983 1.00 0.00 ATOM 184 CZ3 TRP 44 29.851 28.095 24.921 1.00 0.00 ATOM 185 CH2 TRP 44 30.533 27.689 26.063 1.00 0.00 ATOM 186 O TRP 44 31.935 27.419 18.294 1.00 0.00 ATOM 187 C TRP 44 31.085 26.977 19.069 1.00 0.00 ATOM 188 N PHE 45 29.781 27.213 18.971 1.00 0.00 ATOM 189 CA PHE 45 29.171 27.926 17.835 1.00 0.00 ATOM 190 CB PHE 45 28.221 27.016 17.039 1.00 0.00 ATOM 191 CG PHE 45 28.939 25.838 16.350 1.00 0.00 ATOM 192 CD1 PHE 45 30.329 25.812 16.226 1.00 0.00 ATOM 193 CD2 PHE 45 28.226 24.766 15.824 1.00 0.00 ATOM 194 CE1 PHE 45 30.986 24.753 15.642 1.00 0.00 ATOM 195 CE2 PHE 45 28.877 23.724 15.207 1.00 0.00 ATOM 196 CZ PHE 45 30.252 23.720 15.120 1.00 0.00 ATOM 197 O PHE 45 28.414 29.372 19.597 1.00 0.00 ATOM 198 C PHE 45 28.529 29.195 18.383 1.00 0.00 ATOM 199 N GLU 46 28.197 30.096 17.476 1.00 0.00 ATOM 200 CA GLU 46 27.712 31.411 17.928 1.00 0.00 ATOM 201 CB GLU 46 28.541 32.509 17.266 1.00 0.00 ATOM 202 CG GLU 46 30.024 32.397 17.670 1.00 0.00 ATOM 203 CD GLU 46 30.901 33.593 17.274 1.00 0.00 ATOM 204 OE1 GLU 46 32.136 33.446 17.350 1.00 0.00 ATOM 205 OE2 GLU 46 30.341 34.675 16.966 1.00 0.00 ATOM 206 O GLU 46 25.783 31.183 16.557 1.00 0.00 ATOM 207 C GLU 46 26.210 31.529 17.646 1.00 0.00 ATOM 208 N ALA 47 25.448 31.994 18.629 1.00 0.00 ATOM 209 CA ALA 47 23.975 31.869 18.610 1.00 0.00 ATOM 210 CB ALA 47 23.488 31.000 19.765 1.00 0.00 ATOM 211 O ALA 47 23.708 34.273 18.898 1.00 0.00 ATOM 212 C ALA 47 23.212 33.197 18.555 1.00 0.00 ATOM 213 N GLN 48 21.959 33.084 18.117 1.00 0.00 ATOM 214 CA GLN 48 21.058 34.246 17.986 1.00 0.00 ATOM 215 CB GLN 48 20.862 34.654 16.525 1.00 0.00 ATOM 216 CG GLN 48 22.187 35.164 15.959 1.00 0.00 ATOM 217 CD GLN 48 22.122 35.791 14.567 1.00 0.00 ATOM 218 OE1 GLN 48 23.013 35.803 13.740 1.00 0.00 ATOM 219 NE2 GLN 48 21.036 36.455 14.315 1.00 0.00 ATOM 220 O GLN 48 18.956 33.118 18.176 1.00 0.00 ATOM 221 C GLN 48 19.723 33.967 18.656 1.00 0.00 ATOM 222 N VAL 49 19.503 34.638 19.772 1.00 0.00 ATOM 223 CA VAL 49 18.337 34.370 20.635 1.00 0.00 ATOM 224 CB VAL 49 18.612 34.762 22.099 1.00 0.00 ATOM 225 CG1 VAL 49 17.436 34.456 23.029 1.00 0.00 ATOM 226 CG2 VAL 49 19.792 33.942 22.616 1.00 0.00 ATOM 227 O VAL 49 16.855 36.002 19.630 1.00 0.00 ATOM 228 C VAL 49 17.003 34.849 20.040 1.00 0.00 ATOM 229 N VAL 50 16.129 33.864 19.812 1.00 0.00 ATOM 230 CA VAL 50 14.816 34.188 19.201 1.00 0.00 ATOM 231 CB VAL 50 14.578 33.433 17.878 1.00 0.00 ATOM 232 CG1 VAL 50 13.177 33.660 17.299 1.00 0.00 ATOM 233 CG2 VAL 50 15.545 34.005 16.831 1.00 0.00 ATOM 234 O VAL 50 13.733 35.423 20.883 1.00 0.00 ATOM 235 C VAL 50 13.728 34.367 20.270 1.00 0.00 ATOM 236 N ARG 51 12.968 33.338 20.663 1.00 0.00 ATOM 237 CA ARG 51 11.964 33.519 21.747 1.00 0.00 ATOM 238 CB ARG 51 10.570 33.111 21.274 1.00 0.00 ATOM 239 CG ARG 51 9.418 33.397 22.256 1.00 0.00 ATOM 240 CD ARG 51 8.072 32.858 21.762 1.00 0.00 ATOM 241 NE ARG 51 8.218 31.434 21.427 1.00 0.00 ATOM 242 CZ ARG 51 7.873 30.895 20.265 1.00 0.00 ATOM 243 NH1 ARG 51 7.256 31.579 19.307 1.00 0.00 ATOM 244 NH2 ARG 51 8.119 29.610 20.033 1.00 0.00 ATOM 245 O ARG 51 12.690 31.532 22.869 1.00 0.00 ATOM 246 C ARG 51 12.295 32.687 22.977 1.00 0.00 ATOM 247 N VAL 52 11.851 33.221 24.107 1.00 0.00 ATOM 248 CA VAL 52 11.922 32.464 25.368 1.00 0.00 ATOM 249 CB VAL 52 12.661 33.236 26.482 1.00 0.00 ATOM 250 CG1 VAL 52 11.932 34.491 26.945 1.00 0.00 ATOM 251 CG2 VAL 52 12.910 32.335 27.677 1.00 0.00 ATOM 252 O VAL 52 9.565 32.817 25.646 1.00 0.00 ATOM 253 C VAL 52 10.521 32.054 25.800 1.00 0.00 ATOM 254 N THR 53 10.411 30.788 26.130 1.00 0.00 ATOM 255 CA THR 53 9.211 30.280 26.781 1.00 0.00 ATOM 256 CB THR 53 8.276 29.545 25.813 1.00 0.00 ATOM 257 CG2 THR 53 7.810 30.485 24.693 1.00 0.00 ATOM 258 OG1 THR 53 8.939 28.432 25.227 1.00 0.00 ATOM 259 O THR 53 10.244 28.361 27.856 1.00 0.00 ATOM 260 C THR 53 9.688 29.453 27.963 1.00 0.00 ATOM 261 N ARG 54 9.541 30.090 29.112 1.00 0.00 ATOM 262 CA ARG 54 9.958 29.542 30.412 1.00 0.00 ATOM 263 CB ARG 54 9.806 30.745 31.375 1.00 0.00 ATOM 264 CG ARG 54 10.115 32.137 30.760 1.00 0.00 ATOM 265 CD ARG 54 9.515 33.369 31.454 1.00 0.00 ATOM 266 NE ARG 54 10.198 33.587 32.735 1.00 0.00 ATOM 267 CZ ARG 54 9.896 32.983 33.887 1.00 0.00 ATOM 268 NH1 ARG 54 8.941 32.081 33.994 1.00 0.00 ATOM 269 NH2 ARG 54 10.545 33.344 34.972 1.00 0.00 ATOM 270 O ARG 54 9.283 27.543 31.665 1.00 0.00 ATOM 271 C ARG 54 9.075 28.288 30.717 1.00 0.00 ATOM 272 N LYS 55 8.124 28.033 29.822 1.00 0.00 ATOM 273 CA LYS 55 7.131 26.954 29.828 1.00 0.00 ATOM 274 CB LYS 55 6.104 27.306 28.752 1.00 0.00 ATOM 275 CG LYS 55 4.866 26.428 28.869 1.00 0.00 ATOM 276 CD LYS 55 3.963 26.783 27.706 1.00 0.00 ATOM 277 CE LYS 55 2.629 26.091 27.836 1.00 0.00 ATOM 278 NZ LYS 55 2.802 24.727 27.408 1.00 0.00 ATOM 279 O LYS 55 7.104 24.675 30.376 1.00 0.00 ATOM 280 C LYS 55 7.634 25.506 29.652 1.00 0.00 ATOM 281 N ALA 56 8.249 25.187 28.508 1.00 0.00 ATOM 282 CA ALA 56 8.588 23.789 28.138 1.00 0.00 ATOM 283 CB ALA 56 7.343 22.889 28.066 1.00 0.00 ATOM 284 O ALA 56 8.942 24.443 25.889 1.00 0.00 ATOM 285 C ALA 56 9.284 23.661 26.776 1.00 0.00 ATOM 286 N PRO 57 10.072 22.584 26.574 1.00 0.00 ATOM 287 CA PRO 57 10.757 22.337 25.293 1.00 0.00 ATOM 288 CB PRO 57 11.658 21.136 25.553 1.00 0.00 ATOM 289 CG PRO 57 11.018 20.429 26.739 1.00 0.00 ATOM 290 CD PRO 57 10.506 21.599 27.572 1.00 0.00 ATOM 291 O PRO 57 9.391 23.290 23.554 1.00 0.00 ATOM 292 C PRO 57 9.886 22.269 24.037 1.00 0.00 ATOM 293 N SER 58 9.907 21.116 23.388 1.00 0.00 ATOM 294 CA SER 58 9.226 20.949 22.108 1.00 0.00 ATOM 295 CB SER 58 10.214 21.290 20.978 1.00 0.00 ATOM 296 OG SER 58 11.291 20.361 20.970 1.00 0.00 ATOM 297 O SER 58 8.361 18.938 23.068 1.00 0.00 ATOM 298 C SER 58 8.569 19.576 22.026 1.00 0.00 ATOM 299 N ARG 59 8.131 19.191 20.823 1.00 0.00 ATOM 300 CA ARG 59 7.426 17.910 20.606 1.00 0.00 ATOM 301 CB ARG 59 7.282 17.624 19.108 1.00 0.00 ATOM 302 CG ARG 59 6.374 18.612 18.407 1.00 0.00 ATOM 303 CD ARG 59 6.036 18.101 17.007 1.00 0.00 ATOM 304 NE ARG 59 5.255 19.100 16.267 1.00 0.00 ATOM 305 CZ ARG 59 5.050 19.125 14.943 1.00 0.00 ATOM 306 NH1 ARG 59 5.556 18.203 14.140 1.00 0.00 ATOM 307 NH2 ARG 59 4.257 20.038 14.411 1.00 0.00 ATOM 308 O ARG 59 9.388 16.951 21.617 1.00 0.00 ATOM 309 C ARG 59 8.239 16.762 21.207 1.00 0.00 ATOM 310 N ASP 60 7.635 15.588 21.261 1.00 0.00 ATOM 311 CA ASP 60 8.385 14.361 21.564 1.00 0.00 ATOM 312 CB ASP 60 7.472 13.189 21.927 1.00 0.00 ATOM 313 CG ASP 60 8.242 12.073 22.646 1.00 0.00 ATOM 314 OD1 ASP 60 9.489 12.091 22.664 1.00 0.00 ATOM 315 OD2 ASP 60 7.527 11.173 23.117 1.00 0.00 ATOM 316 O ASP 60 8.870 13.221 19.468 1.00 0.00 ATOM 317 C ASP 60 9.240 14.016 20.342 1.00 0.00 ATOM 318 N GLU 61 10.243 14.865 20.180 1.00 0.00 ATOM 319 CA GLU 61 11.137 14.856 19.012 1.00 0.00 ATOM 320 CB GLU 61 10.517 15.608 17.788 1.00 0.00 ATOM 321 CG GLU 61 9.161 15.074 17.193 1.00 0.00 ATOM 322 CD GLU 61 8.517 15.549 15.854 1.00 0.00 ATOM 323 OE1 GLU 61 8.264 