PFRMAT TS TARGET T0417 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 This was pretty obvously a d.108.1.1 (probable acetyltransferase) METHOD family, but there are many templates with slight differences. METHOD Some of the alignments to the sheet differed a bit, and the final METHOD first model was chosen mainly on the ease of closing the gaps. METHOD METHOD The models were optimized in a dimeric context, with the monomers METHOD dimerized by superimposing them on 2ge3_1 from PQS. METHOD METHOD Model METHOD 1 try18-opt3 < try13-opt3 < dimer-try6 METHOD try6-opt3 < MQAU1-opt3 METHOD MQAU1 is metaserver model based mainly on SAM-T08-server_TS1 METHOD 2 try19-opt3 < try17-opt3 < dimer-try5 METHOD try5-opt3 < try2-opt3 < alignments (mainly 2ge3A) METHOD 3 try14-opt3 < dimer-MQAU1 METHOD MQAU1 is metaserver model based mainly on SAM-T08-server_TS1 METHOD 4 try15-opt3 < dimer-try1 METHOD try1 is automatically generated monomer METHOD (mainly from 1tiqA, I think) METHOD 5 try16-opt3 < dimer-try3 generated from alignments METHOD (mainly from 1yr0A, I think) METHOD METHOD METHOD REMARK 6 REMARK 6 T0417 model 3 Sun Jun 8 19:10:59 2008 MODEL 3 PARENT 1y9k_A 1yr0_A 2ge3_A 3c26_A REMARK 7 REMARK 7 ALLPARENTS 1y9k_A 1yr0_A 2ge3_A 3c26_A ATOM 1 N SER 1 -20.580 32.352 4.781 1.00 0.00 ATOM 2 CA SER 1 -21.044 32.876 6.096 1.00 0.00 ATOM 3 CB SER 1 -20.942 34.401 6.116 1.00 0.00 ATOM 4 OG SER 1 -20.251 34.877 4.975 1.00 0.00 ATOM 5 O SER 1 -22.852 31.296 6.180 1.00 0.00 ATOM 6 C SER 1 -22.486 32.456 6.370 1.00 0.00 ATOM 7 N ASN 2 -23.301 33.413 6.806 1.00 0.00 ATOM 8 CA ASN 2 -24.720 33.156 7.040 1.00 0.00 ATOM 9 CB ASN 2 -25.392 34.395 7.636 1.00 0.00 ATOM 10 CG ASN 2 -24.978 34.646 9.075 1.00 0.00 ATOM 11 ND2 ASN 2 -25.151 35.882 9.530 1.00 0.00 ATOM 12 OD1 ASN 2 -24.512 33.739 9.765 1.00 0.00 ATOM 13 O ASN 2 -26.308 31.876 5.760 1.00 0.00 ATOM 14 C ASN 2 -25.438 32.748 5.745 1.00 0.00 ATOM 15 N ALA 3 -25.043 33.351 4.627 1.00 0.00 ATOM 16 CA ALA 3 -25.658 33.037 3.341 1.00 0.00 ATOM 17 CB ALA 3 -25.177 34.015 2.279 1.00 0.00 ATOM 18 O ALA 3 -26.117 31.016 2.133 1.00 0.00 ATOM 19 C ALA 3 -25.335 31.627 2.862 1.00 0.00 ATOM 20 N MET 4 -24.180 31.110 3.274 1.00 0.00 ATOM 21 CA MET 4 -23.752 29.738 2.874 1.00 0.00 ATOM 22 CB MET 4 -22.003 29.915 3.056 1.00 0.00 ATOM 23 CG MET 4 -21.657 28.899 4.141 1.00 0.00 ATOM 24 SD MET 4 -19.870 28.613 4.281 1.00 0.00 ATOM 25 CE MET 4 -19.414 29.928 5.420 1.00 0.00 ATOM 26 O MET 4 -24.206 27.465 3.435 1.00 0.00 ATOM 27 C MET 4 -24.285 28.646 3.792 1.00 0.00 ATOM 28 N ARG 5 -24.781 29.025 4.977 1.00 0.00 ATOM 29 CA ARG 5 -25.271 28.030 5.937 1.00 0.00 ATOM 30 CB ARG 5 -25.976 28.720 7.107 1.00 0.00 ATOM 31 CG ARG 5 -26.403 27.772 8.219 1.00 0.00 ATOM 32 CD ARG 5 -27.024 28.531 9.381 1.00 0.00 ATOM 33 NE ARG 5 -26.072 29.440 10.013 1.00 0.00 ATOM 34 CZ ARG 5 -25.179 29.069 10.926 1.00 0.00 ATOM 35 NH1 ARG 5 -24.352 29.965 11.448 1.00 0.00 ATOM 36 NH2 ARG 5 -25.117 27.804 11.316 1.00 0.00 ATOM 37 O ARG 5 -27.056 27.482 4.442 1.00 0.00 ATOM 38 C ARG 5 -26.206 27.073 5.236 1.00 0.00 ATOM 39 N LYS 6 -26.074 25.801 5.566 1.00 0.00 ATOM 40 CA LYS 6 -26.886 24.767 4.931 1.00 0.00 ATOM 41 CB LYS 6 -26.566 23.396 5.531 1.00 0.00 ATOM 42 CG LYS 6 -25.172 22.887 5.206 1.00 0.00 ATOM 43 CD LYS 6 -24.983 21.454 5.675 1.00 0.00 ATOM 44 CE LYS 6 -24.867 21.378 7.189 1.00 0.00 ATOM 45 NZ LYS 6 -23.637 22.054 7.684 1.00 0.00 ATOM 46 O LYS 6 -29.157 24.748 4.189 1.00 0.00 ATOM 47 C LYS 6 -28.386 24.962 5.121 1.00 0.00 ATOM 48 N ASP 7 -28.823 25.287 6.290 1.00 0.00 ATOM 49 CA ASP 7 -30.243 25.478 6.560 1.00 0.00 ATOM 50 CB ASP 7 -30.463 25.864 8.024 1.00 0.00 ATOM 51 CG ASP 7 -30.252 24.700 8.972 1.00 0.00 ATOM 52 OD1 ASP 7 -30.135 23.553 8.488 1.00 0.00 ATOM 53 OD2 ASP 7 -30.200 24.933 10.197 1.00 0.00 ATOM 54 O ASP 7 -32.147 26.636 5.679 1.00 0.00 ATOM 55 C ASP 7 -30.916 26.572 5.727 1.00 0.00 ATOM 56 N GLU 8 -30.140 27.428 5.065 1.00 0.00 ATOM 57 CA GLU 8 -30.731 28.581 4.371 1.00 0.00 ATOM 58 CB GLU 8 -29.683 29.677 4.162 1.00 0.00 ATOM 59 CG GLU 8 -29.181 30.306 5.449 1.00 0.00 ATOM 60 CD GLU 8 -30.278 31.011 6.222 1.00 0.00 ATOM 61 OE1 GLU 8 -30.950 31.883 5.636 1.00 0.00 ATOM 62 OE2 GLU 8 -30.466 30.688 7.415 1.00 0.00 ATOM 63 O GLU 8 -32.112 28.881 2.432 1.00 0.00 ATOM 64 C GLU 8 -31.278 28.179 3.004 1.00 0.00 ATOM 65 N THR 9 -30.805 27.051 2.485 1.00 0.00 ATOM 66 CA THR 9 -31.262 26.559 1.171 1.00 0.00 ATOM 67 CB THR 9 -30.381 27.098 0.026 1.00 0.00 ATOM 68 CG2 THR 9 -30.350 28.619 0.049 1.00 0.00 ATOM 69 OG1 THR 9 -29.045 26.604 0.177 1.00 0.00 ATOM 70 O THR 9 -30.555 24.447 2.064 1.00 0.00 ATOM 71 C THR 9 -31.138 25.040 1.156 1.00 0.00 ATOM 72 N SER 10 -31.686 24.411 0.121 1.00 0.00 ATOM 73 CA SER 10 -31.625 22.962 0.002 1.00 0.00 ATOM 74 CB SER 10 -32.715 22.399 -0.912 1.00 0.00 ATOM 75 OG SER 10 -32.541 22.843 -2.247 1.00 0.00 ATOM 76 O SER 10 -29.950 21.301 -0.351 1.00 0.00 ATOM 77 C SER 10 -30.318 22.458 -0.553 1.00 0.00 ATOM 78 N ASN 11 -29.604 23.330 -1.259 1.00 0.00 ATOM 79 CA ASN 11 -28.322 22.958 -1.844 1.00 0.00 ATOM 80 CB ASN 11 -28.756 22.903 -3.471 1.00 0.00 ATOM 81 CG ASN 11 -28.718 24.279 -4.040 1.00 0.00 ATOM 82 ND2 ASN 11 -29.683 24.592 -4.884 1.00 0.00 ATOM 83 OD1 ASN 11 -27.823 25.049 -3.766 1.00 0.00 ATOM 84 O ASN 11 -26.559 24.193 -0.781 1.00 0.00 ATOM 85 C ASN 11 -27.255 23.176 -0.776 1.00 0.00 ATOM 86 N THR 12 -27.125 22.220 0.139 1.00 0.00 ATOM 87 CA THR 12 -26.130 22.320 1.214 1.00 0.00 ATOM 88 CB THR 12 -26.522 21.451 2.422 1.00 0.00 ATOM 89 CG2 THR 12 -27.857 21.901 2.992 1.00 0.00 ATOM 90 OG1 THR 12 -26.631 20.082 2.014 1.00 0.00 ATOM 91 O THR 12 -23.788 21.971 1.605 1.00 0.00 ATOM 92 C THR 12 -24.722 21.891 0.806 1.00 0.00 ATOM 93 N SER 13 -24.573 21.438 -0.435 1.00 0.00 ATOM 94 CA SER 13 -23.272 21.002 -0.929 1.00 0.00 ATOM 95 CB SER 13 -23.596 20.125 -2.249 1.00 0.00 ATOM 96 OG SER 13 -22.432 19.808 -2.987 1.00 0.00 ATOM 97 O SER 13 -21.093 22.013 -0.777 1.00 0.00 ATOM 98 C SER 13 -22.283 22.156 -1.064 1.00 0.00 ATOM 99 N PRO 14 -22.766 23.291 -1.554 1.00 0.00 ATOM 100 CA PRO 14 -21.887 24.432 -1.764 1.00 0.00 ATOM 101 CB PRO 14 -22.631 25.286 -2.792 1.00 0.00 ATOM 102 CG PRO 14 -24.072 24.977 -2.562 1.00 0.00 ATOM 103 CD PRO 14 -24.127 23.533 -2.142 1.00 0.00 ATOM 104 O PRO 14 -22.510 25.445 0.308 1.00 0.00 ATOM 105 C PRO 14 -21.622 25.228 -0.503 1.00 0.00 ATOM 106 N ASP 15 -20.367 25.656 -0.366 1.00 0.00 ATOM 107 CA ASP 15 -19.915 26.658 0.578 1.00 0.00 ATOM 108 CB ASP 15 -18.441 26.439 0.997 1.00 0.00 ATOM 109 CG ASP 15 -17.909 27.523 1.936 1.00 0.00 ATOM 110 OD1 ASP 15 -18.616 28.536 2.144 1.00 0.00 ATOM 111 OD2 ASP 15 -16.784 27.372 2.459 1.00 0.00 ATOM 112 O ASP 15 -19.379 28.372 -1.005 1.00 0.00 ATOM 113 C ASP 15 -20.174 27.968 -0.161 1.00 0.00 ATOM 114 N ILE 16 -21.300 28.606 0.129 1.00 0.00 ATOM 115 CA ILE 16 -21.671 29.845 -0.543 1.00 0.00 ATOM 116 CB ILE 16 -23.159 30.196 -0.094 1.00 0.00 ATOM 117 CG1 ILE 16 -24.104 29.048 -0.499 1.00 0.00 ATOM 118 CG2 ILE 16 -23.614 31.524 -0.738 1.00 0.00 ATOM 119 CD1 ILE 16 -25.556 29.246 -0.050 1.00 0.00 ATOM 120 O ILE 16 -20.580 31.818 -1.349 1.00 0.00 ATOM 121 C ILE 16 -20.628 30.951 -0.472 1.00 0.00 ATOM 122 N SER 17 -19.919 31.044 0.631 1.00 0.00 ATOM 123 CA SER 17 -18.929 32.094 0.769 1.00 0.00 ATOM 124 CB SER 17 -18.331 32.087 2.177 1.00 0.00 ATOM 125 OG SER 17 -17.578 30.909 2.403 1.00 0.00 ATOM 126 O SER 17 -17.242 32.955 -0.656 1.00 0.00 ATOM 127 C SER 17 -17.855 31.953 -0.280 1.00 0.00 ATOM 128 N VAL 18 -17.630 30.718 -0.829 1.00 0.00 ATOM 129 CA VAL 18 -16.572 30.542 -1.815 1.00 0.00 ATOM 130 CB VAL 18 -15.515 29.555 -1.281 1.00 0.00 ATOM 131 CG1 VAL 18 -14.450 29.293 -2.334 1.00 0.00 ATOM 132 CG2 VAL 18 -14.837 30.118 -0.041 1.00 0.00 ATOM 133 O VAL 18 -16.801 30.507 -4.197 1.00 0.00 ATOM 134 C VAL 18 -17.060 29.943 -3.125 1.00 0.00 ATOM 135 N ALA 19 -17.741 28.799 -3.052 1.00 0.00 ATOM 136 CA ALA 19 -18.042 28.100 -4.314 1.00 0.00 ATOM 137 CB ALA 19 -18.800 26.803 -3.944 1.00 0.00 ATOM 138 O ALA 19 -18.798 28.938 -6.409 1.00 0.00 ATOM 139 C ALA 19 -19.016 28.870 -5.192 1.00 0.00 ATOM 140 N GLN 20 -20.070 29.457 -4.617 1.00 0.00 ATOM 141 CA GLN 20 -21.011 30.230 -5.435 1.00 0.00 ATOM 142 CB GLN 20 -22.138 30.797 -4.616 1.00 0.00 ATOM 143 CG GLN 20 -23.060 31.759 -5.405 1.00 0.00 ATOM 144 CD GLN 20 -23.886 31.041 -6.440 1.00 0.00 ATOM 145 OE1 GLN 20 -24.837 30.342 -6.095 1.00 0.00 ATOM 146 NE2 GLN 20 -23.529 31.190 -7.707 1.00 0.00 ATOM 147 O GLN 20 -20.417 31.648 -7.282 1.00 0.00 ATOM 148 C GLN 20 -20.356 31.463 -6.053 1.00 0.00 ATOM 149 N PRO 21 -19.724 32.330 -5.271 1.00 0.00 ATOM 150 CA PRO 21 -19.057 33.489 -5.884 1.00 0.00 ATOM 151 CB PRO 21 -18.339 34.151 -4.724 1.00 0.00 ATOM 152 CG PRO 21 -18.239 33.138 -3.658 1.00 0.00 ATOM 153 CD PRO 21 -19.297 32.107 -3.866 1.00 0.00 ATOM 154 O PRO 21 -17.751 33.878 -7.848 1.00 0.00 ATOM 155 C PRO 21 -17.995 33.105 -6.913 1.00 0.00 ATOM 156 N ALA 22 -17.325 31.961 -6.827 1.00 0.00 ATOM 157 CA ALA 22 -16.236 31.650 -7.755 1.00 0.00 ATOM 158 CB ALA 22 -15.329 30.580 -7.169 1.00 0.00 ATOM 159 O ALA 22 -15.982 31.149 -10.090 1.00 0.00 ATOM 160 C ALA 22 -16.730 31.156 -9.110 1.00 0.00 ATOM 161 N SER 23 -17.994 30.757 -9.160 1.00 0.00 ATOM 162 CA SER 23 -18.627 30.268 -10.381 1.00 0.00 ATOM 163 CB SER 23 -18.056 28.899 -10.750 1.00 0.00 ATOM 164 OG SER 23 -18.425 27.917 -9.799 1.00 0.00 ATOM 165 O SER 23 -20.503 30.406 -8.905 1.00 0.00 ATOM 166 C SER 23 -20.108 30.175 -10.043 1.00 0.00 ATOM 167 N ALA 24 -20.960 29.815 -10.979 1.00 0.00 ATOM 168 