14.692 14.986 1.00 0.00 ATOM 324 OE2 GLU 61 8.104 16.717 15.718 1.00 0.00 ATOM 325 O GLU 61 12.997 16.305 19.713 1.00 0.00 ATOM 326 C GLU 61 12.565 15.156 19.582 1.00 0.00 ATOM 327 N PRO 62 13.214 14.090 20.106 1.00 0.00 ATOM 328 CA PRO 62 14.505 14.111 20.842 1.00 0.00 ATOM 329 CB PRO 62 14.820 12.649 21.185 1.00 0.00 ATOM 330 CG PRO 62 13.432 12.027 21.276 1.00 0.00 ATOM 331 CD PRO 62 12.687 12.702 20.132 1.00 0.00 ATOM 332 O PRO 62 16.335 14.044 19.282 1.00 0.00 ATOM 333 C PRO 62 15.678 14.711 20.085 1.00 0.00 ATOM 334 N CYS 63 16.023 15.921 20.484 1.00 0.00 ATOM 335 CA CYS 63 17.202 16.620 19.933 1.00 0.00 ATOM 336 CB CYS 63 16.962 18.123 19.986 1.00 0.00 ATOM 337 SG CYS 63 15.478 18.470 18.964 1.00 0.00 ATOM 338 O CYS 63 19.105 15.257 20.081 1.00 0.00 ATOM 339 C CYS 63 18.431 16.099 20.662 1.00 0.00 ATOM 340 N SER 64 18.392 16.204 21.997 1.00 0.00 ATOM 341 CA SER 64 19.312 15.531 22.939 1.00 0.00 ATOM 342 CB SER 64 20.536 14.775 22.367 1.00 0.00 ATOM 343 OG SER 64 21.401 14.241 23.359 1.00 0.00 ATOM 344 O SER 64 20.644 17.089 24.277 1.00 0.00 ATOM 345 C SER 64 19.692 16.318 24.189 1.00 0.00 ATOM 346 N SER 65 18.923 15.983 25.206 1.00 0.00 ATOM 347 CA SER 65 19.229 16.374 26.598 1.00 0.00 ATOM 348 CB SER 65 17.879 16.658 27.275 1.00 0.00 ATOM 349 OG SER 65 17.268 15.452 27.721 1.00 0.00 ATOM 350 O SER 65 20.320 15.282 28.495 1.00 0.00 ATOM 351 C SER 65 20.089 15.283 27.288 1.00 0.00 ATOM 352 N THR 66 20.625 14.355 26.494 1.00 0.00 ATOM 353 CA THR 66 21.515 13.230 26.874 1.00 0.00 ATOM 354 CB THR 66 22.918 13.708 27.284 1.00 0.00 ATOM 355 CG2 THR 66 23.974 12.585 27.280 1.00 0.00 ATOM 356 OG1 THR 66 23.338 14.748 26.398 1.00 0.00 ATOM 357 O THR 66 21.564 12.146 28.963 1.00 0.00 ATOM 358 C THR 66 20.888 12.378 27.972 1.00 0.00 ATOM 359 N SER 67 19.578 12.123 27.946 1.00 0.00 ATOM 360 CA SER 67 18.857 11.350 28.995 1.00 0.00 ATOM 361 CB SER 67 19.431 9.935 29.104 1.00 0.00 ATOM 362 OG SER 67 19.144 9.264 27.881 1.00 0.00 ATOM 363 O SER 67 18.159 11.613 31.330 1.00 0.00 ATOM 364 C SER 67 18.782 12.061 30.371 1.00 0.00 ATOM 365 N ARG 68 19.294 13.276 30.406 1.00 0.00 ATOM 366 CA ARG 68 19.225 14.128 31.585 1.00 0.00 ATOM 367 CB ARG 68 20.636 14.718 31.702 1.00 0.00 ATOM 368 CG ARG 68 20.882 15.465 32.996 1.00 0.00 ATOM 369 CD ARG 68 22.344 15.901 32.973 1.00 0.00 ATOM 370 NE ARG 68 22.625 16.665 34.181 1.00 0.00 ATOM 371 CZ ARG 68 22.400 17.952 34.341 1.00 0.00 ATOM 372 NH1 ARG 68 21.781 18.748 33.475 1.00 0.00 ATOM 373 NH2 ARG 68 22.898 18.487 35.414 1.00 0.00 ATOM 374 O ARG 68 18.271 15.995 30.454 1.00 0.00 ATOM 375 C ARG 68 18.084 15.128 31.310 1.00 0.00 ATOM 376 N PRO 69 16.916 14.934 31.937 1.00 0.00 ATOM 377 CA PRO 69 15.652 15.668 31.692 1.00 0.00 ATOM 378 CB PRO 69 14.625 15.029 32.631 1.00 0.00 ATOM 379 CG PRO 69 15.491 14.534 33.779 1.00 0.00 ATOM 380 CD PRO 69 16.692 13.963 33.035 1.00 0.00 ATOM 381 O PRO 69 14.618 17.796 32.175 1.00 0.00 ATOM 382 C PRO 69 15.655 17.185 31.954 1.00 0.00 ATOM 383 N ALA 70 16.824 17.803 31.864 1.00 0.00 ATOM 384 CA ALA 70 16.952 19.246 32.133 1.00 0.00 ATOM 385 CB ALA 70 18.420 19.629 32.170 1.00 0.00 ATOM 386 O ALA 70 15.487 21.053 31.595 1.00 0.00 ATOM 387 C ALA 70 16.146 20.116 31.162 1.00 0.00 ATOM 388 N LEU 71 16.134 19.738 29.876 1.00 0.00 ATOM 389 CA LEU 71 15.350 20.383 28.801 1.00 0.00 ATOM 390 CB LEU 71 15.278 19.354 27.658 1.00 0.00 ATOM 391 CG LEU 71 14.845 19.805 26.262 1.00 0.00 ATOM 392 CD1 LEU 71 16.095 20.155 25.453 1.00 0.00 ATOM 393 CD2 LEU 71 14.116 18.673 25.554 1.00 0.00 ATOM 394 O LEU 71 13.382 21.728 29.208 1.00 0.00 ATOM 395 C LEU 71 13.904 20.622 29.267 1.00 0.00 ATOM 396 N GLU 72 13.318 19.509 29.686 1.00 0.00 ATOM 397 CA GLU 72 11.914 19.400 30.087 1.00 0.00 ATOM 398 CB GLU 72 11.528 17.918 30.101 1.00 0.00 ATOM 399 CG GLU 72 11.566 17.306 28.690 1.00 0.00 ATOM 400 CD GLU 72 12.925 16.701 28.279 1.00 0.00 ATOM 401 OE1 GLU 72 13.917 16.803 29.026 1.00 0.00 ATOM 402 OE2 GLU 72 12.954 16.086 27.194 1.00 0.00 ATOM 403 O GLU 72 10.595 20.644 31.647 1.00 0.00 ATOM 404 C GLU 72 11.655 20.079 31.427 1.00 0.00 ATOM 405 N GLU 73 12.686 20.093 32.268 1.00 0.00 ATOM 406 CA GLU 73 12.608 20.752 33.582 1.00 0.00 ATOM 407 CB GLU 73 13.806 20.381 34.460 1.00 0.00 ATOM 408 CG GLU 73 13.795 18.902 34.862 1.00 0.00 ATOM 409 CD GLU 73 12.521 18.463 35.606 1.00 0.00 ATOM 410 OE1 GLU 73 12.076 19.189 36.521 1.00 0.00 ATOM 411 OE2 GLU 73 12.055 17.343 35.351 1.00 0.00 ATOM 412 O GLU 73 11.607 22.807 34.229 1.00 0.00 ATOM 413 C GLU 73 12.422 22.264 33.478 1.00 0.00 ATOM 414 N ASP 74 13.104 22.930 32.531 1.00 0.00 ATOM 415 CA ASP 74 12.930 24.410 32.443 1.00 0.00 ATOM 416 CB ASP 74 13.788 25.051 33.532 1.00 0.00 ATOM 417 CG ASP 74 13.371 26.508 33.824 1.00 0.00 ATOM 418 OD1 ASP 74 12.178 26.846 33.642 1.00 0.00 ATOM 419 OD2 ASP 74 14.318 27.258 34.139 1.00 0.00 ATOM 420 O ASP 74 11.732 25.412 30.586 1.00 0.00 ATOM 421 C ASP 74 12.803 25.308 31.181 1.00 0.00 ATOM 422 N VAL 75 13.807 26.162 30.937 1.00 0.00 ATOM 423 CA VAL 75 13.715 27.300 30.009 1.00 0.00 ATOM 424 CB VAL 75 14.343 28.556 30.671 1.00 0.00 ATOM 425 CG1 VAL 75 15.803 28.397 31.073 1.00 0.00 ATOM 426 CG2 VAL 75 14.179 29.813 29.827 1.00 0.00 ATOM 427 O VAL 75 15.472 26.534 28.540 1.00 0.00 ATOM 428 C VAL 75 14.292 26.881 28.661 1.00 0.00 ATOM 429 N ILE 76 13.399 26.805 27.681 1.00 0.00 ATOM 430 CA ILE 76 13.808 26.339 26.349 1.00 0.00 ATOM 431 CB ILE 76 12.919 25.150 25.963 1.00 0.00 ATOM 432 CG1 ILE 76 13.722 24.174 25.124 1.00 0.00 ATOM 433 CG2 ILE 76 11.636 25.548 25.227 1.00 0.00 ATOM 434 CD1 ILE 76 14.467 23.195 26.035 1.00 0.00 ATOM 435 O ILE 76 12.989 28.362 25.297 1.00 0.00 ATOM 436 C ILE 76 13.862 27.484 25.331 1.00 0.00 ATOM 437 N TYR 77 14.879 27.428 24.489 1.00 0.00 ATOM 438 CA TYR 77 15.124 28.474 23.489 1.00 0.00 ATOM 439 CB TYR 77 16.461 29.171 23.794 1.00 0.00 ATOM 440 CG TYR 77 16.377 30.080 25.036 1.00 0.00 ATOM 441 CD1 TYR 77 16.160 31.440 24.858 1.00 0.00 ATOM 442 CD2 TYR 77 16.568 29.578 26.310 1.00 0.00 ATOM 443 CE1 TYR 77 16.134 32.297 25.954 1.00 0.00 ATOM 444 CE2 TYR 77 16.542 30.435 27.405 1.00 0.00 ATOM 445 CZ TYR 77 16.323 31.785 27.229 1.00 0.00 ATOM 446 OH TYR 77 16.145 32.577 28.322 1.00 0.00 ATOM 447 O TYR 77 15.754 26.900 21.764 1.00 0.00 ATOM 448 C TYR 77 15.124 27.910 22.061 1.00 0.00 ATOM 449 N HIS 78 14.398 28.611 21.207 1.00 0.00 ATOM 450 CA HIS 78 14.334 28.274 19.774 1.00 0.00 ATOM 451 CB HIS 78 12.885 28.206 19.298 1.00 0.00 ATOM 452 CG HIS 78 12.022 27.213 20.085 1.00 0.00 ATOM 453 CD2 HIS 78 11.172 27.503 21.073 1.00 0.00 ATOM 454 ND1 HIS 78 11.982 25.905 19.881 1.00 0.00 ATOM 455 CE1 HIS 78 11.137 25.365 20.764 1.00 0.00 ATOM 456 NE2 HIS 78 10.629 26.359 21.495 1.00 0.00 ATOM 457 O HIS 78 14.650 30.549 19.112 1.00 0.00 ATOM 458 C HIS 78 15.075 29.393 19.042 1.00 0.00 ATOM 459 N VAL 79 16.326 29.081 18.699 1.00 0.00 ATOM 460 CA VAL 79 17.225 30.090 18.110 1.00 0.00 ATOM 461 CB VAL 79 18.358 30.480 19.086 1.00 0.00 ATOM 462 CG1 VAL 79 17.863 31.051 20.405 1.00 0.00 ATOM 463 CG2 VAL 79 19.226 29.310 19.474 1.00 0.00 ATOM 464 O VAL 79 17.692 28.527 16.320 1.00 0.00 ATOM 465 C VAL 79 17.811 29.666 16.752 1.00 0.00 ATOM 466 N LYS 80 18.564 30.590 16.174 1.00 0.00 ATOM 467 CA LYS 80 19.225 30.370 14.890 1.00 0.00 ATOM 468 CB LYS 80 18.398 31.200 13.907 1.00 0.00 ATOM 469 CG LYS 80 18.825 31.189 12.446 1.00 0.00 ATOM 470 CD LYS 80 17.720 31.791 11.586 1.00 0.00 ATOM 471 CE LYS 80 18.214 31.913 10.151 1.00 0.00 ATOM 472 NZ LYS 80 17.192 32.478 9.273 1.00 0.00 ATOM 473 O LYS 80 21.015 31.632 15.849 1.00 0.00 ATOM 474 C LYS 80 20.703 30.786 15.012 1.00 0.00 ATOM 475 N TYR 81 21.595 30.104 14.302 1.00 0.00 ATOM 476 CA TYR 81 23.000 30.519 14.367 1.00 0.00 ATOM 477 CB TYR 81 23.735 29.695 15.425 1.00 0.00 ATOM 478 CG TYR 81 23.989 28.206 15.237 1.00 0.00 ATOM 479 CD1 TYR 81 25.288 27.764 15.055 1.00 0.00 ATOM 480 CD2 TYR 81 22.960 27.298 15.318 1.00 0.00 ATOM 481 CE1 TYR 81 25.525 26.406 14.927 1.00 0.00 ATOM 482 CE2 TYR 81 23.195 25.934 15.211 1.00 0.00 ATOM 483 CZ TYR 81 24.493 25.488 15.010 1.00 0.00 ATOM 484 OH TYR 81 24.729 24.164 14.836 1.00 0.00 ATOM 485 O TYR 81 23.250 30.207 12.032 1.00 0.00 ATOM 486 C TYR 81 23.701 30.760 13.023 1.00 0.00 ATOM 487 N ASP 82 24.705 31.649 13.028 1.00 0.00 ATOM 488 CA ASP 82 25.375 32.197 11.817 1.00 0.00 ATOM 489 CB ASP 82 26.323 33.378 12.080 1.00 0.00 ATOM 490 CG ASP 82 27.035 33.849 10.798 1.00 0.00 ATOM 491 OD1 ASP 82 26.369 34.389 9.897 1.00 0.00 ATOM 492 OD2 ASP 82 28.283 33.793 10.818 1.00 0.00 ATOM 493 O ASP 82 26.153 31.067 9.858 1.00 0.00 ATOM 494 C ASP 82 26.166 31.137 11.074 1.00 0.00 ATOM 495 N ASP 83 26.937 30.372 11.815 1.00 0.00 ATOM 496 CA ASP 83 27.869 29.413 11.201 1.00 0.00 ATOM 497 CB ASP 83 28.811 28.895 12.278 1.00 0.00 ATOM 498 CG ASP 83 29.838 27.945 11.677 1.00 0.00 ATOM 499 OD1 ASP 83 30.484 28.361 10.693 1.00 0.00 ATOM 500 OD2 ASP 83 29.901 26.818 12.220 1.00 0.00 ATOM 501 O ASP 83 27.575 27.872 9.342 1.00 0.00 ATOM 502 C ASP 83 27.193 28.250 10.455 1.00 0.00 ATOM 503 N TYR 84 26.183 27.678 11.087 1.00 0.00 ATOM 504 CA TYR 84 25.402 26.623 10.440 1.00 0.00 ATOM 505 CB TYR 84 24.827 25.774 11.575 1.00 0.00 ATOM 506 CG TYR 84 24.207 24.429 11.182 1.00 0.00 ATOM 507 CD1 TYR 84 24.948 23.333 10.752 1.00 0.00 ATOM 508 CD2 TYR 84 22.840 24.305 11.330 1.00 0.00 ATOM 509 CE1 TYR 84 24.313 22.124 10.448 1.00 0.00 ATOM 510 CE2 TYR 84 22.219 23.112 11.023 1.00 0.00 ATOM 511 CZ TYR 84 22.948 22.008 10.585 1.00 0.00 ATOM 512 OH TYR 84 22.349 20.818 10.327 1.00 0.00 ATOM 513 O TYR 84 23.765 28.326 10.121 1.00 0.00 ATOM 514 C TYR 84 24.430 27.451 9.576 1.00 0.00 ATOM 515 N PRO 85 24.652 27.446 8.256 1.00 0.00 ATOM 516 CA PRO 85 24.086 28.477 7.369 1.00 0.00 ATOM 517 CB PRO 85 24.633 28.141 5.978 1.00 0.00 ATOM 518 CG PRO 85 24.981 26.652 6.039 1.00 0.00 ATOM 519 CD PRO 85 25.401 26.426 7.498 1.00 0.00 ATOM 520 O PRO 85 21.879 28.108 8.350 1.00 0.00 ATOM 521 C PRO 85 22.553 28.666 7.493 1.00 0.00 ATOM 522 N GLU 86 22.012 29.439 6.556 1.00 0.00 ATOM 523 CA GLU 86 20.600 29.891 6.508 1.00 0.00 ATOM 524 CB GLU 86 20.294 30.236 5.063 1.00 0.00 ATOM 525 CG GLU 86 20.316 28.972 4.209 1.00 0.00 ATOM 526 CD GLU 86 19.862 29.268 2.801 1.00 0.00 ATOM 527 OE1 GLU 86 18.675 29.632 2.655 1.00 0.00 ATOM 528 OE2 GLU 86 20.745 29.251 1.918 1.00 0.00 ATOM 529 O GLU 86 19.680 27.683 6.944 1.00 0.00 ATOM 530 C GLU 86 19.529 28.897 6.981 1.00 0.00 ATOM 531 N ASN 87 18.355 29.458 7.248 1.00 0.00 ATOM 532 CA ASN 87 17.185 28.679 7.720 1.00 0.00 ATOM 533 CB ASN 87 16.680 27.769 6.598 1.00 0.00 ATOM 534 CG ASN 87 15.389 27.041 6.997 1.00 0.00 ATOM 535 ND2 ASN 87 15.276 25.813 6.549 1.00 0.00 ATOM 536 OD1 ASN 87 14.527 27.526 7.708 1.00 0.00 ATOM 537 O ASN 87 17.211 26.667 9.063 1.00 0.00 ATOM 538 C ASN 87 17.621 27.815 8.931 1.00 0.00 ATOM 539 N GLY 88 18.539 28.412 9.689 1.00 0.00 ATOM 540 CA GLY 88 19.250 27.842 10.837 1.00 0.00 ATOM 541 O GLY 88 17.509 28.553 12.314 1.00 0.00 ATOM 542 C GLY 88 18.304 27.658 12.021 1.00 0.00 ATOM 543 N VAL 89 18.423 26.546 12.730 1.00 0.00 ATOM 544 CA VAL 89 17.612 26.285 13.920 1.00 0.00 ATOM 545 CB VAL 89 16.188 25.764 13.589 1.00 0.00 ATOM 546 CG1 VAL 89 16.170 24.350 13.006 1.00 0.00 ATOM 547 CG2 VAL 89 15.275 25.820 14.812 1.00 0.00 ATOM 548 O VAL 89 18.737 24.251 14.614 1.00 0.00 ATOM 549 C VAL 89 18.345 25.376 14.911 1.00 0.00 ATOM 550 N VAL 90 18.509 25.935 16.088 1.00 0.00 ATOM 551 CA VAL 90 19.082 25.199 17.220 1.00 0.00 ATOM 552 CB VAL 90 20.544 25.629 17.452 1.00 0.00 ATOM 553 CG1 VAL 90 20.716 27.123 17.659 1.00 0.00 ATOM 554 CG2 VAL 90 21.222 24.899 18.598 1.00 0.00 ATOM 555 O VAL 90 17.793 26.397 18.857 1.00 0.00 ATOM 556 C VAL 90 18.100 25.305 18.386 1.00 0.00 ATOM 557 N GLN 91 17.319 24.241 18.502 1.00 0.00 ATOM 558 CA GLN 91 16.387 24.107 19.636 1.00 0.00 ATOM 559 CB GLN 91 15.287 23.094 19.322 1.00 0.00 ATOM 560 CG GLN 91 14.240 23.721 18.404 1.00 0.00 ATOM 561 CD GLN 91 13.647 22.677 17.451 1.00 0.00 ATOM 562 OE1 GLN 91 13.993 22.593 16.281 1.00 0.00 ATOM 563 NE2 GLN 91 12.782 21.833 17.960 1.00 0.00 ATOM 564 O GLN 91 17.892 22.677 20.799 1.00 0.00 ATOM 565 C GLN 91 17.223 23.695 20.852 1.00 0.00 ATOM 566 N MET 92 17.330 24.626 21.797 1.00 0.00 ATOM 567 CA MET 92 18.268 24.443 22.919 1.00 0.00 ATOM 568 CB MET 92 19.562 25.221 22.624 1.00 0.00 ATOM 569 CG MET 92 19.379 26.746 22.538 1.00 0.00 ATOM 570 SD MET 92 20.755 27.605 21.708 1.00 0.00 ATOM 571 CE MET 92 22.179 27.110 22.636 1.00 0.00 ATOM 572 O MET 92 16.766 25.424 24.553 1.00 0.00 ATOM 573 C MET 92 17.712 24.668 24.330 1.00 0.00 ATOM 574 N ASN 93 18.215 23.827 25.239 1.00 0.00 ATOM 575 CA ASN 93 17.857 23.981 26.662 1.00 0.00 ATOM 576 CB ASN 93 17.778 22.631 27.390 1.00 0.00 ATOM 577 CG ASN 93 19.076 21.830 27.371 1.00 0.00 ATOM 578 ND2 ASN 93 18.946 20.533 27.444 1.00 0.00 ATOM 579 OD1 ASN 93 20.169 22.360 27.381 1.00 0.00 ATOM 580 O ASN 93 19.826 25.382 26.737 1.00 0.00 ATOM 581 C ASN 93 18.851 24.941 27.335 1.00 0.00 ATOM 582 N SER 94 18.535 25.292 28.571 1.00 0.00 ATOM 583 CA SER 94 19.285 26.304 29.349 1.00 0.00 ATOM 584 CB SER 94 18.544 26.578 30.638 1.00 0.00 ATOM 585 OG SER 94 18.400 25.333 31.322 1.00 0.00 ATOM 586 O SER 94 21.646 26.692 29.626 1.00 0.00 ATOM 587 C SER 94 20.702 25.909 29.773 1.00 0.00 ATOM 588 N ARG 95 20.844 24.654 30.191 1.00 0.00 ATOM 589 CA ARG 95 22.122 24.049 30.586 1.00 0.00 ATOM 590 CB ARG 95 21.753 22.621 30.976 1.00 0.00 ATOM 591 CG ARG 95 22.246 21.538 30.018 1.00 0.00 ATOM 592 CD ARG 95 21.450 20.261 30.150 1.00 0.00 ATOM 593 NE ARG 95 22.206 19.228 29.445 1.00 0.00 ATOM 594 CZ ARG 95 21.833 17.949 29.374 1.00 0.00 ATOM 595 NH1 ARG 95 20.665 17.562 29.871 1.00 0.00 ATOM 596 NH2 ARG 95 22.563 17.047 28.719 1.00 0.00 ATOM 597 O ARG 95 24.378 24.056 29.714 1.00 0.00 ATOM 598 C ARG 95 23.167 24.175 29.458 1.00 0.00 ATOM 599 N ASP 96 22.675 24.479 28.263 1.00 0.00 ATOM 600 CA ASP 96 23.503 24.573 27.050 1.00 0.00 ATOM 601 CB ASP 96 22.965 