CA ALA 24 -22.391 29.710 -10.690 1.00 0.00 ATOM 169 CB ALA 24 -23.194 29.713 -11.981 1.00 0.00 ATOM 170 O ALA 24 -23.673 28.401 -9.139 1.00 0.00 ATOM 171 C ALA 24 -22.725 28.424 -9.929 1.00 0.00 ATOM 172 N LEU 25 -21.956 27.366 -10.172 1.00 0.00 ATOM 173 CA LEU 25 -22.319 26.021 -9.750 1.00 0.00 ATOM 174 CB LEU 25 -21.823 24.989 -10.765 1.00 0.00 ATOM 175 CG LEU 25 -22.324 25.154 -12.201 1.00 0.00 ATOM 176 CD1 LEU 25 -21.725 24.088 -13.106 1.00 0.00 ATOM 177 CD2 LEU 25 -23.839 25.031 -12.258 1.00 0.00 ATOM 178 O LEU 25 -20.864 26.346 -7.875 1.00 0.00 ATOM 179 C LEU 25 -21.724 25.651 -8.399 1.00 0.00 ATOM 180 N ARG 26 -22.201 24.543 -7.844 1.00 0.00 ATOM 181 CA ARG 26 -21.627 23.965 -6.638 1.00 0.00 ATOM 182 CB ARG 26 -22.722 23.370 -5.752 1.00 0.00 ATOM 183 CG ARG 26 -23.393 22.138 -6.340 1.00 0.00 ATOM 184 CD ARG 26 -24.399 21.542 -5.369 1.00 0.00 ATOM 185 NE ARG 26 -25.185 20.473 -5.984 1.00 0.00 ATOM 186 CZ ARG 26 -24.880 19.183 -5.910 1.00 0.00 ATOM 187 NH1 ARG 26 -25.654 18.283 -6.500 1.00 0.00 ATOM 188 NH2 ARG 26 -23.799 18.796 -5.246 1.00 0.00 ATOM 189 O ARG 26 -20.378 22.632 -8.186 1.00 0.00 ATOM 190 C ARG 26 -20.574 22.935 -7.007 1.00 0.00 ATOM 191 N TYR 27 -19.896 22.393 -6.002 1.00 0.00 ATOM 192 CA TYR 27 -18.862 21.392 -6.240 1.00 0.00 ATOM 193 CB TYR 27 -17.927 21.277 -5.006 1.00 0.00 ATOM 194 CG TYR 27 -17.324 22.578 -4.546 1.00 0.00 ATOM 195 CD1 TYR 27 -18.028 23.441 -3.711 1.00 0.00 ATOM 196 CD2 TYR 27 -16.042 22.942 -4.945 1.00 0.00 ATOM 197 CE1 TYR 27 -17.465 24.633 -3.281 1.00 0.00 ATOM 198 CE2 TYR 27 -15.470 24.128 -4.527 1.00 0.00 ATOM 199 CZ TYR 27 -16.180 24.967 -3.695 1.00 0.00 ATOM 200 OH TYR 27 -15.596 26.131 -3.249 1.00 0.00 ATOM 201 O TYR 27 -20.575 19.710 -6.259 1.00 0.00 ATOM 202 C TYR 27 -19.501 20.093 -6.725 1.00 0.00 ATOM 203 N HIS 28 -18.819 19.398 -7.629 1.00 0.00 ATOM 204 CA HIS 28 -19.332 18.142 -8.160 1.00 0.00 ATOM 205 CB HIS 28 -19.621 18.190 -9.663 1.00 0.00 ATOM 206 CG HIS 28 -20.700 19.155 -10.041 1.00 0.00 ATOM 207 CD2 HIS 28 -20.745 20.535 -10.501 1.00 0.00 ATOM 208 ND1 HIS 28 -22.039 18.829 -10.002 1.00 0.00 ATOM 209 CE1 HIS 28 -22.760 19.892 -10.393 1.00 0.00 ATOM 210 NE2 HIS 28 -21.991 20.919 -10.696 1.00 0.00 ATOM 211 O HIS 28 -17.107 17.299 -8.029 1.00 0.00 ATOM 212 C HIS 28 -18.310 17.072 -7.894 1.00 0.00 ATOM 213 N LEU 29 -18.780 15.890 -7.512 1.00 0.00 ATOM 214 CA LEU 29 -17.885 14.774 -7.229 1.00 0.00 ATOM 215 CB LEU 29 -18.299 14.124 -5.906 1.00 0.00 ATOM 216 CG LEU 29 -18.206 15.006 -4.659 1.00 0.00 ATOM 217 CD1 LEU 29 -18.710 14.259 -3.433 1.00 0.00 ATOM 218 CD2 LEU 29 -16.768 15.426 -4.402 1.00 0.00 ATOM 219 O LEU 29 -19.149 13.341 -8.694 1.00 0.00 ATOM 220 C LEU 29 -18.038 13.777 -8.388 1.00 0.00 ATOM 221 N ARG 30 -16.920 13.373 -8.981 1.00 0.00 ATOM 222 CA ARG 30 -16.951 12.425 -10.090 1.00 0.00 ATOM 223 CB ARG 30 -16.960 13.169 -11.429 1.00 0.00 ATOM 224 CG ARG 30 -18.195 14.028 -11.651 1.00 0.00 ATOM 225 CD ARG 30 -19.431 13.173 -11.878 1.00 0.00 ATOM 226 NE ARG 30 -20.585 13.976 -12.275 1.00 0.00 ATOM 227 CZ ARG 30 -21.427 14.550 -11.422 1.00 0.00 ATOM 228 NH1 ARG 30 -22.448 15.261 -11.875 1.00 0.00 ATOM 229 NH2 ARG 30 -21.240 14.410 -10.116 1.00 0.00 ATOM 230 O ARG 30 -14.737 11.876 -9.358 1.00 0.00 ATOM 231 C ARG 30 -15.704 11.544 -10.038 1.00 0.00 ATOM 232 N PRO 31 -15.708 10.464 -10.811 1.00 0.00 ATOM 233 CA PRO 31 -14.514 9.643 -10.966 1.00 0.00 ATOM 234 CB PRO 31 -14.972 8.492 -11.862 1.00 0.00 ATOM 235 CG PRO 31 -16.445 8.404 -11.639 1.00 0.00 ATOM 236 CD PRO 31 -16.926 9.818 -11.474 1.00 0.00 ATOM 237 O PRO 31 -13.620 11.299 -12.450 1.00 0.00 ATOM 238 C PRO 31 -13.380 10.441 -11.612 1.00 0.00 ATOM 239 N PRO 32 -12.161 10.247 -11.119 1.00 0.00 ATOM 240 CA PRO 32 -10.997 10.914 -11.675 1.00 0.00 ATOM 241 CB PRO 32 -9.888 10.488 -10.743 1.00 0.00 ATOM 242 CG PRO 32 -10.351 9.180 -10.161 1.00 0.00 ATOM 243 CD PRO 32 -11.843 9.282 -10.046 1.00 0.00 ATOM 244 O PRO 32 -10.686 9.127 -13.242 1.00 0.00 ATOM 245 C PRO 32 -10.658 10.350 -13.050 1.00 0.00 ATOM 246 N ARG 33 -10.288 11.209 -13.941 1.00 0.00 ATOM 247 CA ARG 33 -9.749 10.844 -15.240 1.00 0.00 ATOM 248 CB ARG 33 -10.501 11.562 -16.362 1.00 0.00 ATOM 249 CG ARG 33 -11.971 11.186 -16.463 1.00 0.00 ATOM 250 CD ARG 33 -12.673 11.989 -17.545 1.00 0.00 ATOM 251 NE ARG 33 -12.681 13.419 -17.246 1.00 0.00 ATOM 252 CZ ARG 33 -13.140 14.353 -18.072 1.00 0.00 ATOM 253 NH1 ARG 33 -13.106 15.630 -17.715 1.00 0.00 ATOM 254 NH2 ARG 33 -13.632 14.007 -19.254 1.00 0.00 ATOM 255 O ARG 33 -7.738 11.899 -14.462 1.00 0.00 ATOM 256 C ARG 33 -8.270 11.208 -15.332 1.00 0.00 ATOM 257 N ARG 34 -7.608 10.742 -16.387 1.00 0.00 ATOM 258 CA ARG 34 -6.199 11.029 -16.574 1.00 0.00 ATOM 259 CB ARG 34 -5.758 10.372 -17.911 1.00 0.00 ATOM 260 CG ARG 34 -4.344 10.722 -18.326 1.00 0.00 ATOM 261 CD ARG 34 -4.127 10.459 -19.804 1.00 0.00 ATOM 262 NE ARG 34 -2.870 11.031 -20.276 1.00 0.00 ATOM 263 CZ ARG 34 -2.543 11.153 -21.559 1.00 0.00 ATOM 264 NH1 ARG 34 -3.382 10.743 -22.501 1.00 0.00 ATOM 265 NH2 ARG 34 -1.379 11.688 -21.902 1.00 0.00 ATOM 266 O ARG 34 -4.928 12.964 -16.036 1.00 0.00 ATOM 267 C ARG 34 -5.953 12.503 -16.541 1.00 0.00 ATOM 268 N ASN 35 -6.896 13.268 -17.081 1.00 0.00 ATOM 269 CA ASN 35 -6.771 14.721 -17.105 1.00 0.00 ATOM 270 CB ASN 35 -8.013 15.299 -17.786 1.00 0.00 ATOM 271 CG ASN 35 -8.006 15.087 -19.288 1.00 0.00 ATOM 272 ND2 ASN 35 -9.178 15.177 -19.900 1.00 0.00 ATOM 273 OD1 ASN 35 -6.955 14.847 -19.884 1.00 0.00 ATOM 274 O ASN 35 -6.284 16.497 -15.567 1.00 0.00 ATOM 275 C ASN 35 -6.731 15.360 -15.721 1.00 0.00 ATOM 276 N ASP 36 -7.200 14.628 -14.715 1.00 0.00 ATOM 277 CA ASP 36 -7.214 15.143 -13.305 1.00 0.00 ATOM 278 CB ASP 36 -8.202 14.371 -12.430 1.00 0.00 ATOM 279 CG ASP 36 -9.649 14.678 -12.773 1.00 0.00 ATOM 280 OD1 ASP 36 -9.890 15.679 -13.483 1.00 0.00 ATOM 281 OD2 ASP 36 -10.537 13.921 -12.334 1.00 0.00 ATOM 282 O ASP 36 -5.740 15.451 -11.445 1.00 0.00 ATOM 283 C ASP 36 -5.874 15.008 -12.584 1.00 0.00 ATOM 284 N GLY 37 -4.894 14.363 -13.214 1.00 0.00 ATOM 285 CA GLY 37 -3.612 14.112 -12.534 1.00 0.00 ATOM 286 O GLY 37 -2.189 15.380 -11.092 1.00 0.00 ATOM 287 C GLY 37 -2.822 15.349 -12.150 1.00 0.00 ATOM 288 N ALA 38 -2.794 16.402 -13.014 1.00 0.00 ATOM 289 CA ALA 38 -2.056 17.626 -12.718 1.00 0.00 ATOM 290 CB ALA 38 -2.074 18.633 -13.858 1.00 0.00 ATOM 291 O ALA 38 -1.930 18.714 -10.581 1.00 0.00 ATOM 292 C ALA 38 -2.667 18.285 -11.486 1.00 0.00 ATOM 293 N ALA 39 -4.015 18.339 -11.403 1.00 0.00 ATOM 294 CA ALA 39 -4.671 18.885 -10.225 1.00 0.00 ATOM 295 CB ALA 39 -6.178 18.895 -10.442 1.00 0.00 ATOM 296 O ALA 39 -4.068 18.572 -7.903 1.00 0.00 ATOM 297 C ALA 39 -4.350 18.027 -8.970 1.00 0.00 ATOM 298 N ILE 40 -4.397 16.708 -9.116 1.00 0.00 ATOM 299 CA ILE 40 -4.112 15.814 -8.000 1.00 0.00 ATOM 300 CB ILE 40 -4.296 14.339 -8.413 1.00 0.00 ATOM 301 CG1 ILE 40 -5.779 14.024 -8.617 1.00 0.00 ATOM 302 CG2 ILE 40 -3.748 13.414 -7.337 1.00 0.00 ATOM 303 CD1 ILE 40 -6.032 12.684 -9.276 1.00 0.00 ATOM 304 O ILE 40 -2.387 16.046 -6.350 1.00 0.00 ATOM 305 C ILE 40 -2.669 16.011 -7.547 1.00 0.00 ATOM 306 N HIS 41 -1.758 16.141 -8.506 1.00 0.00 ATOM 307 CA HIS 41 -0.322 16.342 -8.189 1.00 0.00 ATOM 308 CB HIS 41 0.503 16.367 -9.470 1.00 0.00 ATOM 309 CG HIS 41 1.953 16.632 -9.218 1.00 0.00 ATOM 310 CD2 HIS 41 2.757 17.667 -9.570 1.00 0.00 ATOM 311 ND1 HIS 41 2.723 15.777 -8.465 1.00 0.00 ATOM 312 CE1 HIS 41 3.946 16.270 -8.363 1.00 0.00 ATOM 313 NE2 HIS 41 3.997 17.411 -9.030 1.00 0.00 ATOM 314 O HIS 41 0.646 17.617 -6.396 1.00 0.00 ATOM 315 C HIS 41 -0.091 17.623 -7.383 1.00 0.00 ATOM 316 N GLN 42 -0.722 18.714 -7.806 1.00 0.00 ATOM 317 CA GLN 42 -0.575 19.989 -7.111 1.00 0.00 ATOM 318 CB GLN 42 -1.365 21.114 -7.784 1.00 0.00 ATOM 319 CG GLN 42 -0.827 21.520 -9.146 1.00 0.00 ATOM 320 CD GLN 42 -1.699 22.554 -9.830 1.00 0.00 ATOM 321 OE1 GLN 42 -2.764 22.912 -9.329 1.00 0.00 ATOM 322 NE2 GLN 42 -1.247 23.038 -10.982 1.00 0.00 ATOM 323 O GLN 42 -0.339 20.346 -4.739 1.00 0.00 ATOM 324 C GLN 42 -1.034 19.880 -5.644 1.00 0.00 ATOM 325 N LEU 43 -2.188 19.274 -5.422 1.00 0.00 ATOM 326 CA LEU 43 -2.723 19.114 -4.070 1.00 0.00 ATOM 327 CB LEU 43 -4.129 18.554 -4.087 1.00 0.00 ATOM 328 CG LEU 43 -5.164 19.247 -4.962 1.00 0.00 ATOM 329 CD1 LEU 43 -6.386 18.383 -5.057 1.00 0.00 ATOM 330 CD2 LEU 43 -5.499 20.624 -4.413 1.00 0.00 ATOM 331 O LEU 43 -1.516 18.580 -2.066 1.00 0.00 ATOM 332 C LEU 43 -1.818 18.238 -3.210 1.00 0.00 ATOM 333 N VAL 44 -1.390 17.107 -3.761 1.00 0.00 ATOM 334 CA VAL 44 -0.526 16.205 -3.034 1.00 0.00 ATOM 335 CB VAL 44 -0.263 14.892 -3.812 1.00 0.00 ATOM 336 CG1 VAL 44 0.804 14.080 -3.106 1.00 0.00 ATOM 337 CG2 VAL 44 -1.551 14.074 -3.938 1.00 0.00 ATOM 338 O VAL 44 1.358 16.704 -1.629 1.00 0.00 ATOM 339 C VAL 44 0.815 16.871 -2.722 1.00 0.00 ATOM 340 N SER 45 1.321 17.653 -3.654 1.00 0.00 ATOM 341 CA SER 45 2.608 18.355 -3.479 1.00 0.00 ATOM 342 CB SER 45 2.943 19.145 -4.732 1.00 0.00 ATOM 343 OG SER 45 4.089 19.921 -4.470 1.00 0.00 ATOM 344 O SER 45 3.430 19.406 -1.446 1.00 0.00 ATOM 345 C SER 45 2.551 19.332 -2.280 1.00 0.00 ATOM 346 N GLU 46 1.405 20.015 -2.097 1.00 0.00 ATOM 347 CA GLU 46 1.193 20.881 -0.945 1.00 0.00 ATOM 348 CB GLU 46 -0.069 21.755 -1.071 1.00 0.00 ATOM 349 CG GLU 46 0.106 22.966 -1.980 1.00 0.00 ATOM 350 CD GLU 46 1.337 23.848 -1.676 1.00 0.00 ATOM 351 OE1 GLU 46 1.542 24.243 -0.503 1.00 0.00 ATOM 352 OE2 GLU 46 2.105 24.156 -2.617 1.00 0.00 ATOM 353 O GLU 46 1.679 20.435 1.338 1.00 0.00 ATOM 354 C GLU 46 1.154 20.024 0.300 1.00 0.00 ATOM 355 N CYS 