23.621 25.988 1.00 0.00 ATOM 602 CG ASP 96 23.109 22.141 26.382 1.00 0.00 ATOM 603 OD1 ASP 96 22.328 21.354 25.822 1.00 0.00 ATOM 604 OD2 ASP 96 23.951 21.792 27.263 1.00 0.00 ATOM 605 O ASP 96 24.710 26.202 25.753 1.00 0.00 ATOM 606 C ASP 96 23.743 25.983 26.486 1.00 0.00 ATOM 607 N VAL 97 23.034 26.963 27.025 1.00 0.00 ATOM 608 CA VAL 97 23.158 28.359 26.561 1.00 0.00 ATOM 609 CB VAL 97 21.744 28.957 26.559 1.00 0.00 ATOM 610 CG1 VAL 97 21.722 30.392 26.095 1.00 0.00 ATOM 611 CG2 VAL 97 20.805 28.206 25.614 1.00 0.00 ATOM 612 O VAL 97 24.076 29.291 28.644 1.00 0.00 ATOM 613 C VAL 97 24.209 29.068 27.436 1.00 0.00 ATOM 614 N ARG 98 25.374 29.291 26.845 1.00 0.00 ATOM 615 CA ARG 98 26.473 29.983 27.528 1.00 0.00 ATOM 616 CB ARG 98 27.795 29.239 27.335 1.00 0.00 ATOM 617 CG ARG 98 27.861 27.965 28.176 1.00 0.00 ATOM 618 CD ARG 98 28.099 28.296 29.652 1.00 0.00 ATOM 619 NE ARG 98 29.386 29.002 29.877 1.00 0.00 ATOM 620 CZ ARG 98 30.609 28.464 29.928 1.00 0.00 ATOM 621 NH1 ARG 98 30.812 27.177 29.679 1.00 0.00 ATOM 622 NH2 ARG 98 31.629 29.178 30.378 1.00 0.00 ATOM 623 O ARG 98 27.120 31.613 25.882 1.00 0.00 ATOM 624 C ARG 98 26.524 31.384 26.924 1.00 0.00 ATOM 625 N ALA 99 25.834 32.280 27.608 1.00 0.00 ATOM 626 CA ALA 99 25.613 33.626 27.057 1.00 0.00 ATOM 627 CB ALA 99 24.679 34.418 27.964 1.00 0.00 ATOM 628 O ALA 99 27.849 34.394 27.571 1.00 0.00 ATOM 629 C ALA 99 26.889 34.414 26.792 1.00 0.00 ATOM 630 N ARG 100 26.800 35.142 25.689 1.00 0.00 ATOM 631 CA ARG 100 27.777 36.207 25.411 1.00 0.00 ATOM 632 CB ARG 100 27.859 36.456 23.893 1.00 0.00 ATOM 633 CG ARG 100 28.451 37.820 23.533 1.00 0.00 ATOM 634 CD ARG 100 28.775 38.044 22.058 1.00 0.00 ATOM 635 NE ARG 100 27.627 37.790 21.172 1.00 0.00 ATOM 636 CZ ARG 100 27.546 36.763 20.313 1.00 0.00 ATOM 637 NH1 ARG 100 28.491 35.844 20.229 1.00 0.00 ATOM 638 NH2 ARG 100 26.503 36.664 19.508 1.00 0.00 ATOM 639 O ARG 100 28.409 38.169 26.613 1.00 0.00 ATOM 640 C ARG 100 27.487 37.433 26.295 1.00 0.00 ATOM 641 N ALA 101 26.340 37.430 26.970 1.00 0.00 ATOM 642 CA ALA 101 25.989 38.468 27.949 1.00 0.00 ATOM 643 CB ALA 101 24.515 38.295 28.304 1.00 0.00 ATOM 644 O ALA 101 27.060 39.506 29.855 1.00 0.00 ATOM 645 C ALA 101 26.898 38.483 29.192 1.00 0.00 ATOM 646 N ARG 102 27.645 37.402 29.429 1.00 0.00 ATOM 647 CA ARG 102 28.697 37.416 30.473 1.00 0.00 ATOM 648 CB ARG 102 29.587 36.174 30.557 1.00 0.00 ATOM 649 CG ARG 102 28.898 34.944 31.103 1.00 0.00 ATOM 650 CD ARG 102 29.916 33.870 31.488 1.00 0.00 ATOM 651 NE ARG 102 30.680 33.374 30.337 1.00 0.00 ATOM 652 CZ ARG 102 30.288 32.459 29.464 1.00 0.00 ATOM 653 NH1 ARG 102 29.107 31.876 29.498 1.00 0.00 ATOM 654 NH2 ARG 102 31.055 32.204 28.434 1.00 0.00 ATOM 655 O ARG 102 30.204 39.170 31.180 1.00 0.00 ATOM 656 C ARG 102 29.703 38.547 30.254 1.00 0.00 ATOM 657 N THR 103 30.002 38.751 28.976 1.00 0.00 ATOM 658 CA THR 103 30.908 39.786 28.484 1.00 0.00 ATOM 659 CB THR 103 30.888 39.536 26.964 1.00 0.00 ATOM 660 CG2 THR 103 30.119 40.545 26.120 1.00 0.00 ATOM 661 OG1 THR 103 32.169 39.147 26.470 1.00 0.00 ATOM 662 O THR 103 31.396 42.110 28.749 1.00 0.00 ATOM 663 C THR 103 30.571 41.229 28.937 1.00 0.00 ATOM 664 N ILE 104 29.453 41.454 29.634 1.00 0.00 ATOM 665 CA ILE 104 29.034 42.822 30.013 1.00 0.00 ATOM 666 CB ILE 104 27.512 42.857 30.284 1.00 0.00 ATOM 667 CG1 ILE 104 26.773 42.432 29.000 1.00 0.00 ATOM 668 CG2 ILE 104 26.956 44.259 30.592 1.00 0.00 ATOM 669 CD1 ILE 104 25.338 41.979 29.258 1.00 0.00 ATOM 670 O ILE 104 29.832 44.708 31.331 1.00 0.00 ATOM 671 C ILE 104 29.991 43.526 31.015 1.00 0.00 ATOM 672 N ILE 105 31.080 42.871 31.438 1.00 0.00 ATOM 673 CA ILE 105 32.167 43.520 32.210 1.00 0.00 ATOM 674 CB ILE 105 33.370 42.593 32.461 1.00 0.00 ATOM 675 CG1 ILE 105 32.940 41.362 33.267 1.00 0.00 ATOM 676 CG2 ILE 105 34.479 43.325 33.207 1.00 0.00 ATOM 677 CD1 ILE 105 33.969 40.217 33.278 1.00 0.00 ATOM 678 O ILE 105 33.122 44.753 30.332 1.00 0.00 ATOM 679 C ILE 105 32.617 44.787 31.457 1.00 0.00 ATOM 680 N LYS 106 32.438 45.889 32.174 1.00 0.00 ATOM 681 CA LYS 106 32.840 47.205 31.679 1.00 0.00 ATOM 682 CB LYS 106 32.196 48.308 32.529 1.00 0.00 ATOM 683 CG LYS 106 30.694 48.383 32.295 1.00 0.00 ATOM 684 CD LYS 106 30.122 49.447 33.209 1.00 0.00 ATOM 685 CE LYS 106 28.614 49.615 33.132 1.00 0.00 ATOM 686 NZ LYS 106 28.120 50.309 34.319 1.00 0.00 ATOM 687 O LYS 106 35.134 46.715 32.351 1.00 0.00 ATOM 688 C LYS 106 34.358 47.386 31.666 1.00 0.00 ATOM 689 N TRP 107 34.696 48.540 31.110 1.00 0.00 ATOM 690 CA TRP 107 36.050 49.115 30.999 1.00 0.00 ATOM 691 CB TRP 107 35.961 50.605 30.681 1.00 0.00 ATOM 692 CG TRP 107 34.686 51.112 30.038 1.00 0.00 ATOM 693 CD1 TRP 107 34.467 50.928 28.760 1.00 0.00 ATOM 694 CD2 TRP 107 33.612 51.810 30.571 1.00 0.00 ATOM 695 CE2 TRP 107 32.741 52.010 29.524 1.00 0.00 ATOM 696 CE3 TRP 107 33.288 52.323 31.820 1.00 0.00 ATOM 697 NE1 TRP 107 33.308 51.475 28.450 1.00 0.00 ATOM 698 CZ2 TRP 107 31.545 52.687 29.701 1.00 0.00 ATOM 699 CZ3 TRP 107 32.096 53.012 32.016 1.00 0.00 ATOM 700 CH2 TRP 107 31.218 53.190 30.952 1.00 0.00 ATOM 701 O TRP 107 37.966 49.022 32.495 1.00 0.00 ATOM 702 C TRP 107 36.753 49.131 32.353 1.00 0.00 ATOM 703 N GLN 108 35.995 49.653 33.307 1.00 0.00 ATOM 704 CA GLN 108 36.482 49.987 34.648 1.00 0.00 ATOM 705 CB GLN 108 35.312 50.633 35.388 1.00 0.00 ATOM 706 CG GLN 108 35.047 52.049 34.868 1.00 0.00 ATOM 707 CD GLN 108 33.797 52.673 35.483 1.00 0.00 ATOM 708 OE1 GLN 108 32.687 52.161 35.430 1.00 0.00 ATOM 709 NE2 GLN 108 33.937 53.885 35.942 1.00 0.00 ATOM 710 O GLN 108 38.050 48.941 36.109 1.00 0.00 ATOM 711 C GLN 108 37.071 48.774 35.372 1.00 0.00 ATOM 712 N ASP 109 36.731 47.586 34.868 1.00 0.00 ATOM 713 CA ASP 109 37.276 46.325 35.379 1.00 0.00 ATOM 714 CB ASP 109 36.201 45.248 35.389 1.00 0.00 ATOM 715 CG ASP 109 34.922 45.603 36.163 1.00 0.00 ATOM 716 OD1 ASP 109 33.863 45.132 35.715 1.00 0.00 ATOM 717 OD2 ASP 109 35.013 46.475 37.047 1.00 0.00 ATOM 718 O ASP 109 39.091 44.835 34.872 1.00 0.00 ATOM 719 C ASP 109 38.467 45.836 34.551 1.00 0.00 ATOM 720 N LEU 110 38.902 46.625 33.574 1.00 0.00 ATOM 721 CA LEU 110 40.046 46.230 32.732 1.00 0.00 ATOM 722 CB LEU 110 40.328 47.260 31.642 1.00 0.00 ATOM 723 CG LEU 110 39.188 47.306 30.623 1.00 0.00 ATOM 724 CD1 LEU 110 39.384 48.402 29.597 1.00 0.00 ATOM 725 CD2 LEU 110 39.034 45.966 29.902 1.00 0.00 ATOM 726 O LEU 110 41.967 45.003 33.425 1.00 0.00 ATOM 727 C LEU 110 41.297 46.018 33.571 1.00 0.00 ATOM 728 N GLU 111 41.588 46.979 34.430 1.00 0.00 ATOM 729 CA GLU 111 42.780 46.975 35.297 1.00 0.00 ATOM 730 CB GLU 111 42.581 46.023 36.472 1.00 0.00 ATOM 731 CG GLU 111 41.794 46.782 37.530 1.00 0.00 ATOM 732 CD GLU 111 41.496 46.001 38.813 1.00 0.00 ATOM 733 OE1 GLU 111 42.076 44.913 38.998 1.00 0.00 ATOM 734 OE2 GLU 111 40.652 46.550 39.553 1.00 0.00 ATOM 735 O GLU 111 44.672 45.659 34.706 1.00 0.00 ATOM 736 C GLU 111 44.025 46.649 34.459 1.00 0.00 ATOM 737 N VAL 112 44.118 47.320 33.316 1.00 0.00 ATOM 738 CA VAL 112 45.083 47.034 32.231 1.00 0.00 ATOM 739 CB VAL 112 45.907 48.264 31.822 1.00 0.00 ATOM 740 CG1 VAL 112 44.991 49.145 30.987 1.00 0.00 ATOM 741 CG2 VAL 112 46.498 49.062 32.978 1.00 0.00 ATOM 742 O VAL 112 45.721 45.097 31.065 1.00 0.00 ATOM 743 C VAL 112 45.908 45.747 32.083 1.00 0.00 ATOM 744 N GLY 113 46.710 45.325 33.080 1.00 0.00 ATOM 745 CA GLY 113 47.431 44.035 33.049 1.00 0.00 ATOM 746 O GLY 113 47.018 41.802 32.237 1.00 0.00 ATOM 747 C GLY 113 46.534 42.812 32.750 1.00 0.00 ATOM 748 N GLN 114 45.248 42.915 33.049 1.00 0.00 ATOM 749 CA GLN 114 44.248 41.849 32.830 1.00 0.00 ATOM 750 CB GLN 114 42.863 42.238 33.340 1.00 0.00 ATOM 751 CG GLN 114 42.803 42.381 34.851 1.00 0.00 ATOM 752 CD GLN 114 43.002 41.026 35.496 1.00 0.00 ATOM 753 OE1 GLN 114 42.374 40.037 35.145 1.00 0.00 ATOM 754 NE2 GLN 114 43.841 41.015 36.493 1.00 0.00 ATOM 755 O GLN 114 43.565 42.227 30.546 1.00 0.00 ATOM 756 C GLN 114 44.068 41.465 31.371 1.00 0.00 ATOM 757 N VAL 115 44.337 40.192 31.125 1.00 0.00 ATOM 758 CA VAL 115 44.116 39.612 29.802 1.00 0.00 ATOM 759 CB VAL 115 44.950 38.320 29.695 1.00 0.00 ATOM 760 CG1 VAL 115 46.429 38.584 29.853 1.00 0.00 ATOM 761 CG2 VAL 115 44.538 37.194 30.646 1.00 0.00 ATOM 762 O VAL 115 41.797 39.217 30.469 1.00 0.00 ATOM 763 C VAL 115 42.589 39.480 29.553 1.00 0.00 ATOM 764 N VAL 116 42.175 39.768 28.327 1.00 0.00 ATOM 765 CA VAL 116 40.761 39.596 27.907 1.00 0.00 ATOM 766 CB VAL 116 40.220 40.908 27.336 1.00 0.00 ATOM 767 CG1 VAL 116 40.185 42.041 28.376 1.00 0.00 ATOM 768 CG2 VAL 116 40.928 41.250 26.036 1.00 0.00 ATOM 769 O VAL 116 41.375 38.003 26.166 1.00 0.00 ATOM 770 C VAL 116 40.508 38.468 26.880 1.00 0.00 ATOM 771 N MET 117 39.246 38.166 26.658 1.00 0.00 ATOM 772 CA MET 117 38.862 37.439 25.448 1.00 0.00 ATOM 773 CB MET 117 38.188 36.115 25.785 1.00 0.00 ATOM 774 CG MET 117 39.270 35.159 26.280 1.00 0.00 ATOM 775 SD MET 117 38.666 33.551 26.894 1.00 0.00 ATOM 776 CE MET 117 38.021 32.978 25.337 1.00 0.00 ATOM 777 O MET 117 37.211 39.128 25.031 1.00 0.00 ATOM 778 C MET 117 38.063 38.372 24.548 1.00 0.00 ATOM 779 N LEU 118 38.518 38.466 23.302 1.00 0.00 ATOM 780 CA LEU 118 38.017 39.506 22.390 1.00 0.00 ATOM 781 CB LEU 118 39.147 40.104 21.554 1.00 0.00 ATOM 782 CG LEU 118 40.136 40.930 22.352 1.00 0.00 ATOM 783 CD1 LEU 118 41.191 41.402 21.348 1.00 0.00 ATOM 784 CD2 LEU 118 39.450 42.111 23.049 1.00 0.00 ATOM 785 O LEU 118 36.840 37.790 21.223 1.00 0.00 ATOM 786 C LEU 118 36.931 38.978 21.475 1.00 0.00 ATOM 787 N ASN 119 36.012 39.881 21.165 1.00 0.00 ATOM 788 CA ASN 119 34.915 39.547 20.259 1.00 0.00 ATOM 789 CB ASN 119 33.633 39.890 21.015 1.00 0.00 ATOM 790 CG ASN 119 32.403 39.289 20.353 1.00 0.00 ATOM 791 ND2 ASN 119 31.347 40.060 20.386 1.00 0.00 ATOM 792 OD1 ASN 119 32.354 38.179 19.842 1.00 0.00 ATOM 793 O ASN 119 34.088 40.583 18.206 1.00 0.00 ATOM 794 C ASN 119 35.042 40.348 18.950 1.00 0.00 ATOM 795 N TYR 120 36.277 40.790 18.684 1.00 0.00 ATOM 796 CA TYR 120 36.582 41.560 17.473 1.00 0.00 ATOM 797 CB TYR 120 38.040 42.018 17.448 1.00 0.00 ATOM 798 CG TYR 120 38.243 42.908 16.222 1.00 0.00 ATOM 799 CD1 TYR 120 38.060 44.274 16.356 1.00 0.00 ATOM 800 CD2 TYR 120 38.531 42.374 14.978 1.00 0.00 ATOM 801 CE1 TYR 120 38.156 45.111 15.266 1.00 0.00 ATOM 802 CE2 TYR 120 38.636 43.208 13.878 1.00 0.00 ATOM 803 CZ TYR 120 38.429 44.563 14.036 1.00 0.00 ATOM 804 OH TYR 120 38.625 45.385 13.004 1.00 0.00 ATOM 805 O TYR 120 37.028 39.723 15.995 1.00 0.00 ATOM 806 C TYR 120 36.318 40.703 16.240 1.00 0.00 ATOM 807 N ASN 121 35.503 41.267 15.372 1.00 0.00 ATOM 808 CA ASN 121 35.269 40.641 14.067 1.00 0.00 ATOM 809 CB ASN 121 33.788 40.330 13.877 1.00 0.00 ATOM 810 CG ASN 121 33.552 39.502 12.617 1.00 0.00 ATOM 811 ND2 ASN 121 32.514 38.716 12.667 1.00 0.00 ATOM 812 OD1 ASN 121 34.243 39.545 11.612 1.00 0.00 ATOM 813 O ASN 121 35.307 42.732 12.962 1.00 0.00 ATOM 814 C ASN 121 35.782 41.603 12.997 1.00 0.00 ATOM 815 N PRO 122 36.777 41.194 12.206 1.00 0.00 ATOM 816 CA PRO 122 37.347 42.024 11.135 1.00 0.00 ATOM 817 CB PRO 122 38.285 41.129 10.357 1.00 0.00 ATOM 818 CG PRO 122 38.719 40.144 11.416 1.00 0.00 ATOM 819 CD PRO 122 37.521 39.950 12.349 1.00 0.00 ATOM 820 O PRO 122 36.756 43.550 9.526 1.00 0.00 ATOM 821 C PRO 122 36.330 42.606 10.183 1.00 0.00 ATOM 822 N ASP 123 35.181 41.948 10.075 1.00 0.00 ATOM 823 CA ASP 123 34.008 42.334 9.265 1.00 0.00 ATOM 824 CB ASP 123 34.285 43.155 7.996 1.00 0.00 ATOM 825 CG ASP 123 34.495 44.634 8.295 1.00 0.00 ATOM 826 OD1 ASP 123 34.767 45.315 7.294 1.00 0.00 ATOM 827 OD2 ASP 123 34.435 45.054 9.476 1.00 0.00 ATOM 828 O ASP 123 32.150 40.843 9.261 1.00 0.00 ATOM 829 C ASP 123 33.261 41.095 8.809 1.00 0.00 ATOM 830 N ASN 124 33.912 40.327 7.963 1.00 0.00 ATOM 831 CA ASN 124 33.267 39.122 7.436 1.00 0.00 ATOM 832 CB ASN 124 32.676 39.562 6.101 1.00 0.00 ATOM 833 CG ASN 124 33.743 40.004 5.122 1.00 0.00 ATOM 834 ND2 ASN 124 33.512 41.159 4.603 1.00 0.00 ATOM 835 OD1 ASN 124 34.623 39.273 4.705 1.00 0.00 ATOM 836 O ASN 124 35.047 37.944 8.482 1.00 0.00 ATOM 837 C ASN 124 34.244 37.934 7.538 1.00 0.00 ATOM 838 N PRO 125 34.107 36.852 6.762 1.00 0.00 ATOM 839 CA PRO 125 35.041 35.734 6.895 1.00 0.00 ATOM 840 CB PRO 125 34.476 34.640 6.000 1.00 0.00 ATOM 841 CG PRO 125 33.491 35.345 5.076 1.00 0.00 ATOM 842 CD PRO 125 32.953 36.455 5.941 1.00 0.00 ATOM 843 O PRO 125 36.780 37.329 6.542 1.00 0.00 ATOM 844 C PRO 125 36.495 36.144 6.654 1.00 0.00 ATOM 845 N LYS 126 37.394 35.204 6.911 1.00 0.00 ATOM 846 CA LYS 126 38.860 35.382 7.033 1.00 0.00 ATOM 847 CB LYS 126 39.561 36.659 6.530 1.00 0.00 ATOM 848 CG LYS 126 39.387 36.917 5.033 1.00 0.00 ATOM 849 CD LYS 126 39.831 35.722 4.198 1.00 0.00 ATOM 850 CE LYS 126 41.312 35.449 4.406 1.00 0.00 ATOM 851 NZ LYS 126 41.761 34.275 3.688 1.00 0.00 ATOM 852 O LYS 126 39.554 34.238 8.989 1.00 0.00 ATOM 853 C LYS 126 39.129 35.285 8.519 1.00 0.00 ATOM 854 N GLU 127 38.786 36.355 9.218 1.00 0.00 ATOM 855 CA GLU 127 38.757 36.269 10.676 1.00 0.00 ATOM 856 CB GLU 127 39.865 37.153 11.265 1.00 0.00 ATOM 857 CG GLU 127 41.278 36.945 10.693 1.00 0.00 ATOM 858 CD GLU 127 41.875 35.574 11.017 1.00 0.00 ATOM 859 OE1 GLU 127 41.680 35.142 12.176 1.00 0.00 ATOM 860 OE2 GLU 127 42.506 35.005 10.088 1.00 0.00 ATOM 861 O GLU 127 36.777 37.649 10.793 1.00 0.00 ATOM 862 C GLU 127 37.324 36.595 11.116 1.00 0.00 ATOM 863 N ARG 128 36.628 35.535 11.491 1.00 0.00 ATOM 864 CA ARG 128 35.209 35.603 11.924 1.00 0.00 ATOM 865 CB ARG 128 34.221 35.641 10.737 1.00 0.00 ATOM 866 CG ARG 128 32.752 35.677 11.148 1.00 0.00 ATOM 867 CD ARG 128 31.803 35.745 9.954 1.00 0.00 ATOM 868 NE ARG 128 30.571 36.393 10.442 1.00 0.00 ATOM 869 CZ ARG 128 29.395 36.418 9.835 1.00 0.00 ATOM 870 NH1 ARG 128 29.227 35.803 8.688 1.00 0.00 ATOM 871 NH2 ARG 128 28.363 37.080 10.342 1.00 0.00 ATOM 872 O ARG 128 35.319 33.258 12.365 1.00 0.00 ATOM 873 C ARG 128 34.947 34.341 12.748 1.00 0.00 ATOM 874 N GLY 