47 0.568 18.832 0.201 1.00 0.00 ATOM 356 CA CYS 47 0.534 17.902 1.322 1.00 0.00 ATOM 357 CB CYS 47 -0.296 16.667 0.970 1.00 0.00 ATOM 358 SG CYS 47 -2.046 17.007 0.662 1.00 0.00 ATOM 359 O CYS 47 2.823 17.395 0.779 1.00 0.00 ATOM 360 C CYS 47 1.941 17.410 1.647 1.00 0.00 ATOM 361 N PRO 48 2.162 16.982 2.893 1.00 0.00 ATOM 362 CA PRO 48 3.483 16.489 3.291 1.00 0.00 ATOM 363 CB PRO 48 3.353 16.210 4.793 1.00 0.00 ATOM 364 CG PRO 48 2.117 16.946 5.210 1.00 0.00 ATOM 365 CD PRO 48 1.203 16.873 3.989 1.00 0.00 ATOM 366 O PRO 48 3.069 14.581 1.876 1.00 0.00 ATOM 367 C PRO 48 3.903 15.381 2.306 1.00 0.00 ATOM 368 N PRO 49 5.148 15.423 1.822 1.00 0.00 ATOM 369 CA PRO 49 5.677 14.440 0.871 1.00 0.00 ATOM 370 CB PRO 49 7.162 14.798 0.761 1.00 0.00 ATOM 371 CG PRO 49 7.497 15.408 2.081 1.00 0.00 ATOM 372 CD PRO 49 6.289 16.204 2.491 1.00 0.00 ATOM 373 O PRO 49 5.423 12.081 0.430 1.00 0.00 ATOM 374 C PRO 49 5.547 12.970 1.283 1.00 0.00 ATOM 375 N LEU 50 5.502 14.058 -2.484 1.00 0.00 ATOM 376 CA LEU 50 5.688 13.169 -3.623 1.00 0.00 ATOM 377 CB LEU 50 4.492 12.237 -3.748 1.00 0.00 ATOM 378 CG LEU 50 4.351 11.265 -2.570 1.00 0.00 ATOM 379 CD1 LEU 50 3.019 10.542 -2.609 1.00 0.00 ATOM 380 CD2 LEU 50 5.487 10.253 -2.605 1.00 0.00 ATOM 381 O LEU 50 4.984 15.007 -5.045 1.00 0.00 ATOM 382 C LEU 50 5.563 13.911 -4.961 1.00 0.00 ATOM 383 N ASP 51 6.045 13.270 -6.016 1.00 0.00 ATOM 384 CA ASP 51 5.921 13.810 -7.354 1.00 0.00 ATOM 385 CB ASP 51 7.150 13.438 -8.188 1.00 0.00 ATOM 386 CG ASP 51 7.245 11.950 -8.452 1.00 0.00 ATOM 387 OD1 ASP 51 6.265 11.231 -8.165 1.00 0.00 ATOM 388 OD2 ASP 51 8.300 11.498 -8.949 1.00 0.00 ATOM 389 O ASP 51 3.932 12.469 -7.415 1.00 0.00 ATOM 390 C ASP 51 4.648 13.287 -8.006 1.00 0.00 ATOM 391 N LEU 52 4.382 13.751 -9.228 1.00 0.00 ATOM 392 CA LEU 52 3.189 13.352 -9.973 1.00 0.00 ATOM 393 CB LEU 52 3.062 14.236 -11.230 1.00 0.00 ATOM 394 CG LEU 52 1.889 13.920 -12.163 1.00 0.00 ATOM 395 CD1 LEU 52 0.550 13.971 -11.448 1.00 0.00 ATOM 396 CD2 LEU 52 1.909 14.857 -13.338 1.00 0.00 ATOM 397 O LEU 52 2.128 11.258 -10.450 1.00 0.00 ATOM 398 C LEU 52 3.189 11.878 -10.373 1.00 0.00 ATOM 399 N ASN 53 4.356 11.310 -10.769 1.00 0.00 ATOM 400 CA ASN 53 4.439 9.907 -11.160 1.00 0.00 ATOM 401 CB ASN 53 5.896 9.591 -11.506 1.00 0.00 ATOM 402 CG ASN 53 6.293 10.110 -12.873 1.00 0.00 ATOM 403 ND2 ASN 53 7.596 10.250 -13.094 1.00 0.00 ATOM 404 OD1 ASN 53 5.441 10.377 -13.720 1.00 0.00 ATOM 405 O ASN 53 3.476 7.969 -10.130 1.00 0.00 ATOM 406 C ASN 53 4.038 9.054 -9.964 1.00 0.00 ATOM 407 N SER 54 4.316 9.552 -8.757 1.00 0.00 ATOM 408 CA SER 54 3.957 8.819 -7.544 1.00 0.00 ATOM 409 CB SER 54 4.353 9.497 -6.291 1.00 0.00 ATOM 410 OG SER 54 3.784 10.789 -6.174 1.00 0.00 ATOM 411 O SER 54 1.886 7.637 -7.203 1.00 0.00 ATOM 412 C SER 54 2.429 8.723 -7.439 1.00 0.00 ATOM 413 N LEU 55 1.737 9.842 -7.654 1.00 0.00 ATOM 414 CA LEU 55 0.271 9.820 -7.643 1.00 0.00 ATOM 415 CB LEU 55 -0.286 11.245 -7.694 1.00 0.00 ATOM 416 CG LEU 55 -0.043 12.112 -6.458 1.00 0.00 ATOM 417 CD1 LEU 55 -0.507 13.539 -6.701 1.00 0.00 ATOM 418 CD2 LEU 55 -0.802 11.563 -5.259 1.00 0.00 ATOM 419 O LEU 55 -1.330 8.373 -8.638 1.00 0.00 ATOM 420 C LEU 55 -0.300 9.046 -8.793 1.00 0.00 ATOM 421 N TYR 56 0.310 9.116 -9.995 1.00 0.00 ATOM 422 CA TYR 56 -0.136 8.364 -11.156 1.00 0.00 ATOM 423 CB TYR 56 0.711 8.645 -12.379 1.00 0.00 ATOM 424 CG TYR 56 0.144 8.021 -13.636 1.00 0.00 ATOM 425 CD1 TYR 56 -0.981 8.566 -14.256 1.00 0.00 ATOM 426 CD2 TYR 56 0.700 6.863 -14.177 1.00 0.00 ATOM 427 CE1 TYR 56 -1.538 7.972 -15.384 1.00 0.00 ATOM 428 CE2 TYR 56 0.146 6.258 -15.307 1.00 0.00 ATOM 429 CZ TYR 56 -0.974 6.820 -15.903 1.00 0.00 ATOM 430 OH TYR 56 -1.529 6.233 -17.018 1.00 0.00 ATOM 431 O TYR 56 -1.070 6.138 -11.222 1.00 0.00 ATOM 432 C TYR 56 -0.128 6.846 -10.863 1.00 0.00 ATOM 433 N ALA 57 0.930 6.365 -10.217 1.00 0.00 ATOM 434 CA ALA 57 1.036 4.948 -9.890 1.00 0.00 ATOM 435 CB ALA 57 2.441 4.624 -9.436 1.00 0.00 ATOM 436 O ALA 57 -0.707 3.570 -8.984 1.00 0.00 ATOM 437 C ALA 57 -0.063 4.615 -8.885 1.00 0.00 ATOM 438 N TYR 58 -0.276 5.505 -7.921 1.00 0.00 ATOM 439 CA TYR 58 -1.312 5.293 -6.897 1.00 0.00 ATOM 440 CB TYR 58 -1.364 6.448 -5.931 1.00 0.00 ATOM 441 CG TYR 58 -2.436 6.266 -4.887 1.00 0.00 ATOM 442 CD1 TYR 58 -2.220 5.450 -3.778 1.00 0.00 ATOM 443 CD2 TYR 58 -3.670 6.889 -5.017 1.00 0.00 ATOM 444 CE1 TYR 58 -3.213 5.265 -2.820 1.00 0.00 ATOM 445 CE2 TYR 58 -4.672 6.714 -4.071 1.00 0.00 ATOM 446 CZ TYR 58 -4.434 5.901 -2.973 1.00 0.00 ATOM 447 OH TYR 58 -5.405 5.738 -2.019 1.00 0.00 ATOM 448 O TYR 58 -3.426 4.267 -7.308 1.00 0.00 ATOM 449 C TYR 58 -2.658 5.164 -7.604 1.00 0.00 ATOM 450 N LEU 59 -2.920 6.054 -8.548 1.00 0.00 ATOM 451 CA LEU 59 -4.186 6.016 -9.298 1.00 0.00 ATOM 452 CB LEU 59 -4.216 7.156 -10.318 1.00 0.00 ATOM 453 CG LEU 59 -5.463 7.247 -11.197 1.00 0.00 ATOM 454 CD1 LEU 59 -6.704 7.480 -10.351 1.00 0.00 ATOM 455 CD2 LEU 59 -5.340 8.394 -12.189 1.00 0.00 ATOM 456 O LEU 59 -5.399 4.074 -10.049 1.00 0.00 ATOM 457 C LEU 59 -4.338 4.698 -10.081 1.00 0.00 ATOM 458 N LEU 60 -3.269 4.273 -10.747 1.00 0.00 ATOM 459 CA LEU 60 -3.305 3.036 -11.519 1.00 0.00 ATOM 460 CB LEU 60 -1.990 2.801 -12.264 1.00 0.00 ATOM 461 CG LEU 60 -1.906 1.527 -13.106 1.00 0.00 ATOM 462 CD1 LEU 60 -2.961 1.535 -14.202 1.00 0.00 ATOM 463 CD2 LEU 60 -0.540 1.405 -13.761 1.00 0.00 ATOM 464 O LEU 60 -4.286 0.920 -10.957 1.00 0.00 ATOM 465 C LEU 60 -3.566 1.849 -10.596 1.00 0.00 ATOM 466 N LEU 61 -2.977 1.885 -9.404 1.00 0.00 ATOM 467 CA LEU 61 -3.157 0.790 -8.421 1.00 0.00 ATOM 468 CB LEU 61 -2.281 1.011 -7.177 1.00 0.00 ATOM 469 CG LEU 61 -0.798 0.658 -7.357 1.00 0.00 ATOM 470 CD1 LEU 61 -0.003 1.167 -6.157 1.00 0.00 ATOM 471 CD2 LEU 61 -0.640 -0.851 -7.517 1.00 0.00 ATOM 472 O LEU 61 -5.233 -0.309 -7.933 1.00 0.00 ATOM 473 C LEU 61 -4.625 0.759 -8.009 1.00 0.00 ATOM 474 N CYS 62 -5.191 1.932 -7.744 1.00 0.00 ATOM 475 CA CYS 62 -6.612 2.029 -7.336 1.00 0.00 ATOM 476 CB CYS 62 -7.071 3.591 -7.702 1.00 0.00 ATOM 477 SG CYS 62 -8.414 4.394 -6.793 1.00 0.00 ATOM 478 O CYS 62 -8.501 0.795 -8.202 1.00 0.00 ATOM 479 C CYS 62 -7.522 1.510 -8.452 1.00 0.00 ATOM 480 N GLU 63 -7.209 1.873 -9.714 1.00 0.00 ATOM 481 CA GLU 63 -7.986 1.427 -10.881 1.00 0.00 ATOM 482 CB GLU 63 -7.391 2.080 -12.129 1.00 0.00 ATOM 483 CG GLU 63 -8.130 1.751 -13.415 1.00 0.00 ATOM 484 CD GLU 63 -7.533 2.443 -14.626 1.00 0.00 ATOM 485 OE1 GLU 63 -6.547 3.190 -14.456 1.00 0.00 ATOM 486 OE2 GLU 63 -8.052 2.237 -15.743 1.00 0.00 ATOM 487 O GLU 63 -8.893 -0.774 -11.186 1.00 0.00 ATOM 488 C GLU 63 -7.892 -0.093 -10.954 1.00 0.00 ATOM 489 N HIS 64 -6.691 -0.625 -10.754 1.00 0.00 ATOM 490 CA HIS 64 -6.491 -2.056 -10.799 1.00 0.00 ATOM 491 CB HIS 64 -4.992 -2.353 -10.726 1.00 0.00 ATOM 492 CG HIS 64 -4.644 -3.782 -11.011 1.00 0.00 ATOM 493 CD2 HIS 64 -4.080 -4.885 -10.246 1.00 0.00 ATOM 494 ND1 HIS 64 -4.839 -4.363 -12.245 1.00 0.00 ATOM 495 CE1 HIS 64 -4.436 -5.645 -12.192 1.00 0.00 ATOM 496 NE2 HIS 64 -3.979 -5.965 -10.996 1.00 0.00 ATOM 497 O HIS 64 -7.695 -3.953 -9.943 1.00 0.00 ATOM 498 C HIS 64 -7.241 -2.833 -9.711 1.00 0.00 ATOM 499 N HIS 65 -7.366 -2.234 -8.531 1.00 0.00 ATOM 500 CA HIS 65 -8.063 -2.881 -7.425 1.00 0.00 ATOM 501 CB HIS 65 -7.115 -2.754 -6.117 1.00 0.00 ATOM 502 CG HIS 65 -5.782 -3.412 -6.226 1.00 0.00 ATOM 503 CD2 HIS 65 -4.562 -2.991 -5.842 1.00 0.00 ATOM 504 ND1 HIS 65 -5.615 -4.688 -6.744 1.00 0.00 ATOM 505 CE1 HIS 65 -4.316 -4.986 -6.691 1.00 0.00 ATOM 506 NE2 HIS 65 -3.671 -3.981 -6.154 1.00 0.00 ATOM 507 O HIS 65 -10.305 -3.306 -6.686 1.00 0.00 ATOM 508 C HIS 65 -9.576 -2.700 -7.473 1.00 0.00 ATOM 509 N ALA 66 -10.045 -1.857 -8.387 1.00 0.00 ATOM 510 CA ALA 66 -11.493 -1.604 -8.530 1.00 0.00 ATOM 511 CB ALA 66 -12.156 -2.936 -8.832 1.00 0.00 ATOM 512 O ALA 66 -13.252 -0.571 -7.276 1.00 0.00 ATOM 513 C ALA 66 -12.040 -0.647 -7.486 1.00 0.00 ATOM 514 N HIS 67 -11.167 0.074 -6.813 1.00 0.00 ATOM 515 CA HIS 67 -11.573 0.998 -5.761 1.00 0.00 ATOM 516 CB HIS 67 -10.887 1.328 -4.784 1.00 0.00 ATOM 517 CG HIS 67 -9.405 1.233 -4.697 1.00 0.00 ATOM 518 CD2 HIS 67 -8.444 2.169 -4.858 1.00 0.00 ATOM 519 ND1 HIS 67 -8.752 0.038 -4.484 1.00 0.00 ATOM 520 CE1 HIS 67 -7.449 0.248 -4.477 1.00 0.00 ATOM 521 NE2 HIS 67 -7.233 1.527 -4.730 1.00 0.00 ATOM 522 O HIS 67 -11.076 2.787 -7.282 1.00 0.00 ATOM 523 C HIS 67 -11.771 2.405 -6.347 1.00 0.00 ATOM 524 N THR 68 -12.678 3.197 -5.764 1.00 0.00 ATOM 525 CA THR 68 -12.940 4.498 -6.360 1.00 0.00 ATOM 526 CB THR 68 -14.327 5.043 -5.970 1.00 0.00 ATOM 527 CG2 THR 68 -15.420 4.086 -6.425 1.00 0.00 ATOM 528 OG1 THR 68 -14.405 5.188 -4.547 1.00 0.00 ATOM 529 O THR 68 -11.491 5.556 -4.768 1.00 0.00 ATOM 530 C THR 68 -11.961 5.587 -5.907 1.00 0.00 ATOM 531 N CYS 69 -11.662 6.519 -6.818 1.00 0.00 ATOM 532 CA CYS 69 -11.081 7.826 -6.470 1.00 0.00 ATOM 533 CB CYS 69 -9.783 7.998 -7.203 1.00 0.00 ATOM 534 SG CYS 69 -8.547 6.753 -6.722 1.00 0.00 ATOM 535 O CYS 69 -12.589 8.581 -8.117 1.00 0.00 ATOM 536 C CYS 69 -12.045 8.779 -7.030 1.00 0.00 ATOM 537 N VAL 70 -12.283 9.858 -6.291 1.00 0.00 ATOM 538 CA VAL 70 -13.219 10.886 -6.734 1.00 0.00 ATOM 539 CB VAL 70 -14.376 10.779 -5.724 1.00 0.00 ATOM 540 CG1 VAL 70 -15.382 11.898 -5.949 1.00 0.00 ATOM 541 CG2 VAL 70 -15.096 9.448 -5.876 1.00 0.00 ATOM 542 O VAL 70 -11.588 12.405 -5.911 1.00 0.00 ATOM 543 C VAL 70 -12.580 12.240 -6.609 1.00 0.00 ATOM 544 N VAL 71 -13.125 13.205 -7.341 1.00 0.00 ATOM 545 CA VAL 71 -12.632 14.567 -7.302 1.00 0.00 ATOM 546 CB VAL 71 -11.925 14.950 -8.614 1.00 0.00 ATOM 547 CG1 VAL 71 -11.445 16.393 -8.561 1.00 0.00 ATOM 548 CG2 VAL 71 -10.719 14.053 -8.852 1.00 0.00 ATOM 549 O VAL 71 -14.796 15.482 -7.730 1.00 0.00 ATOM 550 C VAL 71 -13.734 15.565 -7.089 1.00 0.00 ATOM 551 N ALA 72 -13.500 16.522 -6.140 1.00 0.00 ATOM 552 CA ALA 72 -14.395 17.652 -5.965 1.00 0.00 ATOM 553 CB ALA 72 -14.257 18.229 -4.564 1.00 0.00 ATOM 554 O ALA 72 -12.822 19.126 -6.973 1.00 0.00 ATOM 555 C ALA 72 -13.954 18.646 -7.011 1.00 0.00 ATOM 556 N GLU 73 -14.843 18.933 -7.965 1.00 0.00 ATOM 557 CA GLU 73 -14.515 19.755 -9.120 1.00 0.00 ATOM 558 CB GLU 73 -14.287 18.860 -10.340 1.00 0.00 ATOM 559 CG GLU 73 -15.520 18.090 -10.783 1.00 0.00 ATOM 560 CD GLU 73 -15.233 17.144 -11.933 1.00 0.00 ATOM 561 OE1 GLU 73 -14.069 17.087 -12.378 1.00 0.00 ATOM 562 OE2 GLU 73 -16.174 16.461 -12.390 1.00 0.00 ATOM 563 O GLU 73 -16.805 20.554 -9.072 1.00 0.00 ATOM 564 C GLU 73 -15.641 20.739 -9.463 1.00 0.00 ATOM 565 N SER 74 -15.292 21.798 -10.178 1.00 0.00 ATOM 566 CA SER 74 -16.319 22.649 -10.759 1.00 0.00 ATOM 567 CB SER 74 -15.880 24.115 -10.735 1.00 0.00 ATOM 568 OG SER 74 -14.805 24.340 -11.630 1.00 0.00 ATOM 569 O SER 74 -15.859 21.339 -12.719 1.00 0.00 ATOM 570 C SER 74 -16.545 22.234 -12.213 1.00 0.00 ATOM 571 N PRO 75 -17.505 22.876 -12.881 1.00 0.00 ATOM 572 CA PRO 75 -17.811 22.549 -14.277 1.00 0.00 ATOM 573 CB PRO 75 -18.729 23.625 -14.778 1.00 0.00 ATOM 574 CG PRO 75 -18.649 24.748 -13.809 1.00 0.00 ATOM 575 CD PRO 75 -18.122 24.186 -12.497 1.00 0.00 ATOM 576 O PRO 75 -16.483 22.046 -16.215 1.00 0.00 ATOM 577 C PRO 75 -16.614 22.742 -15.208 1.00 0.00 ATOM 578 N GLY 76 -15.722 23.701 -14.906 1.00 0.00 ATOM 579 CA GLY 76 -14.556 23.954 -15.733 1.00 0.00 ATOM 580 O GLY 76 -12.640 22.690 -16.418 1.00 0.00 ATOM 581 C GLY 76 -13.507 22.868 -15.556 1.00 0.00 ATOM 582 N GLY 77 -13.615 22.144 -14.407 1.00 0.00 ATOM 583 CA GLY 77 -12.739 20.988 -14.190 1.00 0.00 ATOM 584 O GLY 77 -10.886 20.058 -12.984 1.00 0.00 ATOM 585 C GLY 77 -11.577 21.053 -13.206 1.00 0.00 ATOM 586 N ARG 78 -11.362 22.225 -12.617 1.00 0.00 ATOM 587 CA ARG 78 -10.277 22.402 -11.655 1.00 0.00 ATOM 588 CB ARG 78 -10.084 23.882 -11.310 1.00 0.00 ATOM 589 CG ARG 78 -9.703 24.750 -12.497 1.00 0.00 ATOM 590 CD ARG 78 -9.623 26.217 -12.105 1.00 0.00 ATOM 591 NE ARG 78 -10.940 26.775 -11.810 1.00 0.00 ATOM 592 CZ ARG 78 -11.139 27.954 -11.229 1.00 0.00 ATOM 593 NH1 ARG 78 -12.373 28.382 -10.998 1.00 0.00 ATOM 594 NH2 ARG 78 -10.101 28.702 -10.877 1.00 0.00 ATOM 595 O ARG 78 -11.504 21.592 -9.774 1.00 0.00 ATOM 596 C ARG 78 -10.448 21.577 -10.387 1.00 0.00 ATOM 597 N ILE 79 -9.392 20.833 -9.985 1.00 0.00 ATOM 598 CA ILE 79 -9.440 19.990 -8.795 1.00 0.00 ATOM 599 CB ILE 79 -8.344 18.877 -8.750 1.00 0.00 ATOM 600 CG1 ILE 79 -8.361 17.921 -9.895 1.00 0.00 ATOM 601 CG2 ILE 79 -8.450 18.079 -7.465 1.00 0.00 ATOM 602 CD1 ILE 79 -7.991 16.547 -9.333 1.00 0.00 ATOM 603 O ILE 79 -8.340 21.323 -7.129 1.00 0.00 ATOM 604 C ILE 79 -9.370 20.736 -7.465 1.00 0.00 ATOM 605 N ASP 80 -10.465 20.711 -6.711 1.00 0.00 ATOM 606 CA ASP 80 -10.515 21.395 -5.400 1.00 0.00 ATOM 607 CB ASP 80 -11.901 21.998 -5.163 1.00 0.00 ATOM 608 CG ASP 80 -12.241 23.087 -6.161 1.00 0.00 ATOM 609 OD1 ASP 80 -11.395 23.976 -6.382 1.00 0.00 ATOM 610 OD2 ASP 80 -13.359 23.052 -6.722 1.00 0.00 ATOM 611 O ASP 80 -9.947 20.871 -3.136 1.00 0.00 ATOM 612 C ASP 80 -10.208 20.443 -4.262 1.00 0.00 ATOM 613 N GLY 81 -10.236 19.145 -4.549 1.00 0.00 ATOM 614 CA GLY 81 -9.955 18.139 -3.535 1.00 0.00 ATOM 615 O GLY 81 -10.777 16.636 -5.214 1.00 0.00 ATOM 616 C GLY 81 -10.185 16.758 -4.140 1.00 0.00 ATOM 617 N PHE 82 -9.719 15.721 -3.452 1.00 0.00 ATOM 618 CA PHE 82 -9.886 14.404 -3.933 1.00 0.00 ATOM 619 CB PHE 82 -8.691 13.999 -4.798 1.00 0.00 ATOM 620 CG PHE 82 -7.387 13.955 -4.051 1.00 0.00 ATOM 621 CD1 PHE 82 -6.937 12.774 -3.487 1.00 0.00 ATOM 622 CD2 PHE 82 -6.614 15.095 -3.914 1.00 0.00 ATOM 623 CE1 PHE 82 -5.740 12.733 -2.801 1.00 0.00 ATOM 624 CE2 PHE 82 -5.416 15.054 -3.224 1.00 0.00 ATOM 625 CZ PHE 82 -4.978 13.880 -2.671 1.00 0.00 ATOM 626 O PHE 82 -9.612 13.679 -1.686 1.00 0.00 ATOM 627 C PHE 82 -9.994 13.406 -2.824 1.00 0.00 ATOM 628 N VAL 83 -10.521 12.228 -3.144 1.00 0.00 ATOM 629 CA VAL 83 -10.675 11.174 -2.149 1.00 0.00 ATOM 630 CB VAL 83 -12.103 11.222 -1.571 1.00 0.00 ATOM 631 CG1 VAL 83 -13.129 11.014 -2.674 1.00 0.00 ATOM 632 CG2 VAL 83 -12.291 10.133 -0.525 1.00 0.00 ATOM 633 O VAL 83 -10.865 9.549 -3.902 1.00 0.00 ATOM 634 C VAL 83 -10.408 9.819 -2.791 1.00 0.00 ATOM 635 N SER 84 -9.665 8.967 -2.090 1.00 0.00 ATOM 636 CA SER 84 -9.347 7.640 -2.606 1.00 0.00 ATOM 637 CB SER 84 -7.830 7.454 -2.670 1.00 0.00 ATOM 638 OG SER 84 -7.254 8.297 -3.652 1.00 0.00 ATOM 639 O SER 84 -9.578 6.616 -0.454 1.00 0.00 ATOM 640 C SER 84 -9.934 6.619 -1.635 1.00 0.00 ATOM 641 N ALA 85 -10.760 5.738 -2.130 1.00 0.00 ATOM 642 CA ALA 85 -11.394 4.756 -1.252 1.00 0.00 ATOM 643 CB ALA 85 -12.794 5.200 -0.861 1.00 0.00 ATOM 644 O ALA 85 -11.671 3.441 -3.248 1.00 0.00 ATOM 645 C ALA 85 -11.710 3.483 -2.025 1.00 0.00 ATOM 646 N TYR 86 -12.019 2.446 -1.223 1.00 0.00 ATOM 647 CA TYR 86 -12.349 1.166 -1.840 1.00 0.00 ATOM 648 CB TYR 86 -11.136 0.251 -1.747 1.00 0.00 ATOM 649 CG TYR 86 -11.298 -1.173 -2.259 1.00 0.00 ATOM 650 CD1 TYR 86 -11.813 -1.428 -3.531 1.00 0.00 ATOM 651 CD2 TYR 86 -10.840 -2.252 -1.499 1.00 0.00 ATOM 652 CE1 TYR 86 -11.849 -2.736 -4.035 1.00 0.00 ATOM 653 CE2 TYR 86 -10.874 -3.565 -1.988 1.00 0.00 ATOM 654 CZ TYR 86 -11.367 -3.795 -3.248 1.00 0.00 ATOM 655 OH TYR 86 -11.362 -5.075 -3.754 1.00 0.00 ATOM 656 O TYR 86 -13.284 0.573 0.288 1.00 0.00 ATOM 657 C TYR 86 -13.209 0.314 -0.914 1.00 0.00 ATOM 658 N LEU 87 -13.857 -0.703 -1.473 1.00 0.00 ATOM 659 CA LEU 87 -14.691 -1.567 -0.688 1.00 0.00 ATOM 660 CB LEU 87 -15.827 -2.134 -1.542 1.00 0.00 ATOM 661 CG LEU 87 -16.830 -3.037 -0.821 1.00 0.00 ATOM 662 CD1 LEU 87 -17.644 -2.240 0.186 1.00 0.00 ATOM 663 CD2 LEU 87 -17.798 -3.668 -1.815 1.00 0.00 ATOM 664 O LEU 87 -13.015 -3.255 -1.007 1.00 0.00 ATOM 665 C LEU 87 -13.792 -2.708 -0.222 1.00 0.00 ATOM 666 N LEU 88 -13.900 -3.066 1.053 1.00 0.00 ATOM 667 CA LEU 88 -13.092 -4.146 1.604 1.00 0.00 ATOM 668 CB LEU 88 -13.323 -4.314 3.108 1.00 0.00 ATOM 669 CG LEU 88 -12.469 -5.367 3.812 1.00 0.00 ATOM 670 CD1 LEU 88 -11.003 -4.963 3.803 1.00 0.00 ATOM 671 CD2 LEU 88 -12.905 -5.536 5.257 1.00 0.00 ATOM 672 O LEU 88 -14.685 -5.609 0.574 1.00 0.00 ATOM 673 C LEU 88 -13.502 -5.417 0.872 1.00 0.00 ATOM 674 N PRO 89 -12.543 -6.287 0.575 1.00 0.00 ATOM 675 CA PRO 89 -12.881 -7.527 -0.116 1.00 0.00 ATOM 676 CB PRO 89 -11.667 -7.799 -1.004 1.00 0.00 ATOM 677 CG PRO 89 -10.529 -7.153 -0.290 1.00 0.00 ATOM 678 CD PRO 89 -11.095 -5.926 0.371 1.00 0.00 ATOM 679 O PRO 89 -14.128 -9.419 0.663 1.00 0.00 ATOM 680 C PRO 89 -13.181 -8.657 0.858 1.00 0.00 ATOM 681 N THR 90 -12.374 -8.764 1.908 1.00 0.00 ATOM 682 CA THR 90 -12.569 -9.809 2.908 1.00 0.00 ATOM 683 CB THR 90 -11.338 -9.682 4.030 1.00 0.00 ATOM 684 CG2 THR 90 -11.003 -10.974 4.787 1.00 0.00 ATOM 685 OG1 THR 90 -10.148 -9.090 3.509 1.00 0.00 ATOM 686 O THR 90 -14.282 -10.391 4.514 1.00 0.00 ATOM 687 C THR 90 -13.741 -9.488 3.873 1.00 0.00 ATOM 688 N ARG 91 -14.117 -8.216 3.960 1.00 0.00 ATOM 689 CA ARG 91 -15.210 -7.810 4.836 1.00 0.00 ATOM 690 CB ARG 91 -14.626 -7.578 6.276 1.00 0.00 ATOM 691 CG ARG 91 -13.800 -8.726 6.877 1.00 0.00 ATOM 692 CD ARG 91 -13.020 -8.362 8.149 1.00 0.00 ATOM 693 NE ARG 91 -12.720 -6.936 8.157 1.00 0.00 ATOM 694 CZ ARG 91 -11.539 -6.377 8.390 1.00 0.00 ATOM 695 NH1 ARG 91 -10.460 -7.110 8.707 1.00 0.00 ATOM 696 NH2 ARG 91 -11.437 -5.049 8.329 1.00 0.00 ATOM 697 O ARG 91 -15.889 -5.664 3.996 1.00 0.00 ATOM 698 C ARG 91 -16.064 -6.885 3.972 1.00 0.00 ATOM 699 N PRO 92 -16.918 -7.453 3.122 1.00 0.00 ATOM 700 CA PRO 92 -17.497 -6.633 2.058 1.00 0.00 ATOM 701 CB PRO 92 -18.288 -7.650 1.241 1.00 0.00 ATOM 702 CG PRO 92 -18.588 -8.751 2.217 1.00 0.00 ATOM 703 CD PRO 92 -17.362 -8.852 3.052 1.00 0.00 ATOM 704 O PRO 92 -18.655 -4.550 1.779 1.00 0.00 ATOM 705 C PRO 92 -18.431 -5.515 2.511 1.00 0.00 ATOM 706 N ASP 93 -18.972 -5.648 3.718 1.00 0.00 ATOM 707 CA ASP 93 -19.877 -4.638 4.253 1.00 0.00 ATOM 708 CB ASP 93 -20.676 -5.171 5.446 1.00 0.00 ATOM 709 CG ASP 93 -21.736 -6.174 5.034 1.00 0.00 ATOM 710 OD1 ASP 93 -22.025 -6.270 3.824 1.00 0.00 ATOM 711 OD2 ASP 93 -22.278 -6.862 5.923 1.00 0.00 ATOM 712 O ASP 93 -19.686 -2.460 5.232 1.00 0.00 ATOM 713 C ASP 93 -19.098 -3.440 4.772 1.00 0.00 ATOM 714 N VAL 94 -17.774 -3.515 4.697 1.00 0.00 ATOM 715 CA VAL 94 -16.926 -2.423 5.161 1.00 0.00 ATOM 716 CB VAL 94 -15.780 -2.834 6.105 1.00 0.00 ATOM 717 CG1 VAL 94 -14.904 -1.635 6.433 1.00 0.00 ATOM 718 CG2 VAL 94 -16.335 -3.396 7.405 1.00 0.00 ATOM 719 O VAL 94 -15.762 -2.384 3.065 1.00 0.00 ATOM 720 C VAL 94 -16.275 -1.729 3.971 1.00 0.00 ATOM 721 N LEU 95 -16.326 -0.395 3.969 1.00 0.00 ATOM 722 CA LEU 95 -15.682 0.415 2.938 1.00 0.00 ATOM 723 CB LEU 95 -16.557 1.607 2.644 1.00 0.00 ATOM 724 CG LEU 95 -15.974 2.767 1.843 1.00 0.00 ATOM 725 CD1 LEU 95 -15.605 2.315 0.445 1.00 0.00 ATOM 726 CD2 LEU 95 -16.971 3.921 1.809 1.00 0.00 ATOM 727 O LEU 95 -14.601 1.365 4.859 1.00 0.00 ATOM 728 C LEU 95 -14.522 1.120 3.656 1.00 0.00 ATOM 729 N PHE 96 -13.434 1.389 2.943 1.00 0.00 ATOM 730 CA PHE 96 -12.260 2.028 3.540 1.00 0.00 ATOM 731 CB PHE 96 -11.119 1.036 3.608 1.00 0.00 ATOM 732 CG PHE 96 -9.883 1.601 4.231 1.00 0.00 ATOM 733 CD1 PHE 96 -9.823 1.850 5.603 1.00 0.00 ATOM 734 CD2 PHE 96 -8.758 1.877 3.450 1.00 0.00 ATOM 735 CE1 PHE 96 -8.674 