129 34.434 34.538 13.948 1.00 0.00 ATOM 875 CA GLY 129 33.851 33.430 14.742 1.00 0.00 ATOM 876 O GLY 129 34.460 31.737 16.327 1.00 0.00 ATOM 877 C GLY 129 34.707 32.862 15.882 1.00 0.00 ATOM 878 N PHE 130 35.761 33.584 16.258 1.00 0.00 ATOM 879 CA PHE 130 36.586 33.173 17.404 1.00 0.00 ATOM 880 CB PHE 130 38.076 33.020 17.073 1.00 0.00 ATOM 881 CG PHE 130 38.718 34.304 16.521 1.00 0.00 ATOM 882 CD1 PHE 130 39.222 35.287 17.357 1.00 0.00 ATOM 883 CD2 PHE 130 38.776 34.460 15.152 1.00 0.00 ATOM 884 CE1 PHE 130 39.769 36.450 16.809 1.00 0.00 ATOM 885 CE2 PHE 130 39.330 35.611 14.606 1.00 0.00 ATOM 886 CZ PHE 130 39.817 36.609 15.440 1.00 0.00 ATOM 887 O PHE 130 36.405 35.347 18.407 1.00 0.00 ATOM 888 C PHE 130 36.442 34.128 18.580 1.00 0.00 ATOM 889 N TRP 131 36.433 33.537 19.766 1.00 0.00 ATOM 890 CA TRP 131 36.784 34.255 20.999 1.00 0.00 ATOM 891 CB TRP 131 35.871 33.805 22.155 1.00 0.00 ATOM 892 CG TRP 131 34.447 34.366 22.058 1.00 0.00 ATOM 893 CD1 TRP 131 33.417 33.850 21.403 1.00 0.00 ATOM 894 CD2 TRP 131 33.999 35.548 22.642 1.00 0.00 ATOM 895 CE2 TRP 131 32.665 35.674 22.300 1.00 0.00 ATOM 896 CE3 TRP 131 34.603 36.518 23.434 1.00 0.00 ATOM 897 NE1 TRP 131 32.343 34.632 21.526 1.00 0.00 ATOM 898 CZ2 TRP 131 31.940 36.750 22.763 1.00 0.00 ATOM 899 CZ3 TRP 131 33.870 37.606 23.895 1.00 0.00 ATOM 900 CH2 TRP 131 32.524 37.725 23.555 1.00 0.00 ATOM 901 O TRP 131 38.783 32.906 20.845 1.00 0.00 ATOM 902 C TRP 131 38.269 33.957 21.251 1.00 0.00 ATOM 903 N TYR 132 38.995 34.965 21.737 1.00 0.00 ATOM 904 CA TYR 132 40.478 34.859 21.825 1.00 0.00 ATOM 905 CB TYR 132 41.102 35.697 20.699 1.00 0.00 ATOM 906 CG TYR 132 42.361 35.069 20.074 1.00 0.00 ATOM 907 CD1 TYR 132 43.632 35.523 20.393 1.00 0.00 ATOM 908 CD2 TYR 132 42.227 34.116 19.083 1.00 0.00 ATOM 909 CE1 TYR 132 44.756 35.050 19.727 1.00 0.00 ATOM 910 CE2 TYR 132 43.335 33.625 18.412 1.00 0.00 ATOM 911 CZ TYR 132 44.609 34.089 18.729 1.00 0.00 ATOM 912 OH TYR 132 45.687 33.637 18.052 1.00 0.00 ATOM 913 O TYR 132 40.749 36.233 23.773 1.00 0.00 ATOM 914 C TYR 132 41.146 35.249 23.158 1.00 0.00 ATOM 915 N ASP 133 42.283 34.622 23.402 1.00 0.00 ATOM 916 CA ASP 133 43.216 34.960 24.497 1.00 0.00 ATOM 917 CB ASP 133 44.186 33.784 24.649 1.00 0.00 ATOM 918 CG ASP 133 45.237 33.985 25.742 1.00 0.00 ATOM 919 OD1 ASP 133 45.445 35.143 26.176 1.00 0.00 ATOM 920 OD2 ASP 133 45.846 32.966 26.117 1.00 0.00 ATOM 921 O ASP 133 44.731 36.153 23.046 1.00 0.00 ATOM 922 C ASP 133 44.039 36.185 24.058 1.00 0.00 ATOM 923 N ALA 134 43.983 37.243 24.827 1.00 0.00 ATOM 924 CA ALA 134 44.761 38.455 24.545 1.00 0.00 ATOM 925 CB ALA 134 43.697 39.473 24.130 1.00 0.00 ATOM 926 O ALA 134 46.015 38.511 26.698 1.00 0.00 ATOM 927 C ALA 134 45.732 39.012 25.622 1.00 0.00 ATOM 928 N GLU 135 46.346 40.114 25.244 1.00 0.00 ATOM 929 CA GLU 135 47.246 40.875 26.128 1.00 0.00 ATOM 930 CB GLU 135 48.670 40.709 25.630 1.00 0.00 ATOM 931 CG GLU 135 49.702 41.304 26.607 1.00 0.00 ATOM 932 CD GLU 135 51.140 40.997 26.214 1.00 0.00 ATOM 933 OE1 GLU 135 51.310 40.370 25.153 1.00 0.00 ATOM 934 OE2 GLU 135 52.066 41.549 26.857 1.00 0.00 ATOM 935 O GLU 135 46.735 42.892 24.971 1.00 0.00 ATOM 936 C GLU 135 46.818 42.333 26.066 1.00 0.00 ATOM 937 N ILE 136 46.260 42.827 27.157 1.00 0.00 ATOM 938 CA ILE 136 45.784 44.222 27.199 1.00 0.00 ATOM 939 CB ILE 136 44.540 44.397 28.072 1.00 0.00 ATOM 940 CG1 ILE 136 43.431 43.430 27.659 1.00 0.00 ATOM 941 CG2 ILE 136 44.040 45.858 28.033 1.00 0.00 ATOM 942 CD1 ILE 136 42.949 43.734 26.251 1.00 0.00 ATOM 943 O ILE 136 47.353 45.074 28.817 1.00 0.00 ATOM 944 C ILE 136 46.902 45.146 27.679 1.00 0.00 ATOM 945 N SER 137 47.247 46.060 26.798 1.00 0.00 ATOM 946 CA SER 137 48.283 47.065 27.086 1.00 0.00 ATOM 947 CB SER 137 48.995 47.384 25.780 1.00 0.00 ATOM 948 OG SER 137 49.814 46.311 25.352 1.00 0.00 ATOM 949 O SER 137 47.457 48.406 28.921 1.00 0.00 ATOM 950 C SER 137 47.671 48.330 27.715 1.00 0.00 ATOM 951 N ARG 138 47.355 49.289 26.858 1.00 0.00 ATOM 952 CA ARG 138 46.749 50.541 27.306 1.00 0.00 ATOM 953 CB ARG 138 47.467 51.725 26.666 1.00 0.00 ATOM 954 CG ARG 138 47.044 52.996 27.376 1.00 0.00 ATOM 955 CD ARG 138 47.718 54.210 26.773 1.00 0.00 ATOM 956 NE ARG 138 46.852 55.343 27.111 1.00 0.00 ATOM 957 CZ ARG 138 47.191 56.408 27.809 1.00 0.00 ATOM 958 NH1 ARG 138 48.386 56.572 28.322 1.00 0.00 ATOM 959 NH2 ARG 138 46.278 57.328 28.003 1.00 0.00 ATOM 960 O ARG 138 44.828 50.459 25.829 1.00 0.00 ATOM 961 C ARG 138 45.253 50.524 26.985 1.00 0.00 ATOM 962 N LYS 139 44.504 50.769 28.046 1.00 0.00 ATOM 963 CA LYS 139 43.040 51.024 27.993 1.00 0.00 ATOM 964 CB LYS 139 42.443 51.134 29.404 1.00 0.00 ATOM 965 CG LYS 139 40.963 51.441 29.496 1.00 0.00 ATOM 966 CD LYS 139 40.529 51.464 30.954 1.00 0.00 ATOM 967 CE LYS 139 39.033 51.714 31.005 1.00 0.00 ATOM 968 NZ LYS 139 38.511 51.682 32.376 1.00 0.00 ATOM 969 O LYS 139 41.562 52.556 26.852 1.00 0.00 ATOM 970 C LYS 139 42.705 52.296 27.216 1.00 0.00 ATOM 971 N ARG 140 43.728 53.142 27.126 1.00 0.00 ATOM 972 CA ARG 140 43.735 54.531 26.628 1.00 0.00 ATOM 973 CB ARG 140 42.945 54.805 25.351 1.00 0.00 ATOM 974 CG ARG 140 43.148 53.799 24.221 1.00 0.00 ATOM 975 CD ARG 140 44.635 53.786 23.958 1.00 0.00 ATOM 976 NE ARG 140 45.109 55.139 23.657 1.00 0.00 ATOM 977 CZ ARG 140 46.384 55.418 23.477 1.00 0.00 ATOM 978 NH1 ARG 140 46.809 56.623 23.273 1.00 0.00 ATOM 979 NH2 ARG 140 47.308 54.499 23.475 1.00 0.00 ATOM 980 O ARG 140 43.804 56.477 27.900 1.00 0.00 ATOM 981 C ARG 140 43.162 55.471 27.664 1.00 0.00 ATOM 982 N GLU 141 41.915 55.214 28.063 1.00 0.00 ATOM 983 CA GLU 141 41.249 55.729 29.287 1.00 0.00 ATOM 984 CB GLU 141 42.277 55.961 30.396 1.00 0.00 ATOM 985 CG GLU 141 41.678 56.569 31.653 1.00 0.00 ATOM 986 CD GLU 141 42.467 56.291 32.900 1.00 0.00 ATOM 987 OE1 GLU 141 43.364 55.426 32.810 1.00 0.00 ATOM 988 OE2 GLU 141 41.910 56.672 33.949 1.00 0.00 ATOM 989 O GLU 141 38.915 56.019 29.362 1.00 0.00 ATOM 990 C GLU 141 39.986 56.620 29.330 1.00 0.00 ATOM 991 N THR 142 40.065 57.916 29.636 1.00 0.00 ATOM 992 CA THR 142 38.838 58.665 29.996 1.00 0.00 ATOM 993 CB THR 142 39.147 59.965 30.777 1.00 0.00 ATOM 994 CG2 THR 142 37.891 60.644 31.343 1.00 0.00 ATOM 995 OG1 THR 142 40.108 59.715 31.798 1.00 0.00 ATOM 996 O THR 142 36.787 58.597 28.746 1.00 0.00 ATOM 997 C THR 142 37.983 58.852 28.727 1.00 0.00 ATOM 998 N ARG 143 38.661 59.002 27.592 1.00 0.00 ATOM 999 CA ARG 143 37.975 59.126 26.285 1.00 0.00 ATOM 1000 CB ARG 143 38.848 59.654 25.149 1.00 0.00 ATOM 1001 CG ARG 143 37.982 59.955 23.911 1.00 0.00 ATOM 1002 CD ARG 143 38.817 60.537 22.788 1.00 0.00 ATOM 1003 NE ARG 143 37.958 60.709 21.603 1.00 0.00 ATOM 1004 CZ ARG 143 38.376 61.240 20.457 1.00 0.00 ATOM 1005 NH1 ARG 143 39.651 61.562 20.281 1.00 0.00 ATOM 1006 NH2 ARG 143 37.521 61.501 19.480 1.00 0.00 ATOM 1007 O ARG 143 36.427 57.763 25.067 1.00 0.00 ATOM 1008 C ARG 143 37.419 57.788 25.796 1.00 0.00 ATOM 1009 N THR 144 38.169 56.718 26.041 