2.355 6.180 1.00 0.00 ATOM 736 CE2 PHE 96 -7.606 2.384 4.020 1.00 0.00 ATOM 737 CZ PHE 96 -7.551 2.627 5.388 1.00 0.00 ATOM 738 O PHE 96 -11.663 3.244 1.557 1.00 0.00 ATOM 739 C PHE 96 -11.809 3.274 2.777 1.00 0.00 ATOM 740 N VAL 97 -11.615 4.376 3.499 1.00 0.00 ATOM 741 CA VAL 97 -11.127 5.607 2.878 1.00 0.00 ATOM 742 CB VAL 97 -11.846 6.847 3.440 1.00 0.00 ATOM 743 CG1 VAL 97 -11.297 8.114 2.806 1.00 0.00 ATOM 744 CG2 VAL 97 -13.339 6.773 3.147 1.00 0.00 ATOM 745 O VAL 97 -9.238 5.714 4.370 1.00 0.00 ATOM 746 C VAL 97 -9.639 5.650 3.204 1.00 0.00 ATOM 747 N TRP 98 -8.824 5.599 2.159 1.00 0.00 ATOM 748 CA TRP 98 -7.376 5.577 2.313 1.00 0.00 ATOM 749 CB TRP 98 -6.877 5.229 0.699 1.00 0.00 ATOM 750 CG TRP 98 -6.040 4.030 0.375 1.00 0.00 ATOM 751 CD1 TRP 98 -4.703 3.869 0.609 1.00 0.00 ATOM 752 CD2 TRP 98 -6.507 2.788 -0.159 1.00 0.00 ATOM 753 CE2 TRP 98 -5.401 1.913 -0.214 1.00 0.00 ATOM 754 CE3 TRP 98 -7.757 2.327 -0.592 1.00 0.00 ATOM 755 NE1 TRP 98 -4.312 2.595 0.260 1.00 0.00 ATOM 756 CZ2 TRP 98 -5.507 0.600 -0.685 1.00 0.00 ATOM 757 CZ3 TRP 98 -7.864 1.020 -1.061 1.00 0.00 ATOM 758 CH2 TRP 98 -6.743 0.170 -1.102 1.00 0.00 ATOM 759 O TRP 98 -5.818 7.151 3.224 1.00 0.00 ATOM 760 C TRP 98 -6.711 6.947 2.401 1.00 0.00 ATOM 761 N GLN 99 -7.101 7.869 1.525 1.00 0.00 ATOM 762 CA GLN 99 -6.453 9.171 1.513 1.00 0.00 ATOM 763 CB GLN 99 -5.153 9.103 0.708 1.00 0.00 ATOM 764 CG GLN 99 -4.379 10.411 0.669 1.00 0.00 ATOM 765 CD GLN 99 -3.056 10.283 -0.062 1.00 0.00 ATOM 766 OE1 GLN 99 -2.753 9.238 -0.636 1.00 0.00 ATOM 767 NE2 GLN 99 -2.265 11.348 -0.041 1.00 0.00 ATOM 768 O GLN 99 -8.025 9.979 -0.112 1.00 0.00 ATOM 769 C GLN 99 -7.342 10.238 0.881 1.00 0.00 ATOM 770 N VAL 100 -7.332 11.436 1.456 1.00 0.00 ATOM 771 CA VAL 100 -8.132 12.512 0.938 1.00 0.00 ATOM 772 CB VAL 100 -9.441 12.654 1.729 1.00 0.00 ATOM 773 CG1 VAL 100 -10.250 13.818 1.182 1.00 0.00 ATOM 774 CG2 VAL 100 -10.228 11.356 1.635 1.00 0.00 ATOM 775 O VAL 100 -6.613 13.896 2.126 1.00 0.00 ATOM 776 C VAL 100 -7.425 13.796 1.206 1.00 0.00 ATOM 777 N ALA 101 -7.725 14.808 0.397 1.00 0.00 ATOM 778 CA ALA 101 -7.101 16.116 0.559 1.00 0.00 ATOM 779 CB ALA 101 -5.741 16.162 -0.121 1.00 0.00 ATOM 780 O ALA 101 -8.872 16.949 -0.829 1.00 0.00 ATOM 781 C ALA 101 -8.019 17.209 0.022 1.00 0.00 ATOM 782 N VAL 102 -7.842 18.431 0.514 1.00 0.00 ATOM 783 CA VAL 102 -8.650 19.533 0.074 1.00 0.00 ATOM 784 CB VAL 102 -9.692 19.979 1.115 1.00 0.00 ATOM 785 CG1 VAL 102 -10.456 21.197 0.619 1.00 0.00 ATOM 786 CG2 VAL 102 -10.691 18.862 1.382 1.00 0.00 ATOM 787 O VAL 102 -6.683 20.851 0.450 1.00 0.00 ATOM 788 C VAL 102 -7.678 20.661 -0.249 1.00 0.00 ATOM 789 N HIS 103 -7.966 21.409 -1.311 1.00 0.00 ATOM 790 CA HIS 103 -7.107 22.518 -1.709 1.00 0.00 ATOM 791 CB HIS 103 -7.665 23.169 -2.977 1.00 0.00 ATOM 792 CG HIS 103 -6.746 24.177 -3.594 1.00 0.00 ATOM 793 CD2 HIS 103 -5.829 24.190 -4.726 1.00 0.00 ATOM 794 ND1 HIS 103 -6.604 25.456 -3.101 1.00 0.00 ATOM 795 CE1 HIS 103 -5.715 26.120 -3.861 1.00 0.00 ATOM 796 NE2 HIS 103 -5.246 25.368 -4.836 1.00 0.00 ATOM 797 O HIS 103 -8.110 23.757 0.084 1.00 0.00 ATOM 798 C HIS 103 -7.095 23.542 -0.580 1.00 0.00 ATOM 799 N SER 104 -5.945 24.174 -0.363 1.00 0.00 ATOM 800 CA SER 104 -5.801 25.215 0.725 1.00 0.00 ATOM 801 CB SER 104 -4.427 25.873 0.591 1.00 0.00 ATOM 802 OG SER 104 -3.388 24.943 0.846 1.00 0.00 ATOM 803 O SER 104 -7.181 26.862 1.788 1.00 0.00 ATOM 804 C SER 104 -6.806 26.367 0.724 1.00 0.00 ATOM 805 N ARG 105 -7.182 26.839 -0.463 1.00 0.00 ATOM 806 CA ARG 105 -8.126 27.951 -0.577 1.00 0.00 ATOM 807 CB ARG 105 -7.618 28.515 -2.143 1.00 0.00 ATOM 808 CG ARG 105 -8.037 29.919 -2.557 1.00 0.00 ATOM 809 CD ARG 105 -7.892 30.139 -4.059 1.00 0.00 ATOM 810 NE ARG 105 -7.911 28.879 -4.822 1.00 0.00 ATOM 811 CZ ARG 105 -8.976 28.312 -5.397 1.00 0.00 ATOM 812 NH1 ARG 105 -10.182 28.883 -5.355 1.00 0.00 ATOM 813 NH2 ARG 105 -8.814 27.166 -6.050 1.00 0.00 ATOM 814 O ARG 105 -10.454 28.489 -0.357 1.00 0.00 ATOM 815 C ARG 105 -9.598 27.603 -0.370 1.00 0.00 ATOM 816 N ALA 106 -9.877 26.328 -0.123 1.00 0.00 ATOM 817 CA ALA 106 -11.233 25.894 0.089 1.00 0.00 ATOM 818 CB ALA 106 -11.720 24.990 -1.090 1.00 0.00 ATOM 819 O ALA 106 -10.510 24.831 2.098 1.00 0.00 ATOM 820 C ALA 106 -11.429 25.382 1.492 1.00 0.00 ATOM 821 N ARG 107 -12.635 25.562 2.020 1.00 0.00 ATOM 822 CA ARG 107 -12.944 25.105 3.371 1.00 0.00 ATOM 823 CB ARG 107 -14.308 25.616 3.831 1.00 0.00 ATOM 824 CG ARG 107 -14.629 25.319 5.296 1.00 0.00 ATOM 825 CD ARG 107 -16.036 25.755 5.643 1.00 0.00 ATOM 826 NE ARG 107 -16.243 25.685 7.091 1.00 0.00 ATOM 827 CZ ARG 107 -17.421 25.792 7.685 1.00 0.00 ATOM 828 NH1 ARG 107 -18.533 25.944 6.965 1.00 0.00 ATOM 829 NH2 ARG 107 -17.480 25.698 9.003 1.00 0.00 ATOM 830 O ARG 107 -13.546 22.871 2.739 1.00 0.00 ATOM 831 C ARG 107 -12.867 23.588 3.476 1.00 0.00 ATOM 832 N GLY 108 -11.989 23.099 4.345 1.00 0.00 ATOM 833 CA GLY 108 -11.833 21.660 4.533 1.00 0.00 ATOM 834 O GLY 108 -13.339 19.842 4.088 1.00 0.00 ATOM 835 C GLY 108 -13.129 20.887 4.714 1.00 0.00 ATOM 836 N HIS 109 -14.003 21.409 5.573 1.00 0.00 ATOM 837 CA HIS 109 -15.266 20.726 5.866 1.00 0.00 ATOM 838 CB HIS 109 -16.046 21.477 6.947 1.00 0.00 ATOM 839 CG HIS 109 -17.387 20.886 7.246 1.00 0.00 ATOM 840 CD2 HIS 109 -18.768 21.244 6.956 1.00 0.00 ATOM 841 ND1 HIS 109 -17.544 19.719 7.962 1.00 0.00 ATOM 842 CE1 HIS 109 -18.855 19.442 8.066 1.00 0.00 ATOM 843 NE2 HIS 109 -19.595 20.352 7.463 1.00 0.00 ATOM 844 O HIS 109 -16.645 19.485 4.344 1.00 0.00 ATOM 845 C HIS 109 -16.152 20.587 4.639 1.00 0.00 ATOM 846 N ARG 110 -16.396 21.672 3.876 1.00 0.00 ATOM 847 CA ARG 110 -17.362 21.625 2.798 1.00 0.00 ATOM 848 CB ARG 110 -17.492 22.956 2.157 1.00 0.00 ATOM 849 CG ARG 110 -18.568 23.029 1.085 1.00 0.00 ATOM 850 CD ARG 110 -19.870 22.434 1.470 1.00 0.00 ATOM 851 NE ARG 110 -20.374 22.967 2.723 1.00 0.00 ATOM 852 CZ ARG 110 -21.387 22.402 3.367 1.00 0.00 ATOM 853 NH1 ARG 110 -22.015 21.365 2.834 1.00 0.00 ATOM 854 NH2 ARG 110 -21.797 22.890 4.517 1.00 0.00 ATOM 855 O ARG 110 -17.713 19.758 1.334 1.00 0.00 ATOM 856 C ARG 110 -16.947 20.648 1.703 1.00 0.00 ATOM 857 N LEU 111 -15.733 20.815 1.189 1.00 0.00 ATOM 858 CA LEU 111 -15.226 19.933 0.132 1.00 0.00 ATOM 859 CB LEU 111 -13.917 20.368 -0.382 1.00 0.00 ATOM 860 CG LEU 111 -13.917 21.576 -1.315 1.00 0.00 ATOM 861 CD1 LEU 111 -12.498 22.072 -1.599 1.00 0.00 ATOM 862 CD2 LEU 111 -14.568 21.249 -2.649 1.00 0.00 ATOM 863 O LEU 111 -15.482 17.561 0.070 1.00 0.00 ATOM 864 C LEU 111 -15.045 18.539 0.677 1.00 0.00 ATOM 865 N GLY 112 -14.396 18.438 1.833 1.00 0.00 ATOM 866 CA GLY 112 -14.163 17.142 2.459 1.00 0.00 ATOM 867 O GLY 112 -15.518 15.163 2.368 1.00 0.00 ATOM 868 C GLY 112 -15.442 16.347 2.700 1.00 0.00 ATOM 869 N ARG 113 -16.447 17.000 3.275 1.00 0.00 ATOM 870 CA ARG 113 -17.710 16.341 3.549 1.00 0.00 ATOM 871 CB ARG 113 -18.645 17.276 4.319 1.00 0.00 ATOM 872 CG ARG 113 -19.979 16.649 4.690 1.00 0.00 ATOM 873 CD ARG 113 -20.827 17.602 5.515 1.00 0.00 ATOM 874 NE ARG 113 -22.094 16.999 5.922 1.00 0.00 ATOM 875 CZ ARG 113 -23.181 16.959 5.157 1.00 0.00 ATOM 876 NH1 ARG 113 -24.289 16.389 5.611 1.00 0.00 ATOM 877 NH2 ARG 113 -23.158 17.491 3.943 1.00 0.00 ATOM 878 O ARG 113 -19.063 14.856 2.238 1.00 0.00 ATOM 879 C ARG 113 -18.447 15.921 2.280 1.00 0.00 ATOM 880 N ALA 114 -18.380 16.757 1.249 1.00 0.00 ATOM 881 CA ALA 114 -19.043 16.455 -0.011 1.00 0.00 ATOM 882 CB ALA 114 -19.022 17.619 -0.953 1.00 0.00 ATOM 883 O ALA 114 -19.107 14.274 -1.009 1.00 0.00 ATOM 884 C ALA 114 -18.406 15.195 -0.586 1.00 0.00 ATOM 885 N MET 115 -17.077 15.139 -0.566 1.00 0.00 ATOM 886 CA MET 115 -16.364 13.982 -1.086 1.00 0.00 ATOM 887 CB MET 115 -14.824 14.350 -0.396 1.00 0.00 ATOM 888 CG MET 115 -13.506 13.916 -1.055 1.00 0.00 ATOM 889 SD MET 115 -12.863 15.123 -2.274 1.00 0.00 ATOM 890 CE MET 115 -12.369 16.448 -1.197 1.00 0.00 ATOM 891 O MET 115 -17.033 11.683 -0.911 1.00 0.00 ATOM 892 C MET 115 -16.717 12.712 -0.314 1.00 0.00 ATOM 893 N LEU 116 -16.664 12.790 1.012 1.00 0.00 ATOM 894 CA LEU 116 -16.982 11.639 1.849 1.00 0.00 ATOM 895 CB LEU 116 -16.571 11.863 3.285 1.00 0.00 ATOM 896 CG LEU 116 -15.060 11.763 3.475 1.00 0.00 ATOM 897 CD1 LEU 116 -14.827 12.245 4.895 1.00 0.00 ATOM 898 CD2 LEU 116 -14.540 10.363 3.268 1.00 0.00 ATOM 899 O LEU 116 -18.706 9.982 1.650 1.00 0.00 ATOM 900 C LEU 116 -18.429 11.181 1.689 1.00 0.00 ATOM 901 N GLY 117 -19.347 12.137 1.599 1.00 0.00 ATOM 902 CA GLY 117 -20.767 11.815 1.439 1.00 0.00 ATOM 903 O GLY 117 -21.823 10.099 0.144 1.00 0.00 ATOM 904 C GLY 117 -21.069 11.075 0.148 1.00 0.00 ATOM 905 N HIS 118 -20.494 11.521 -0.966 1.00 0.00 ATOM 906 CA HIS 118 -20.716 10.850 -2.239 1.00 0.00 ATOM 907 CB HIS 118 -20.105 11.645 -3.394 1.00 0.00 ATOM 908 CG HIS 118 -20.347 11.038 -4.742 1.00 0.00 ATOM 909 CD2 HIS 118 -19.526 10.377 -5.748 1.00 0.00 ATOM 910 ND1 HIS 118 -21.592 11.010 -5.330 1.00 0.00 ATOM 911 CE1 HIS 118 -21.496 10.404 -6.529 1.00 0.00 ATOM 912 NE2 HIS 118 -20.259 10.022 -6.783 1.00 0.00 ATOM 913 O HIS 118 -20.735 8.509 -2.758 1.00 0.00 ATOM 914 C HIS 118 -20.134 9.441 -2.223 1.00 0.00 ATOM 915 N ILE 119 -18.982 9.281 -1.579 1.00 0.00 ATOM 916 CA ILE 119 -18.335 7.974 -1.496 1.00 0.00 ATOM 917 CB ILE 119 -16.980 8.034 -0.769 1.00 0.00 ATOM 918 CG1 ILE 119 -15.971 8.844 -1.589 1.00 0.00 ATOM 919 CG2 ILE 119 -16.421 6.634 -0.564 1.00 0.00 ATOM 920 CD1 ILE 119 -15.666 8.246 -2.945 1.00 0.00 ATOM 921 O ILE 119 -19.467 5.925 -1.005 1.00 0.00 ATOM 922 C ILE 119 -19.248 7.089 -0.671 1.00 0.00 ATOM 923 N