1.00 0.00 ATOM 1010 CA THR 144 37.754 55.404 25.542 1.00 0.00 ATOM 1011 CB THR 144 38.620 54.223 25.922 1.00 0.00 ATOM 1012 CG2 THR 144 39.840 54.308 25.057 1.00 0.00 ATOM 1013 OG1 THR 144 38.903 54.181 27.327 1.00 0.00 ATOM 1014 O THR 144 35.537 54.667 25.225 1.00 0.00 ATOM 1015 C THR 144 36.387 55.006 26.030 1.00 0.00 ATOM 1016 N ALA 145 36.188 55.139 27.338 1.00 0.00 ATOM 1017 CA ALA 145 34.911 54.728 27.946 1.00 0.00 ATOM 1018 CB ALA 145 35.004 54.902 29.445 1.00 0.00 ATOM 1019 O ALA 145 32.629 54.914 27.294 1.00 0.00 ATOM 1020 C ALA 145 33.712 55.477 27.360 1.00 0.00 ATOM 1021 N ARG 146 33.976 56.665 26.822 1.00 0.00 ATOM 1022 CA ARG 146 32.970 57.442 26.090 1.00 0.00 ATOM 1023 CB ARG 146 33.518 58.836 25.778 1.00 0.00 ATOM 1024 CG ARG 146 32.426 59.794 25.284 1.00 0.00 ATOM 1025 CD ARG 146 33.049 61.158 24.973 1.00 0.00 ATOM 1026 NE ARG 146 34.031 61.014 23.884 1.00 0.00 ATOM 1027 CZ ARG 146 33.724 61.006 22.580 1.00 0.00 ATOM 1028 NH1 ARG 146 32.510 61.230 22.144 1.00 0.00 ATOM 1029 NH2 ARG 146 34.650 60.722 21.680 1.00 0.00 ATOM 1030 O ARG 146 31.305 56.382 24.695 1.00 0.00 ATOM 1031 C ARG 146 32.482 56.716 24.845 1.00 0.00 ATOM 1032 N GLU 147 33.440 56.323 24.033 1.00 0.00 ATOM 1033 CA GLU 147 33.050 55.656 22.793 1.00 0.00 ATOM 1034 CB GLU 147 33.712 56.479 21.699 1.00 0.00 ATOM 1035 CG GLU 147 33.259 57.925 21.477 1.00 0.00 ATOM 1036 CD GLU 147 31.814 57.984 21.009 1.00 0.00 ATOM 1037 OE1 GLU 147 31.560 57.359 19.969 1.00 0.00 ATOM 1038 OE2 GLU 147 31.019 58.682 21.661 1.00 0.00 ATOM 1039 O GLU 147 32.892 53.411 21.829 1.00 0.00 ATOM 1040 C GLU 147 33.183 54.097 22.796 1.00 0.00 ATOM 1041 N LEU 148 33.561 53.487 23.926 1.00 0.00 ATOM 1042 CA LEU 148 33.462 52.027 24.187 1.00 0.00 ATOM 1043 CB LEU 148 31.942 51.761 24.254 1.00 0.00 ATOM 1044 CG LEU 148 31.416 50.483 24.891 1.00 0.00 ATOM 1045 CD1 LEU 148 31.569 50.454 26.401 1.00 0.00 ATOM 1046 CD2 LEU 148 29.934 50.364 24.607 1.00 0.00 ATOM 1047 O LEU 148 33.766 50.361 22.402 1.00 0.00 ATOM 1048 C LEU 148 34.274 51.166 23.186 1.00 0.00 ATOM 1049 N TYR 149 35.601 51.248 23.331 1.00 0.00 ATOM 1050 CA TYR 149 36.586 50.491 22.517 1.00 0.00 ATOM 1051 CB TYR 149 36.622 50.995 21.060 1.00 0.00 ATOM 1052 CG TYR 149 36.890 52.502 20.956 1.00 0.00 ATOM 1053 CD1 TYR 149 38.170 52.994 20.801 1.00 0.00 ATOM 1054 CD2 TYR 149 35.831 53.381 20.889 1.00 0.00 ATOM 1055 CE1 TYR 149 38.417 54.344 20.612 1.00 0.00 ATOM 1056 CE2 TYR 149 36.086 54.724 20.671 1.00 0.00 ATOM 1057 CZ TYR 149 37.361 55.236 20.564 1.00 0.00 ATOM 1058 OH TYR 149 37.536 56.588 20.510 1.00 0.00 ATOM 1059 O TYR 149 38.315 51.482 23.861 1.00 0.00 ATOM 1060 C TYR 149 37.989 50.544 23.131 1.00 0.00 ATOM 1061 N ALA 150 38.748 49.476 22.939 1.00 0.00 ATOM 1062 CA ALA 150 40.079 49.334 23.589 1.00 0.00 ATOM 1063 CB ALA 150 39.955 48.507 24.871 1.00 0.00 ATOM 1064 O ALA 150 40.964 47.749 22.006 1.00 0.00 ATOM 1065 C ALA 150 41.184 48.715 22.726 1.00 0.00 ATOM 1066 N ASN 151 42.383 49.250 22.923 1.00 0.00 ATOM 1067 CA ASN 151 43.578 48.771 22.214 1.00 0.00 ATOM 1068 CB ASN 151 44.688 49.826 22.247 1.00 0.00 ATOM 1069 CG ASN 151 45.840 49.425 21.325 1.00 0.00 ATOM 1070 ND2 ASN 151 46.635 50.387 20.962 1.00 0.00 ATOM 1071 OD1 ASN 151 46.062 48.284 20.978 1.00 0.00 ATOM 1072 O ASN 151 44.758 47.437 23.834 1.00 0.00 ATOM 1073 C ASN 151 44.088 47.459 22.797 1.00 0.00 ATOM 1074 N VAL 152 43.785 46.373 22.101 1.00 0.00 ATOM 1075 CA VAL 152 44.263 45.056 22.553 1.00 0.00 ATOM 1076 CB VAL 152 43.212 43.953 22.516 1.00 0.00 ATOM 1077 CG1 VAL 152 43.768 42.655 23.124 1.00 0.00 ATOM 1078 CG2 VAL 152 41.939 44.409 23.211 1.00 0.00 ATOM 1079 O VAL 152 45.397 44.640 20.477 1.00 0.00 ATOM 1080 C VAL 152 45.437 44.621 21.707 1.00 0.00 ATOM 1081 N VAL 153 46.381 44.038 22.429 1.00 0.00 ATOM 1082 CA VAL 153 47.445 43.343 21.723 1.00 0.00 ATOM 1083 CB VAL 153 48.844 43.845 22.149 1.00 0.00 ATOM 1084 CG1 VAL 153 48.824 45.323 21.749 1.00 0.00 ATOM 1085 CG2 VAL 153 49.224 43.738 23.621 1.00 0.00 ATOM 1086 O VAL 153 45.917 41.821 20.764 1.00 0.00 ATOM 1087 C VAL 153 46.970 41.917 21.387 1.00 0.00 ATOM 1088 N LEU 154 47.546 40.852 21.925 1.00 0.00 ATOM 1089 CA LEU 154 47.070 39.461 21.725 1.00 0.00 ATOM 1090 CB LEU 154 47.264 38.850 20.326 1.00 0.00 ATOM 1091 CG LEU 154 46.238 39.051 19.225 1.00 0.00 ATOM 1092 CD1 LEU 154 46.612 38.102 18.078 1.00 0.00 ATOM 1093 CD2 LEU 154 44.817 38.763 19.718 1.00 0.00 ATOM 1094 O LEU 154 49.127 38.932 22.760 1.00 0.00 ATOM 1095 C LEU 154 47.971 38.560 22.544 1.00 0.00 ATOM 1096 N GLY 155 47.393 37.440 22.933 1.00 0.00 ATOM 1097 CA GLY 155 48.148 36.234 23.303 1.00 0.00 ATOM 1098 O GLY 155 48.658 36.196 20.949 1.00 0.00 ATOM 1099 C GLY 155 48.584 35.555 21.995 1.00 0.00 ATOM 1100 N ASP 156 48.891 34.266 22.065 1.00 0.00 ATOM 1101 CA ASP 156 49.340 33.481 20.886 1.00 0.00 ATOM 1102 CB ASP 156 48.082 32.930 20.167 1.00 0.00 ATOM 1103 CG ASP 156 47.416 31.782 20.971 1.00 0.00 ATOM 1104 OD1 ASP 156 48.135 31.208 21.815 1.00 0.00 ATOM 1105 OD2 ASP 156 46.242 31.418 20.714 1.00 0.00 ATOM 1106 O ASP 156 50.725 33.769 18.893 1.00 0.00 ATOM 1107 C ASP 156 50.466 34.141 20.041 1.00 0.00 ATOM 1108 N ASP 157 51.277 34.960 20.706 1.00 0.00 ATOM 1109 CA ASP 157 52.508 35.620 20.190 1.00 0.00 ATOM 1110 CB ASP 157 53.776 34.786 20.411 1.00 0.00 ATOM 1111 CG ASP 157 55.059 35.638 20.276 1.00 0.00 ATOM 1112 OD1 ASP 157 54.964 36.836 19.907 1.00 0.00 ATOM 1113 OD2 ASP 157 56.175 35.123 20.522 1.00 0.00 ATOM 1114 O ASP 157 52.912 35.500 17.805 1.00 0.00 ATOM 1115 C ASP 157 52.470 36.157 18.751 1.00 0.00 ATOM 1116 N SER 158 52.003 37.394 18.626 1.00 0.00 ATOM 1117 CA SER 158 51.958 38.094 17.323 1.00 0.00 ATOM 1118 CB SER 158 51.126 37.277 16.343 1.00 0.00 ATOM 1119 OG SER 158 51.070 37.898 15.053 1.00 0.00 ATOM 1120 O SER 158 50.216 39.622 17.972 1.00 0.00 ATOM 1121 C SER 158 51.335 39.475 17.475 1.00 0.00 ATOM 1122 N LEU 159 51.933 40.405 16.762 1.00 0.00 ATOM 1123 CA LEU 159 51.436 41.798 16.815 1.00 0.00 ATOM 1124 CB LEU 159 52.588 42.737 17.140 1.00 0.00 ATOM 1125 CG LEU 159 53.431 42.388 18.366 1.00 0.00 ATOM 1126 CD1 LEU 159 54.578 43.386 18.487 1.00 0.00 ATOM 1127 CD2 LEU 159 52.609 42.358 19.659 1.00 0.00 ATOM 1128 O LEU 159 50.218 43.378 15.451 1.00 0.00 ATOM 1129 C LEU 159 50.705 42.256 15.545 1.00 0.00 ATOM 1130 N ASN 160 50.569 41.333 14.601 1.00 0.00 ATOM 1131 CA ASN 160 49.815 41.626 13.369 1.00 0.00 ATOM 1132 CB ASN 160 50.179 40.640 12.290 1.00 0.00 ATOM 1133 CG ASN 160 51.505 40.961 11.664 1.00 0.00 ATOM 1134 ND2 ASN 160 52.123 39.990 11.046 1.00 0.00 ATOM 1135 OD1 ASN 160 51.932 42.091 11.747 1.00 0.00 ATOM 1136 O ASN 160 47.606 42.313 12.863 1.00 0.00 ATOM 1137 C ASN 160 48.310 41.572 13.523 1.00 0.00 ATOM 1138 N ASP 161 47.871 40.614 14.314 1.00 0.00 ATOM 1139 CA ASP 161 46.432 40.458 14.583 1.00 0.00 ATOM 1140 CB ASP 161 45.969 38.996 14.415 1.00 0.00 ATOM 1141 CG ASP 161 44.455 38.833 14.475 1.00 0.00 ATOM 1142 OD1 ASP 161 43.776 39.855 14.306 1.00 0.00 