LEU 120 -19.808 7.659 0.394 1.00 0.00 ATOM 924 CA LEU 120 -20.700 6.905 1.265 1.00 0.00 ATOM 925 CB LEU 120 -21.139 7.730 2.475 1.00 0.00 ATOM 926 CG LEU 120 -22.069 7.036 3.473 1.00 0.00 ATOM 927 CD1 LEU 120 -21.393 5.815 4.079 1.00 0.00 ATOM 928 CD2 LEU 120 -22.448 7.979 4.602 1.00 0.00 ATOM 929 O LEU 120 -22.294 5.264 0.544 1.00 0.00 ATOM 930 C LEU 120 -21.929 6.439 0.493 1.00 0.00 ATOM 931 N GLU 121 -22.565 7.361 -0.223 1.00 0.00 ATOM 932 CA GLU 121 -23.750 7.027 -1.003 1.00 0.00 ATOM 933 CB GLU 121 -24.325 8.254 -1.711 1.00 0.00 ATOM 934 CG GLU 121 -24.925 9.288 -0.770 1.00 0.00 ATOM 935 CD GLU 121 -25.373 10.542 -1.494 1.00 0.00 ATOM 936 OE1 GLU 121 -25.147 10.636 -2.720 1.00 0.00 ATOM 937 OE2 GLU 121 -25.946 11.436 -0.837 1.00 0.00 ATOM 938 O GLU 121 -24.255 5.038 -2.244 1.00 0.00 ATOM 939 C GLU 121 -23.455 5.953 -2.042 1.00 0.00 ATOM 940 N ARG 122 -22.305 6.063 -2.700 1.00 0.00 ATOM 941 CA ARG 122 -21.919 5.090 -3.715 1.00 0.00 ATOM 942 CB ARG 122 -20.639 5.545 -4.418 1.00 0.00 ATOM 943 CG ARG 122 -20.142 4.581 -5.485 1.00 0.00 ATOM 944 CD ARG 122 -21.155 4.438 -6.609 1.00 0.00 ATOM 945 NE ARG 122 -20.655 3.591 -7.690 1.00 0.00 ATOM 946 CZ ARG 122 -21.407 3.122 -8.682 1.00 0.00 ATOM 947 NH1 ARG 122 -20.863 2.358 -9.620 1.00 0.00 ATOM 948 NH2 ARG 122 -22.697 3.418 -8.732 1.00 0.00 ATOM 949 O ARG 122 -22.158 2.701 -3.691 1.00 0.00 ATOM 950 C ARG 122 -21.673 3.694 -3.146 1.00 0.00 ATOM 951 N GLN 123 -20.921 3.621 -2.053 1.00 0.00 ATOM 952 CA GLN 123 -20.621 2.337 -1.425 1.00 0.00 ATOM 953 CB GLN 123 -19.333 2.508 -0.529 1.00 0.00 ATOM 954 CG GLN 123 -18.096 2.847 -1.270 1.00 0.00 ATOM 955 CD GLN 123 -17.682 1.716 -2.152 1.00 0.00 ATOM 956 OE1 GLN 123 -17.390 0.618 -1.666 1.00 0.00 ATOM 957 NE2 GLN 123 -17.663 1.956 -3.455 1.00 0.00 ATOM 958 O GLN 123 -21.968 0.510 -0.713 1.00 0.00 ATOM 959 C GLN 123 -21.844 1.725 -0.753 1.00 0.00 ATOM 960 N GLU 124 -22.763 2.548 -0.185 1.00 0.00 ATOM 961 CA GLU 124 -24.021 2.036 0.377 1.00 0.00 ATOM 962 CB GLU 124 -24.935 3.171 0.840 1.00 0.00 ATOM 963 CG GLU 124 -26.171 2.704 1.593 1.00 0.00 ATOM 964 CD GLU 124 -27.023 3.856 2.086 1.00 0.00 ATOM 965 OE1 GLU 124 -26.638 5.023 1.857 1.00 0.00 ATOM 966 OE2 GLU 124 -28.076 3.593 2.704 1.00 0.00 ATOM 967 O GLU 124 -25.217 0.120 -0.430 1.00 0.00 ATOM 968 C GLU 124 -24.680 1.194 -0.709 1.00 0.00 ATOM 969 N CYS 125 -24.640 1.679 -1.945 1.00 0.00 ATOM 970 CA CYS 125 -25.249 0.946 -3.094 1.00 0.00 ATOM 971 CB CYS 125 -25.229 1.836 -4.340 1.00 0.00 ATOM 972 SG CYS 125 -26.223 3.340 -4.197 1.00 0.00 ATOM 973 O CYS 125 -25.056 -1.248 -4.046 1.00 0.00 ATOM 974 C CYS 125 -24.535 -0.378 -3.345 1.00 0.00 ATOM 975 N ARG 126 -23.346 -0.530 -2.773 1.00 0.00 ATOM 976 CA ARG 126 -22.572 -1.762 -2.942 1.00 0.00 ATOM 977 CB ARG 126 -21.447 -1.476 -3.906 1.00 0.00 ATOM 978 CG ARG 126 -21.960 -0.962 -5.263 1.00 0.00 ATOM 979 CD ARG 126 -20.805 -0.428 -6.120 1.00 0.00 ATOM 980 NE ARG 126 -19.904 -1.500 -6.449 1.00 0.00 ATOM 981 CZ ARG 126 -18.656 -1.337 -6.900 1.00 0.00 ATOM 982 NH1 ARG 126 -18.145 -0.121 -7.080 1.00 0.00 ATOM 983 NH2 ARG 126 -17.915 -2.410 -7.169 1.00 0.00 ATOM 984 O ARG 126 -21.780 -3.538 -1.531 1.00 0.00 ATOM 985 C ARG 126 -22.630 -2.664 -1.708 1.00 0.00 ATOM 986 N HIS 127 -23.631 -2.450 -0.859 1.00 0.00 ATOM 987 CA HIS 127 -23.784 -3.253 0.349 1.00 0.00 ATOM 988 CB HIS 127 -23.556 -4.767 -0.008 1.00 0.00 ATOM 989 CG HIS 127 -24.362 -5.273 -1.166 1.00 0.00 ATOM 990 CD2 HIS 127 -23.988 -5.790 -2.361 1.00 0.00 ATOM 991 ND1 HIS 127 -25.738 -5.189 -1.200 1.00 0.00 ATOM 992 CE1 HIS 127 -26.176 -5.629 -2.368 1.00 0.00 ATOM 993 NE2 HIS 127 -25.134 -5.999 -3.090 1.00 0.00 ATOM 994 O HIS 127 -22.990 -3.611 2.583 1.00 0.00 ATOM 995 C HIS 127 -22.956 -2.899 1.580 1.00 0.00 ATOM 996 N VAL 128 -22.213 -1.799 1.500 1.00 0.00 ATOM 997 CA VAL 128 -21.386 -1.365 2.619 1.00 0.00 ATOM 998 CB VAL 128 -20.104 -0.665 2.135 1.00 0.00 ATOM 999 CG1 VAL 128 -19.297 -0.157 3.322 1.00 0.00 ATOM 1000 CG2 VAL 128 -19.237 -1.628 1.340 1.00 0.00 ATOM 1001 O VAL 128 -22.656 0.620 3.024 1.00 0.00 ATOM 1002 C VAL 128 -22.134 -0.388 3.501 1.00 0.00 ATOM 1003 N ARG 129 -22.152 -0.663 4.802 1.00 0.00 ATOM 1004 CA ARG 129 -22.839 0.208 5.749 1.00 0.00 ATOM 1005 CB ARG 129 -23.684 -0.612 6.737 1.00 0.00 ATOM 1006 CG ARG 129 -24.785 -1.373 6.016 1.00 0.00 ATOM 1007 CD ARG 129 -25.903 -0.513 5.406 1.00 0.00 ATOM 1008 NE ARG 129 -26.746 0.177 6.391 1.00 0.00 ATOM 1009 CZ ARG 129 -27.787 0.971 6.091 1.00 0.00 ATOM 1010 NH1 ARG 129 -28.119 1.217 4.825 1.00 0.00 ATOM 1011 NH2 ARG 129 -28.486 1.546 7.065 1.00 0.00 ATOM 1012 O ARG 129 -22.218 1.706 7.545 1.00 0.00 ATOM 1013 C ARG 129 -21.847 0.815 6.778 1.00 0.00 ATOM 1014 N HIS 130 -20.611 0.329 6.781 1.00 0.00 ATOM 1015 CA HIS 130 -19.603 0.834 7.708 1.00 0.00 ATOM 1016 CB HIS 130 -19.327 -0.244 8.758 1.00 0.00 ATOM 1017 CG HIS 130 -20.533 -0.636 9.553 1.00 0.00 ATOM 1018 CD2 HIS 130 -21.538 -1.685 9.468 1.00 0.00 ATOM 1019 ND1 HIS 130 -20.939 0.056 10.674 1.00 0.00 ATOM 1020 CE1 HIS 130 -22.045 -0.528 11.170 1.00 0.00 ATOM 1021 NE2 HIS 130 -22.411 -1.573 10.451 1.00 0.00 ATOM 1022 O HIS 130 -17.876 0.506 6.067 1.00 0.00 ATOM 1023 C HIS 130 -18.316 1.217 6.970 1.00 0.00 ATOM 1024 N LEU 131 -17.718 2.338 7.360 1.00 0.00 ATOM 1025 CA LEU 131 -16.486 2.796 6.729 1.00 0.00 ATOM 1026 CB LEU 131 -16.662 4.147 6.030 1.00 0.00 ATOM 1027 CG LEU 131 -17.723 4.346 4.950 1.00 0.00 ATOM 1028 CD1 LEU 131 -19.122 3.986 5.430 1.00 0.00 ATOM 1029 CD2 LEU 131 -17.734 5.765 4.369 1.00 0.00 ATOM 1030 O LEU 131 -15.711 3.506 8.873 1.00 0.00 ATOM 1031 C LEU 131 -15.441 2.926 7.826 1.00 0.00 ATOM 1032 N GLU 132 -14.264 2.331 7.616 1.00 0.00 ATOM 1033 CA GLU 132 -13.083 2.645 8.401 1.00 0.00 ATOM 1034 CB GLU 132 -12.268 1.369 8.704 1.00 0.00 ATOM 1035 CG GLU 132 -13.041 0.170 9.196 1.00 0.00 ATOM 1036 CD GLU 132 -12.123 -0.956 9.639 1.00 0.00 ATOM 1037 OE1 GLU 132 -11.098 -1.197 8.961 1.00 0.00 ATOM 1038 OE2 GLU 132 -12.427 -1.601 10.662 1.00 0.00 ATOM 1039 O GLU 132 -12.011 3.617 6.487 1.00 0.00 ATOM 1040 C GLU 132 -12.406 3.781 7.642 1.00 0.00 ATOM 1041 N THR 133 -12.271 4.933 8.293 1.00 0.00 ATOM 1042 CA THR 133 -11.637 6.083 7.666 1.00 0.00 ATOM 1043 CB THR 133 -12.665 7.254 7.587 1.00 0.00 ATOM 1044 CG2 THR 133 -14.059 6.764 7.155 1.00 0.00 ATOM 1045 OG1 THR 133 -12.748 7.819 8.909 1.00 0.00 ATOM 1046 O THR 133 -10.011 6.325 9.407 1.00 0.00 ATOM 1047 C THR 133 -10.260 6.427 8.205 1.00 0.00 ATOM 1048 N THR 134 -9.361 6.838 7.316 1.00 0.00 ATOM 1049 CA THR 134 -8.007 7.199 7.721 1.00 0.00 ATOM 1050 CB THR 134 -6.979 6.072 7.518 1.00 0.00 ATOM 1051 CG2 THR 134 -7.431 4.804 8.230 1.00 0.00 ATOM 1052 OG1 THR 134 -6.840 5.791 6.121 1.00 0.00 ATOM 1053 O THR 134 -7.741 8.580 5.799 1.00 0.00 ATOM 1054 C THR 134 -7.396 8.338 6.955 1.00 0.00 ATOM 1055 N VAL 135 -6.412 8.992 7.562 1.00 0.00 ATOM 1056 CA VAL 135 -5.739 10.114 6.919 1.00 0.00 ATOM 1057 CB VAL 135 -6.504 11.424 7.089 1.00 0.00 ATOM 1058 CG1 VAL 135 -6.723 11.844 8.584 1.00 0.00 ATOM 1059 CG2 VAL 135 -5.791 12.572 6.306 1.00 0.00 ATOM 1060 O VAL 135 -4.144 9.961 8.704 1.00 0.00 ATOM 1061 C VAL 135 -4.381 10.352 7.565 1.00 0.00 ATOM 1062 N GLY 136 -3.484 11.028 6.891 1.00 0.00 ATOM 1063 CA GLY 136 -2.178 11.323 7.448 1.00 0.00 ATOM 1064 O GLY 136 -3.097 13.173 8.649 1.00 0.00 ATOM 1065 C GLY 136 -2.235 12.298 8.613 1.00 0.00 ATOM 1066 N PRO 137 -1.314 12.158 9.582 1.00 0.00 ATOM 1067 CA PRO 137 -1.269 13.037 10.754 1.00 0.00 ATOM 1068 CB PRO 137 -0.096 12.618 11.536 1.00 0.00 ATOM 1069 CG PRO 137 0.853 12.088 10.472 1.00 0.00 ATOM 1070 CD PRO 137 -0.048 11.324 9.563 1.00 0.00 ATOM 1071 O PRO 137 -1.507 15.368 11.268 1.00 0.00 ATOM 1072 C PRO 137 -1.062 14.524 10.488 1.00 0.00 ATOM 1073 N ASP 138 -0.389 14.844 9.388 1.00 0.00 ATOM 1074 CA ASP 138 -0.124 16.266 9.017 1.00 0.00 ATOM 1075 CB ASP 138 1.172 16.388 8.213 1.00 0.00 ATOM 1076 CG ASP 138 2.393 15.975 9.011 1.00 0.00 ATOM 1077 OD1 ASP 138 2.536 16.440 10.160 1.00 0.00 ATOM 1078 OD2 ASP 138 3.205 15.186 8.483 1.00 0.00 ATOM 1079 O ASP 138 -1.174 18.091 7.866 1.00 0.00 ATOM 1080 C ASP 138 -1.230 16.902 8.181 1.00 0.00 ATOM 1081 N ASN 139 -2.234 16.108 7.823 1.00 0.00 ATOM 1082 CA ASN 139 -3.349 16.610 7.024 1.00 0.00 ATOM 1083 CB ASN 139 -3.859 15.525 6.009 1.00 0.00 ATOM 1084 CG ASN 139 -4.800 16.052 4.911 1.00 0.00 ATOM 1085 ND2 ASN 139 -4.861 15.357 3.775 1.00 0.00 ATOM 1086 OD1 ASN 139 -5.492 17.020 5.124 1.00 0.00 ATOM 1087 O ASN 139 -5.445 16.580 8.211 1.00 0.00 ATOM 1088 C ASN 139 -4.416 17.210 7.938 1.00 0.00 ATOM 1089 N GLN 140 -4.169 18.419 8.412 1.00 0.00 ATOM 1090 CA GLN 140 -5.111 19.075 9.305 1.00 0.00 ATOM 1091 CB GLN 140 -4.239 20.619 9.410 1.00 0.00 ATOM 1092 CG GLN 140 -2.716 20.598 9.322 1.00 0.00 ATOM 1093 CD GLN 140 -2.096 21.925 9.713 1.00 0.00 ATOM 1094 OE1 GLN 140 -2.196 22.360 10.863 1.00 0.00 ATOM 1095 NE2 GLN 140 -1.447 22.583 8.752 1.00 0.00 ATOM 1096 O GLN 140 -7.508 19.182 9.272 1.00 0.00 ATOM 1097 C GLN 140 -6.463 19.286 8.630 1.00 0.00 ATOM 1098 N ALA 141 -6.439 19.582 7.334 1.00 0.00 ATOM 1099 CA ALA 141 -7.674 19.802 6.584 1.00 0.00 ATOM 1100 CB ALA 141 -7.318 20.167 5.151 1.00 0.00 ATOM 1101 O ALA 141 -9.738 18.593 6.681 1.00 0.00 ATOM 1102 C ALA 141 -8.517 18.541 6.528 1.00 0.00 ATOM 1103 N SER 142 -7.866 17.403 6.310 1.00 0.00 ATOM 1104 CA SER 142 -8.573 16.130 6.240 1.00 0.00 ATOM 1105 CB SER 142 -7.721 14.988 5.792 1.00 0.00 ATOM 1106 OG SER 142 -7.470 15.076 4.377 1.00 0.00 ATOM 1107 O SER 142 -10.327 15.356 7.720 1.00 0.00 ATOM 1108 C SER 142 -9.184 15.808 7.634 1.00 0.00 ATOM 1109 N ARG 143 -8.421 16.047 8.696 1.00 0.00 ATOM 1110 CA ARG 143 -8.902 15.783 10.047 1.00 0.00 ATOM 1111 CB ARG 143 -7.788 16.123 11.035 1.00 0.00 ATOM 1112 CG ARG 143 -6.585 15.197 10.960 1.00 0.00 ATOM 1113 CD ARG 143 -5.523 15.586 11.974 1.00 0.00 ATOM 1114 NE ARG 143 -4.831 16.817 11.597 1.00 0.00 ATOM 1115 CZ ARG 143 -3.994 17.478 12.391 1.00 0.00 ATOM 1116 NH1 ARG 143 -3.410 18.589 11.962 1.00 0.00 ATOM 1117 NH2 ARG 143 -3.743 17.025 13.612 1.00 0.00 ATOM 1118 O ARG 143 -11.130 16.079 10.894 1.00 0.00 ATOM 1119 C ARG 143 -10.158 16.598 10.344 1.00 0.00 ATOM 1120 N ARG 144 -10.134 17.887 9.989 1.00 0.00 ATOM 1121 CA ARG 144 -11.265 18.770 10.238 1.00 0.00 ATOM 1122 CB ARG 144 -10.848 20.231 9.942 1.00 0.00 ATOM 1123 CG ARG 144 -11.928 21.262 10.303 1.00 0.00 ATOM 1124 CD ARG 144 -11.433 22.679 10.050 1.00 0.00 ATOM 1125 NE ARG 144 -10.267 22.957 10.871 1.00 0.00 ATOM 1126 CZ ARG 144 -9.191 23.623 10.444 1.00 0.00 ATOM 1127 NH1 ARG 144 -9.073 24.112 9.213 1.00 0.00 ATOM 1128 NH2 ARG 144 -8.199 23.788 11.307 1.00 0.00 ATOM 1129 O ARG 144 -13.615 18.381 9.916 1.00 0.00 ATOM 1130 C ARG 144 -12.485 18.327 9.427 1.00 0.00 ATOM 1131 N THR 145 -12.255 17.888 8.195 1.00 0.00 ATOM 1132 CA THR 145 -13.344 17.437 7.336 1.00 0.00 ATOM 1133 CB THR 145 -12.783 17.057 5.953 1.00 0.00 ATOM 1134 CG2 THR 145 -13.892 16.529 5.055 1.00 0.00 ATOM 1135 OG1 THR 145 -12.199 18.213 5.337 1.00 0.00 ATOM 1136 O THR 145 -15.254 16.139 7.983 1.00 0.00 ATOM 1137 C THR 145 -14.027 16.193 7.893 1.00 0.00 ATOM 1138 N PHE 146 -13.232 15.195 8.265 1.00 0.00 ATOM 1139 CA PHE 146 -13.777 13.969 8.809 1.00 0.00 ATOM 1140 CB PHE 146 -12.592 12.990 9.112 1.00 0.00 ATOM 1141 CG PHE 146 -12.051 12.217 7.921 1.00 0.00 ATOM 1142 CD1 PHE 146 -12.827 11.273 7.244 1.00 0.00 ATOM 1143 CD2 PHE 146 -10.735 12.411 7.494 1.00 0.00 ATOM 1144 CE1 PHE 146 -12.298 10.547 6.182 1.00 0.00 ATOM 1145 CE2 PHE 146 -10.218 11.697 6.422 1.00 0.00 ATOM 1146 CZ PHE 146 -10.985 10.770 5.779 1.00 0.00 ATOM 1147 O PHE 146 -15.731 13.711 10.139 1.00 0.00 ATOM 1148 C PHE 146 -14.641 14.265 9.995 1.00 0.00 ATOM 1149 N ALA 147 -14.161 15.148 10.864 1.00 0.00 ATOM 1150 CA ALA 147 -14.913 15.520 12.057 1.00 0.00 ATOM 1151 CB ALA 147 -14.018 16.934 12.468 1.00 0.00 ATOM 1152 O ALA 147 -17.235 15.811 12.480 1.00 0.00 ATOM 1153 C ALA 147 -16.275 16.163 11.776 1.00 0.00 ATOM 1154 N GLY 148 -16.337 17.112 10.853 1.00 0.00 ATOM 1155 CA GLY 148 -17.585 17.765 10.509 1.00 0.00 ATOM 1156 O GLY 148 -19.747 16.816 10.108 1.00 0.00 ATOM 1157 C GLY 148 -18.528 16.703 9.972 1.00 0.00 ATOM 1158 N LEU 149 -17.965 15.666 9.357 1.00 0.00 ATOM 1159 CA LEU 149 -18.773 14.586 8.804 1.00 0.00 ATOM 1160 CB LEU 149 -17.900 13.807 7.755 1.00 0.00 ATOM 1161 CG LEU 149 -18.636 12.700 6.976 1.00 0.00 ATOM 1162 CD1 LEU 149 -19.509 13.327 5.912 1.00 0.00 ATOM 1163 CD2 LEU 149 -17.642 11.724 6.347 1.00 0.00 ATOM 1164 O LEU 149 -20.522 13.138 9.580 1.00 0.00 ATOM 1165 C LEU 149 -19.406 13.614 9.794 1.00 0.00 ATOM 1166 N ALA 150 -18.694 13.321 10.878 1.00 0.00 ATOM 1167 CA ALA 150 -19.203 12.398 11.899 1.00 0.00 ATOM 1168 CB ALA 150 -18.678 10.971 11.683 1.00 0.00 ATOM 1169 O ALA 150 -18.578 14.169 13.453 1.00 0.00 ATOM 1170 C ALA 150 -18.827 12.969 13.320 1.00 0.00 ATOM 1171 N GLY 151 -18.798 12.110 14.332 1.00 0.00 ATOM 1172 CA GLY 151 -18.459 12.545 15.683 1.00 0.00 ATOM 1173 O GLY 151 -17.004 14.448 15.772 1.00 0.00 ATOM 1174 C GLY 151 -17.192 13.273 16.085 1.00 0.00 ATOM 1175 N GLU 152 -16.185 12.346 17.111 1.00 0.00 ATOM 1176 CA GLU 152 -14.936 12.946 17.566 1.00 0.00 ATOM 1177 CB GLU 152 -14.415 12.258 18.867 1.00 0.00 ATOM 1178 CG GLU 152 -15.416 12.232 20.023 1.00 0.00 ATOM 1179 CD GLU 152 -15.474 13.537 20.810 1.00 0.00 ATOM 1180 OE1 GLU 152 -15.258 14.605 20.227 1.00 0.00 ATOM 1181 OE2 GLU 152 -15.807 13.496 22.008 1.00 0.00 ATOM 1182 O GLU 152 -12.806 12.513 16.570 1.00 0.00 ATOM 1183 C GLU 152 -13.895 13.078 16.474 1.00 0.00 ATOM 1184 N ARG 153 -14.228 13.831 15.427 1.00 0.00 ATOM 1185 CA ARG 153 -13.304 14.032 14.318 1.00 0.00 ATOM 1186 CB ARG 153 -12.303 15.108 14.539 1.00 0.00 ATOM 1187 CG ARG 153 -11.285 14.938 15.654 1.00 0.00 ATOM 1188 CD ARG 153 -10.445 16.199 15.794 1.00 0.00 ATOM 1189 NE ARG 153 -9.396 16.072 16.804 1.00 0.00 ATOM 1190 CZ ARG 153 -8.223 15.483 16.599 1.00 0.00 ATOM 1191 NH1 ARG 153 -7.933 14.959 15.412 1.00 0.00 ATOM 1192 NH2 ARG 153 -7.335 15.423 17.579 1.00 0.00 ATOM 1193 O ARG 153 -11.661 12.524 13.396 1.00 0.00 ATOM 1194 C ARG 153 -12.824 12.695 13.759 1.00 0.00 ATOM 1195 N GLY 154 -14.401 11.975 12.951 1.00 0.00 ATOM 1196 CA GLY 154 -15.444 11.007 13.218 1.00 0.00 ATOM 1197 O GLY 154 -15.132 8.701 13.618 1.00 0.00 ATOM 1198 C GLY 154 -15.011 9.651 12.843 1.00 0.00 ATOM 1199 N ALA 155 -14.485 9.527 11.630 1.00 0.00 ATOM 1200 CA ALA 155 -14.015 8.238 11.137 1.00 0.00 ATOM 1201 CB ALA 155 -13.462 8.377 9.726 1.00 0.00 ATOM 1202 O ALA 155 -12.000 8.438 12.407 1.00 0.00 ATOM 1203 C ALA 155 -12.912 7.711 12.008 1.00 0.00 ATOM 1204 N HIS 156 -12.959 6.461 12.358 1.00 0.00 ATOM 1205 CA HIS 156 -12.037 5.868 13.289 1.00 0.00 ATOM 1206 CB HIS 156 -12.711 5.632 14.643 1.00 0.00 ATOM 1207 CG HIS 156 -13.866 4.682 14.584 1.00 0.00 ATOM 1208 CD2 HIS 156 -14.049 3.255 14.804 1.00 0.00 ATOM 1209 ND1 HIS 156 -15.145 5.083 14.258 1.00 0.00 ATOM 1210 CE1 HIS 156 -15.959 4.014 14.288 1.00 0.00 ATOM 1211 NE2 HIS 156 -15.309 2.913 14.615 1.00 0.00 ATOM 1212 O HIS 156 -12.215 4.020 11.818 1.00 0.00 ATOM 1213 C HIS 156 -11.577 4.580 12.709 1.00 0.00 ATOM 1214 N VAL 157 -10.452 4.085 13.214 1.00 0.00 ATOM 1215 CA VAL 157 -9.898 2.824 12.730 1.00 0.00 ATOM 1216 CB VAL 157 -8.476 3.038 12.222 1.00 0.00 ATOM 1217 CG1 VAL 157 -7.893 1.691 11.810 1.00 0.00 ATOM 1218 CG2 VAL 157 -8.532 3.979 11.024 1.00 0.00 ATOM 1219 O VAL 157 -9.175 2.364 14.970 1.00 0.00 ATOM 1220 C VAL 157 -9.697 1.926 13.945 1.00 0.00 ATOM 1221 N SER 158 -10.111 0.667 13.828 1.00 0.00 ATOM 1222 CA SER 158 -9.964 -0.272 14.920 1.00 0.00 ATOM 1223 CB SER 158 -10.954 -1.423 14.736 1.00 0.00 ATOM 1224 OG SER 158 -12.292 -0.966 14.823 1.00 0.00 ATOM 1225 O SER 158 -7.750 -0.613 14.030 1.00 0.00 ATOM 1226 C SER 158 -8.529 -0.833 14.958 1.00 0.00 ATOM 1227 N GLU 159 -8.196 -1.552 16.025 1.00 0.00 ATOM 1228 CA GLU 159 -6.865 -2.131 16.160 1.00 0.00 ATOM 1229 CB GLU 159 -6.685 -2.742 17.506 1.00 0.00 ATOM 1230 CG GLU 159 -6.698 -1.742 18.644 1.00 0.00 ATOM 1231 CD GLU 159 -6.453 -2.365 20.026 1.00 0.00 ATOM 1232 OE1 GLU 159 -6.483 -3.644 20.162 1.00 0.00 ATOM 1233 OE2 GLU 159 -6.255 -1.577 21.005 1.00 0.00 ATOM 1234 O GLU 159 -5.444 -3.047 14.458 1.00 0.00 ATOM 1235 C GLU 159 -6.551 -3.065 14.995 1.00 0.00 ATOM 1236 N GLN 160 -7.528 -3.877 14.606 1.00 0.00 ATOM 1237 CA GLN 160 -7.342 -4.822 13.490 1.00 0.00 ATOM 1238 CB GLN 160 -8.630 -5.629 13.317 1.00 0.00 ATOM 1239 CG GLN 160 -8.902 -6.614 14.442 1.00 0.00 ATOM 1240 CD GLN 160 -10.249 -7.297 14.304 1.00 0.00 ATOM 1241 OE1 GLN 160 -11.028 -6.980 13.404 1.00 0.00 ATOM 1242 NE2 GLN 160 -10.530 -8.238 15.198 1.00 0.00 ATOM 1243 O GLN 160 -6.209 -4.583 11.400 1.00 0.00 ATOM 1244 C GLN 160 -7.046 -4.130 12.167 1.00 0.00 ATOM 1245 N PRO 161 -7.823 -3.073 11.886 1.00 0.00 ATOM 1246 CA PRO 161 -7.626 -2.334 10.630 1.00 0.00 ATOM 1247 CB PRO 161 -8.612 -1.169 10.760 1.00 0.00 ATOM 1248 CG PRO 161 -9.728 -1.682 11.572 1.00 0.00 ATOM 1249 CD PRO 161 -9.159 -2.717 12.529 1.00 0.00 ATOM 1250 O PRO 161 -5.801 -1.256 11.725 1.00 0.00 ATOM 1251 C PRO 161 -6.265 -1.628 10.648 1.00 0.00 ATOM 1252 N PHE 162 -5.624 -1.463 9.493 1.00 0.00 ATOM 1253 CA PHE 162 -4.282 -0.846 9.508 1.00 0.00 ATOM 1254 CB PHE 162 -3.497 -1.242 8.253 1.00 0.00 ATOM 1255 CG PHE 162 -3.036 -2.670 8.252 1.00 0.00 ATOM 1256 CD1 PHE 162 -3.731 -3.636 7.548 1.00 0.00 ATOM 1257 CD2 PHE 162 -1.902 -3.047 8.952 1.00 0.00 ATOM 1258 CE1 PHE 162 -3.305 -4.952 7.547 1.00 0.00 ATOM 1259 CE2 PHE 162 -1.477 -4.359 8.950 1.00 0.00 ATOM 1260 CZ PHE 162 -2.172 -5.313 8.249 1.00 0.00 ATOM 1261 O PHE 162 -5.340 1.271 9.132 1.00 0.00 ATOM 1262 C PHE 162 -4.350 0.674 9.548 1.00 0.00 ATOM 1263 N PHE 163 -3.292 1.276 10.084 1.00 0.00 ATOM 1264 CA PHE 163 -3.133 2.733 9.889 1.00 0.00 ATOM 1265 CB PHE 163 -2.735 2.966 11.632 1.00 0.00 ATOM 1266 CG PHE 163 -3.230 1.938 12.634 1.00 0.00 ATOM 1267 CD1 PHE 163 -4.484 2.057 13.219 1.00 0.00 ATOM 1268 CD2 PHE 163 -2.427 0.870 13.020 1.00 0.00 ATOM 1269 CE1 PHE 163 -4.933 1.106 14.130 1.00 0.00 ATOM 1270 CE2 PHE 163 -2.883 -0.079 13.924 1.00 0.00 ATOM 1271 CZ PHE 163 -4.136 0.065 14.494 1.00 0.00 ATOM 1272 O PHE 163 -2.069 4.287 8.403 1.00 0.00 ATOM 1273 C PHE 163 -2.271 3.105 8.688 1.00 0.00 ATOM 1274 N ASP 164 -1.764 2.097 7.985 1.00 0.00 ATOM 1275 CA ASP 164 -0.917 2.335 6.800 1.00 0.00 ATOM 1276 CB ASP 164 0.557 2.398 7.212 1.00 0.00 ATOM 1277 CG ASP 164 1.047 1.101 7.822 1.00 0.00 ATOM 1278 OD1 ASP 164 0.313 0.096 7.747 1.00 0.00 ATOM 1279 OD2 ASP 164 2.169 1.092 8.375 1.00 0.00 ATOM 1280 O ASP 164 -1.647 0.098 6.279 1.00 0.00 ATOM 1281 C ASP 164 -1.217 1.165 5.842 1.00 0.00 ATOM 1282 N ARG 165 -0.593 1.420 4.891 1.00 0.00 ATOM 1283 CA ARG 165 -0.631 0.613 3.676 1.00 0.00 ATOM 1284 CB ARG 165 -2.010 0.749 3.058 1.00 0.00 ATOM 1285 CG ARG 165 -3.136 0.111 3.874 1.00 0.00 ATOM 1286 CD ARG 165 -4.417 -0.046 3.048 1.00 0.00 ATOM 1287 NE ARG 165 -4.223 -1.153 2.121 1.00 0.00 ATOM 1288 CZ ARG 165 -4.431 -2.437 2.373 1.00 0.00 ATOM 1289 NH1 ARG 165 -4.920 -2.875 3.536 1.00 0.00 ATOM 1290 NH2 ARG 165 -4.154 -3.361 1.460 1.00 0.00 ATOM 1291 O ARG 165 0.995 2.214 2.935 1.00 0.00 ATOM 1292 