ATOM 1143 OD2 ASP 161 43.985 37.691 14.558 1.00 0.00 ATOM 1144 O ASP 161 45.312 40.574 16.760 1.00 0.00 ATOM 1145 C ASP 161 46.022 41.112 15.904 1.00 0.00 ATOM 1146 N CYS 162 46.478 42.351 16.049 1.00 0.00 ATOM 1147 CA CYS 162 46.134 43.179 17.215 1.00 0.00 ATOM 1148 CB CYS 162 47.284 44.147 17.463 1.00 0.00 ATOM 1149 SG CYS 162 48.654 43.185 18.168 1.00 0.00 ATOM 1150 O CYS 162 44.692 45.035 16.577 1.00 0.00 ATOM 1151 C CYS 162 44.792 43.894 17.038 1.00 0.00 ATOM 1152 N ARG 163 43.739 43.164 17.374 1.00 0.00 ATOM 1153 CA ARG 163 42.391 43.699 17.126 1.00 0.00 ATOM 1154 CB ARG 163 41.453 42.558 16.755 1.00 0.00 ATOM 1155 CG ARG 163 41.906 41.792 15.512 1.00 0.00 ATOM 1156 CD ARG 163 41.922 42.639 14.241 1.00 0.00 ATOM 1157 NE ARG 163 42.081 41.820 13.031 1.00 0.00 ATOM 1158 CZ ARG 163 41.719 42.222 11.814 1.00 0.00 ATOM 1159 NH1 ARG 163 41.155 43.407 11.611 1.00 0.00 ATOM 1160 NH2 ARG 163 41.894 41.420 10.783 1.00 0.00 ATOM 1161 O ARG 163 42.035 44.312 19.457 1.00 0.00 ATOM 1162 C ARG 163 41.841 44.569 18.275 1.00 0.00 ATOM 1163 N ILE 164 41.164 45.644 17.873 1.00 0.00 ATOM 1164 CA ILE 164 40.519 46.588 18.832 1.00 0.00 ATOM 1165 CB ILE 164 41.039 48.032 18.695 1.00 0.00 ATOM 1166 CG1 ILE 164 42.540 48.030 18.978 1.00 0.00 ATOM 1167 CG2 ILE 164 40.209 49.098 19.470 1.00 0.00 ATOM 1168 CD1 ILE 164 43.192 49.385 18.830 1.00 0.00 ATOM 1169 O ILE 164 38.586 47.002 17.516 1.00 0.00 ATOM 1170 C ILE 164 39.020 46.597 18.588 1.00 0.00 ATOM 1171 N ILE 165 38.282 46.227 19.631 1.00 0.00 ATOM 1172 CA ILE 165 36.801 46.300 19.538 1.00 0.00 ATOM 1173 CB ILE 165 36.221 44.912 19.140 1.00 0.00 ATOM 1174 CG1 ILE 165 34.786 45.047 18.587 1.00 0.00 ATOM 1175 CG2 ILE 165 36.429 43.855 20.221 1.00 0.00 ATOM 1176 CD1 ILE 165 34.031 43.817 18.110 1.00 0.00 ATOM 1177 O ILE 165 36.736 47.696 21.519 1.00 0.00 ATOM 1178 C ILE 165 36.088 47.027 20.699 1.00 0.00 ATOM 1179 N PHE 166 34.767 46.927 20.698 1.00 0.00 ATOM 1180 CA PHE 166 33.824 47.490 21.664 1.00 0.00 ATOM 1181 CB PHE 166 32.374 47.339 21.191 1.00 0.00 ATOM 1182 CG PHE 166 32.071 48.234 19.999 1.00 0.00 ATOM 1183 CD1 PHE 166 31.459 49.463 20.198 1.00 0.00 ATOM 1184 CD2 PHE 166 32.377 47.806 18.727 1.00 0.00 ATOM 1185 CE1 PHE 166 31.116 50.249 19.107 1.00 0.00 ATOM 1186 CE2 PHE 166 32.065 48.629 17.649 1.00 0.00 ATOM 1187 CZ PHE 166 31.424 49.829 17.823 1.00 0.00 ATOM 1188 O PHE 166 33.804 45.539 23.100 1.00 0.00 ATOM 1189 C PHE 166 33.895 46.768 23.001 1.00 0.00 ATOM 1190 N VAL 167 34.056 47.593 24.021 1.00 0.00 ATOM 1191 CA VAL 167 33.933 47.112 25.418 1.00 0.00 ATOM 1192 CB VAL 167 34.494 48.115 26.440 1.00 0.00 ATOM 1193 CG1 VAL 167 34.426 47.608 27.889 1.00 0.00 ATOM 1194 CG2 VAL 167 35.953 48.425 26.124 1.00 0.00 ATOM 1195 O VAL 167 31.623 47.501 24.977 1.00 0.00 ATOM 1196 C VAL 167 32.443 46.917 25.686 1.00 0.00 ATOM 1197 N ASP 168 32.163 46.128 26.715 1.00 0.00 ATOM 1198 CA ASP 168 30.808 45.740 27.161 1.00 0.00 ATOM 1199 CB ASP 168 29.746 46.843 27.047 1.00 0.00 ATOM 1200 CG ASP 168 28.589 46.567 27.992 1.00 0.00 ATOM 1201 OD1 ASP 168 28.881 46.445 29.197 1.00 0.00 ATOM 1202 OD2 ASP 168 27.417 46.720 27.577 1.00 0.00 ATOM 1203 O ASP 168 29.781 43.605 26.911 1.00 0.00 ATOM 1204 C ASP 168 30.393 44.508 26.363 1.00 0.00 ATOM 1205 N GLU 169 30.973 44.409 25.164 1.00 0.00 ATOM 1206 CA GLU 169 30.937 43.239 24.277 1.00 0.00 ATOM 1207 CB GLU 169 30.907 43.689 22.832 1.00 0.00 ATOM 1208 CG GLU 169 29.614 44.393 22.441 1.00 0.00 ATOM 1209 CD GLU 169 29.695 44.832 20.982 1.00 0.00 ATOM 1210 OE1 GLU 169 30.728 44.561 20.308 1.00 0.00 ATOM 1211 OE2 GLU 169 28.727 45.511 20.579 1.00 0.00 ATOM 1212 O GLU 169 32.166 41.223 23.775 1.00 0.00 ATOM 1213 C GLU 169 32.147 42.304 24.376 1.00 0.00 ATOM 1214 N VAL 170 33.190 42.751 25.072 1.00 0.00 ATOM 1215 CA VAL 170 34.389 41.927 25.305 1.00 0.00 ATOM 1216 CB VAL 170 35.712 42.696 25.121 1.00 0.00 ATOM 1217 CG1 VAL 170 35.895 43.130 23.669 1.00 0.00 ATOM 1218 CG2 VAL 170 35.839 43.896 26.071 1.00 0.00 ATOM 1219 O VAL 170 33.459 41.519 27.480 1.00 0.00 ATOM 1220 C VAL 170 34.337 41.253 26.670 1.00 0.00 ATOM 1221 N PHE 171 35.332 40.441 26.961 1.00 0.00 ATOM 1222 CA PHE 171 35.344 39.654 28.200 1.00 0.00 ATOM 1223 CB PHE 171 35.015 38.197 27.852 1.00 0.00 ATOM 1224 CG PHE 171 35.153 37.264 29.048 1.00 0.00 ATOM 1225 CD1 PHE 171 34.145 37.160 30.008 1.00 0.00 ATOM 1226 CD2 PHE 171 36.309 36.517 29.179 1.00 0.00 ATOM 1227 CE1 PHE 171 34.302 36.304 31.079 1.00 0.00 ATOM 1228 CE2 PHE 171 36.462 35.641 30.253 1.00 0.00 ATOM 1229 CZ PHE 171 35.454 35.536 31.203 1.00 0.00 ATOM 1230 O PHE 171 37.711 39.991 28.323 1.00 0.00 ATOM 1231 C PHE 171 36.672 39.813 28.941 1.00 0.00 ATOM 1232 N LYS 172 36.601 39.607 30.249 1.00 0.00 ATOM 1233 CA LYS 172 37.770 39.709 31.139 1.00 0.00 ATOM 1234 CB LYS 172 37.391 40.719 32.216 1.00 0.00 ATOM 1235 CG LYS 172 38.454 40.887 33.314 1.00 0.00 ATOM 1236 CD LYS 172 37.934 41.832 34.398 1.00 0.00 ATOM 1237 CE LYS 172 38.921 41.946 35.549 1.00 0.00 ATOM 1238 NZ LYS 172 38.447 42.871 36.594 1.00 0.00 ATOM 1239 O LYS 172 37.206 37.741 32.381 1.00 0.00 ATOM 1240 C LYS 172 38.065 38.329 31.733 1.00 0.00 ATOM 1241 N ILE 173 39.267 37.834 31.464 1.00 0.00 ATOM 1242 CA ILE 173 39.686 36.529 32.009 1.00 0.00 ATOM 1243 CB ILE 173 40.809 35.900 31.177 1.00 0.00 ATOM 1244 CG1 ILE 173 40.308 35.710 29.741 1.00 0.00 ATOM 1245 CG2 ILE 173 41.215 34.544 31.771 1.00 0.00 ATOM 1246 CD1 ILE 173 41.459 35.497 28.756 1.00 0.00 ATOM 1247 O ILE 173 41.105 37.439 33.726 1.00 0.00 ATOM 1248 C ILE 173 40.130 36.736 33.455 1.00 0.00 ATOM 1249 N GLU 174 39.406 36.108 34.377 1.00 0.00 ATOM 1250 CA GLU 174 39.812 36.215 35.791 1.00 0.00 ATOM 1251 CB GLU 174 38.763 35.611 36.715 1.00 0.00 ATOM 1252 CG GLU 174 37.609 36.554 37.029 1.00 0.00 ATOM 1253 CD GLU 174 36.694 35.868 38.042 1.00 0.00 ATOM 1254 OE1 GLU 174 35.856 35.063 37.588 1.00 0.00 ATOM 1255 OE2 GLU 174 36.832 36.175 39.242 1.00 0.00 ATOM 1256 O GLU 174 41.876 36.022 37.013 1.00 0.00 ATOM 1257 C GLU 174 41.192 35.605 36.081 1.00 0.00 ATOM 1258 N ARG 175 41.595 34.642 35.249 1.00 0.00 ATOM 1259 CA ARG 175 42.891 33.955 35.393 1.00 0.00 ATOM 1260 CB ARG 175 42.743 32.474 35.061 1.00 0.00 ATOM 1261 CG ARG 175 41.657 31.847 35.920 1.00 0.00 ATOM 1262 CD ARG 175 41.720 30.341 35.815 1.00 0.00 ATOM 1263 NE ARG 175 42.769 29.879 36.726 1.00 0.00 ATOM 1264 CZ ARG 175 43.113 28.608 36.882 1.00 0.00 ATOM 1265 NH1 ARG 175 42.580 27.631 36.159 1.00 0.00 ATOM 1266 NH2 ARG 175 43.961 28.244 37.806 1.00 0.00 ATOM 1267 O ARG 175 43.618 35.187 33.465 1.00 0.00 ATOM 1268 C ARG 175 43.959 34.553 34.469 1.00 0.00 ATOM 1269 N PRO 176 45.236 34.408 34.848 1.00 0.00 ATOM 1270 CA PRO 176 46.354 34.804 33.986 1.00 0.00 ATOM 1271 CB PRO 176 47.612 34.314 34.698 1.00 0.00 ATOM 1272 CG PRO 176 47.102 33.247 35.654 1.00 0.00 ATOM 1273 CD PRO 176 45.748 33.791 36.085 1.00 0.00 ATOM 1274 O PRO 176 45.438 33.298 32.386 1.00 0.00 ATOM 1275 C PRO 176 46.289 34.192 32.600 1.00 0.00 TER END