C ARG 165 0.404 1.158 2.700 1.00 0.00 ATOM 1293 N GLN 166 0.623 0.440 1.603 1.00 0.00 ATOM 1294 CA GLN 166 1.573 0.867 0.621 1.00 0.00 ATOM 1295 CB GLN 166 1.677 -0.183 -0.491 1.00 0.00 ATOM 1296 CG GLN 166 2.401 -1.462 -0.062 1.00 0.00 ATOM 1297 CD GLN 166 1.459 -2.555 0.455 1.00 0.00 ATOM 1298 OE1 GLN 166 0.507 -2.295 1.210 1.00 0.00 ATOM 1299 NE2 GLN 166 1.730 -3.793 0.048 1.00 0.00 ATOM 1300 O GLN 166 -0.140 2.437 0.019 1.00 0.00 ATOM 1301 C GLN 166 1.068 2.201 0.075 1.00 0.00 ATOM 1302 N ALA 167 1.991 3.067 -0.327 1.00 0.00 ATOM 1303 CA ALA 167 1.621 4.370 -0.868 1.00 0.00 ATOM 1304 CB ALA 167 2.862 5.239 -1.028 1.00 0.00 ATOM 1305 O ALA 167 1.147 3.271 -2.968 1.00 0.00 ATOM 1306 C ALA 167 0.907 4.226 -2.216 1.00 0.00 ATOM 1307 N PHE 168 3.181 4.942 -3.720 1.00 0.00 ATOM 1308 CA PHE 168 2.530 5.456 -4.918 1.00 0.00 ATOM 1309 CB PHE 168 2.126 7.064 -4.393 1.00 0.00 ATOM 1310 CG PHE 168 2.097 7.309 -2.913 1.00 0.00 ATOM 1311 CD1 PHE 168 3.262 7.237 -2.157 1.00 0.00 ATOM 1312 CD2 PHE 168 0.901 7.616 -2.276 1.00 0.00 ATOM 1313 CE1 PHE 168 3.234 7.469 -0.782 1.00 0.00 ATOM 1314 CE2 PHE 168 0.861 7.852 -0.905 1.00 0.00 ATOM 1315 CZ PHE 168 2.028 7.778 -0.157 1.00 0.00 ATOM 1316 O PHE 168 3.501 4.920 -7.046 1.00 0.00 ATOM 1317 C PHE 168 3.589 5.579 -6.010 1.00 0.00 ATOM 1318 N GLY 169 4.589 6.423 -5.775 1.00 0.00 ATOM 1319 CA GLY 169 5.628 6.606 -6.730 1.00 0.00 ATOM 1320 O GLY 169 7.327 7.925 -5.720 1.00 0.00 ATOM 1321 C GLY 169 6.858 6.801 -5.903 1.00 0.00 ATOM 1322 N GLY 170 7.398 5.701 -5.390 1.00 0.00 ATOM 1323 CA GLY 170 8.600 5.763 -4.567 1.00 0.00 ATOM 1324 O GLY 170 9.428 6.337 -2.391 1.00 0.00 ATOM 1325 C GLY 170 8.450 6.265 -3.137 1.00 0.00 ATOM 1326 N ALA 171 7.226 6.612 -2.754 1.00 0.00 ATOM 1327 CA ALA 171 6.965 7.104 -1.407 1.00 0.00 ATOM 1328 CB ALA 171 6.368 8.503 -1.380 1.00 0.00 ATOM 1329 O ALA 171 5.425 5.264 -1.352 1.00 0.00 ATOM 1330 C ALA 171 6.081 6.079 -0.702 1.00 0.00 ATOM 1331 N ASP 172 6.065 6.123 0.626 1.00 0.00 ATOM 1332 CA ASP 172 5.276 5.214 1.368 1.00 0.00 ATOM 1333 CB ASP 172 6.211 4.486 2.334 1.00 0.00 ATOM 1334 CG ASP 172 5.475 3.521 3.242 1.00 0.00 ATOM 1335 OD1 ASP 172 4.229 3.472 3.170 1.00 0.00 ATOM 1336 OD2 ASP 172 6.144 2.816 4.027 1.00 0.00 ATOM 1337 O ASP 172 4.623 6.933 2.909 1.00 0.00 ATOM 1338 C ASP 172 4.273 5.956 2.244 1.00 0.00 ATOM 1339 N HIS 173 3.027 5.492 2.246 1.00 0.00 ATOM 1340 CA HIS 173 1.975 6.125 3.055 1.00 0.00 ATOM 1341 CB HIS 173 0.581 5.614 2.411 1.00 0.00 ATOM 1342 CG HIS 173 -0.603 6.021 3.237 1.00 0.00 ATOM 1343 CD2 HIS 173 -1.418 7.104 3.158 1.00 0.00 ATOM 1344 ND1 HIS 173 -1.013 5.307 4.351 1.00 0.00 ATOM 1345 CE1 HIS 173 -2.064 5.912 4.886 1.00 0.00 ATOM 1346 NE2 HIS 173 -2.324 7.004 4.192 1.00 0.00 ATOM 1347 O HIS 173 1.750 6.836 5.335 1.00 0.00 ATOM 1348 C HIS 173 2.263 6.038 4.550 1.00 0.00 ATOM 1349 N ASP 174 3.085 5.070 4.941 1.00 0.00 ATOM 1350 CA ASP 174 3.425 4.902 6.328 1.00 0.00 ATOM 1351 CB ASP 174 4.329 3.747 6.565 1.00 0.00 ATOM 1352 CG ASP 174 4.670 3.610 8.010 1.00 0.00 ATOM 1353 OD1 ASP 174 3.695 3.510 8.786 1.00 0.00 ATOM 1354 OD2 ASP 174 5.870 3.668 8.368 1.00 0.00 ATOM 1355 O ASP 174 3.968 6.568 7.968 1.00 0.00 ATOM 1356 C ASP 174 4.221 6.089 6.861 1.00 0.00 ATOM 1357 N ASP 175 5.182 6.561 6.074 1.00 0.00 ATOM 1358 CA ASP 175 6.021 7.713 6.482 1.00 0.00 ATOM 1359 CB ASP 175 7.119 8.009 5.459 1.00 0.00 ATOM 1360 CG ASP 175 8.245 6.996 5.505 1.00 0.00 ATOM 1361 OD1 ASP 175 8.299 6.210 6.473 1.00 0.00 ATOM 1362 OD2 ASP 175 9.075 6.988 4.571 1.00 0.00 ATOM 1363 O ASP 175 5.429 9.818 7.489 1.00 0.00 ATOM 1364 C ASP 175 5.185 8.996 6.604 1.00 0.00 ATOM 1365 N GLU 176 4.209 9.159 5.718 1.00 0.00 ATOM 1366 CA GLU 176 3.353 10.340 5.745 1.00 0.00 ATOM 1367 CB GLU 176 2.447 10.373 4.513 1.00 0.00 ATOM 1368 CG GLU 176 1.578 11.618 4.411 1.00 0.00 ATOM 1369 CD GLU 176 0.770 11.662 3.131 1.00 0.00 ATOM 1370 OE1 GLU 176 0.904 10.727 2.311 1.00 0.00 ATOM 1371 OE2 GLU 176 0.003 12.629 2.944 1.00 0.00 ATOM 1372 O GLU 176 2.209 11.486 7.515 1.00 0.00 ATOM 1373 C GLU 176 2.447 10.407 6.970 1.00 0.00 ATOM 1374 N MET 177 1.944 9.255 7.401 1.00 0.00 ATOM 1375 CA MET 177 1.064 9.199 8.571 1.00 0.00 ATOM 1376 CB MET 177 -0.459 9.225 8.345 1.00 0.00 ATOM 1377 CG MET 177 -1.221 9.435 9.636 1.00 0.00 ATOM 1378 SD MET 177 -1.862 7.850 10.119 1.00 0.00 ATOM 1379 CE MET 177 -3.473 7.964 9.436 1.00 0.00 ATOM 1380 O MET 177 1.371 6.824 8.567 1.00 0.00 ATOM 1381 C MET 177 1.313 7.855 9.237 1.00 0.00 ATOM 1382 N LEU 178 1.459 7.866 10.558 1.00 0.00 ATOM 1383 CA LEU 178 1.700 6.635 11.302 1.00 0.00 ATOM 1384 CB LEU 178 2.793 6.846 12.352 1.00 0.00 ATOM 1385 CG LEU 178 3.113 5.646 13.246 1.00 0.00 ATOM 1386 CD1 LEU 178 3.741 4.522 12.431 1.00 0.00 ATOM 1387 CD2 LEU 178 4.091 6.039 14.343 1.00 0.00 ATOM 1388 O LEU 178 -0.214 7.070 12.680 1.00 0.00 ATOM 1389 C LEU 178 0.403 6.247 12.002 1.00 0.00 ATOM 1390 N LEU 179 -0.008 4.995 11.838 1.00 0.00 ATOM 1391 CA LEU 179 -1.234 4.513 12.463 1.00 0.00 ATOM 1392 CB LEU 179 -2.384 4.275 11.872 1.00 0.00 ATOM 1393 CG LEU 179 -3.248 5.537 12.027 1.00 0.00 ATOM 1394 CD1 LEU 179 -4.413 5.548 11.038 1.00 0.00 ATOM 1395 CD2 LEU 179 -3.749 5.638 13.469 1.00 0.00 ATOM 1396 O LEU 179 -0.055 2.769 13.615 1.00 0.00 ATOM 1397 C LEU 179 -0.851 3.705 13.700 1.00 0.00 ATOM 1398 N ARG 180 -1.420 4.066 14.845 1.00 0.00 ATOM 1399 CA ARG 180 -1.129 3.362 16.089 1.00 0.00 ATOM 1400 CB ARG 180 -0.141 4.193 16.909 1.00 0.00 ATOM 1401 CG ARG 180 1.249 4.285 16.299 1.00 0.00 ATOM 1402 CD ARG 180 2.191 5.084 17.187 1.00 0.00 ATOM 1403 NE ARG 180 1.837 6.501 17.225 1.00 0.00 ATOM 1404 CZ ARG 180 2.220 7.341 18.181 1.00 0.00 ATOM 1405 NH1 ARG 180 1.852 8.613 18.132 1.00 0.00 ATOM 1406 NH2 ARG 180 2.971 6.907 19.183 1.00 0.00 ATOM 1407 O ARG 180 -3.316 4.002 16.837 1.00 0.00 ATOM 1408 C ARG 180 -2.391 3.201 16.914 1.00 0.00 ATOM 1409 N ILE 181 -2.388 2.197 17.793 1.00 0.00 ATOM 1410 CA ILE 181 -3.511 1.928 18.622 1.00 0.00 ATOM 1411 CB ILE 181 -3.551 0.430 19.069 1.00 0.00 ATOM 1412 CG1 ILE 181 -2.360 0.119 19.975 1.00 0.00 ATOM 1413 CG2 ILE 181 -3.524 -0.472 17.844 1.00 0.00 ATOM 1414 CD1 ILE 181 -2.432 -1.272 20.600 1.00 0.00 ATOM 1415 O ILE 181 -2.585 3.480 20.214 1.00 0.00 ATOM 1416 C ILE 181 -3.575 2.876 19.808 1.00 0.00 ATOM 1417 N GLY 182 -4.761 3.001 20.371 1.00 0.00 ATOM 1418 CA GLY 182 -4.994 3.881 21.491 1.00 0.00 ATOM 1419 O GLY 182 -7.266 3.157 21.230 1.00 0.00 ATOM 1420 C GLY 182 -6.473 4.019 21.647 1.00 0.00 ATOM 1421 N PRO 183 -6.932 5.115 22.256 1.00 0.00 ATOM 1422 CA PRO 183 -8.363 5.209 22.558 1.00 0.00 ATOM 1423 CB PRO 183 -8.455 6.473 23.432 1.00 0.00 ATOM 1424 CG PRO 183 -7.125 6.999 23.531 1.00 0.00 ATOM 1425 CD PRO 183 -6.151 6.170 22.928 1.00 0.00 ATOM 1426 O PRO 183 -10.384 4.803 21.339 1.00 0.00 ATOM 1427 C PRO 183 -9.240 5.281 21.306 1.00 0.00 ATOM 1428 N PHE 184 -8.688 5.883 20.263 1.00 0.00 ATOM 1429 CA PHE 184 -9.377 6.031 19.025 1.00 0.00 ATOM 1430 CB PHE 184 -8.224 6.247 17.849 1.00 0.00 ATOM 1431 CG PHE 184 -8.522 7.077 16.623 1.00 0.00 ATOM 1432 CD1 PHE 184 -8.244 8.426 16.604 1.00 0.00 ATOM 1433 CD2 PHE 184 -9.055 6.485 15.488 1.00 0.00 ATOM 1434 CE1 PHE 184 -8.523 9.205 15.453 1.00 0.00 ATOM 1435 CE2 PHE 184 -9.319 7.246 14.328 1.00 0.00 ATOM 1436 CZ PHE 184 -9.048 8.593 14.319 1.00 0.00 ATOM 1437 O PHE 184 -10.818 4.464 17.841 1.00 0.00 ATOM 1438 C PHE 184 -9.710 4.655 18.418 1.00 0.00 ATOM 1439 N THR 185 -8.753 3.711 18.458 1.00 0.00 ATOM 1440 CA THR 185 -8.904 2.365 17.871 1.00 0.00 ATOM 1441 CB THR 185 -7.519 1.655 17.776 1.00 0.00 ATOM 1442 CG2 THR 185 -6.658 2.376 16.816 1.00 0.00 ATOM 1443 OG1 THR 185 -6.833 1.626 19.041 1.00 0.00 ATOM 1444 O THR 185 -10.685 0.819 18.017 1.00 0.00 ATOM 1445 C THR 185 -9.899 1.560 18.608 1.00 0.00 ATOM 1446 N HIS 186 -9.889 1.691 19.930 1.00 0.00 ATOM 1447 CA HIS 186 -10.824 0.955 20.771 1.00 0.00 ATOM 1448 CB HIS 186 -10.571 1.265 22.247 1.00 0.00 ATOM 1449 CG HIS 186 -11.270 0.336 23.187 1.00 0.00 ATOM 1450 CD2 HIS 186 -10.882 -0.814 23.993 1.00 0.00 ATOM 1451 ND1 HIS 186 -12.612 0.447 23.484 1.00 0.00 ATOM 1452 CE1 HIS 186 -12.950 -0.522 24.353 1.00 0.00 ATOM 1453 NE2 HIS 186 -11.919 -1.283 24.662 1.00 0.00 ATOM 1454 O HIS 186 -12.547 2.524 20.303 1.00 0.00 ATOM 1455 C HIS 186 -12.252 1.322 20.452 1.00 0.00 ATOM 1456 N PRO 187 -13.183 0.373 20.341 1.00 0.00 ATOM 1457 CA PRO 187 -14.587 0.671 20.018 1.00 0.00 ATOM 1458 CB PRO 187 -15.209 -0.707 19.787 1.00 0.00 ATOM 1459 CG PRO 187 -14.408 -1.628 20.644 1.00 0.00 ATOM 1460 CD PRO 187 -12.997 -1.111 20.603 1.00 0.00 ATOM 1461 O PRO 187 -14.614 1.579 22.257 1.00 0.00 ATOM 1462 C PRO 187 -15.187 1.494 21.168 1.00 0.00 ATOM 1463 N PRO 188 -16.376 2.045 20.965 1.00 0.00 ATOM 1464 CA PRO 188 -17.019 2.877 21.998 1.00 0.00 ATOM 1465 CB PRO 188 -18.346 3.296 21.359 1.00 0.00 ATOM 1466 CG PRO 188 -18.044 3.388 19.900 1.00 0.00 ATOM 1467 CD PRO 188 -17.124 2.240 19.592 1.00 0.00 ATOM 1468 O PRO 188 -17.239 2.762 24.380 1.00 0.00 ATOM 1469 C PRO 188 -17.315 2.170 23.308 1.00 0.00 ATOM 1470 N HIS 189 -17.746 0.921 23.228 1.00 0.00 ATOM 1471 CA HIS 189 -18.110 0.197 24.397 1.00 0.00 ATOM 1472 CB HIS 189 -18.591 -1.219 23.983 1.00 0.00 ATOM 1473 CG HIS 189 -18.811 -2.140 25.121 1.00 0.00 ATOM 1474 CD2 HIS 189 -18.055 -3.162 25.596 1.00 0.00 ATOM 1475 ND1 HIS 189 -19.870 -1.994 25.995 1.00 0.00 ATOM 1476 CE1 HIS 189 -19.755 -2.900 26.952 1.00 0.00 ATOM 1477 NE2 HIS 189 -18.669 -3.623 26.733 1.00 0.00 ATOM 1478 O HIS 189 -15.794 -0.278 24.896 1.00 0.00 ATOM 1479 C HIS 189 -16.910 -0.025 25.332 1.00 0.00 TER END