PFRMAT TS TARGET T0327 AUTHOR 5370-1100-4902 METHOD The SAM-T06 hand predictions use methods similar to SAM_T04 in CASP6 and METHOD the SAM-T02 method in CASP5. METHOD METHOD We start with a fully automated method (implemented as the SAM_T06 server): METHOD METHOD Use the SAM-T2K and SAM-T04 methods for finding homologs of the METHOD target and aligning them. The hand method also uses the METHOD experimental new SAM-T06 alignment method, which we hope is both METHOD more sensitive and lass prone to contamination by unrelated sequences. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignments. METHOD METHOD We currently use 10 local-structure alphabets: METHOD DSSP METHOD STRIDE METHOD STR2 an extended version of DSSP that splits the beta strands METHOD into multiple classes (parallel/antiparallel/mixed, METHOD edge/center) 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 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 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 O_NOTOR2 an alphabet for predicting chracteristics of hydrogen METHOD bonds from the carbonyl oxygen METHOD N_NOTOR2 an alphabet for predicting chracteristics of hydrogen METHOD bonds from the amide nitrogen METHOD We hope to add more networks for other alphabets over the summer. METHOD METHOD We make 2-track HMMs with each alphabet (1.0 amino acid + 0.3 METHOD local structure) and use them to score a template library of about METHOD 8000 (t06), 10000 (t04), or 15000 (t2k) templates. METHOD The template libraries are expanded weekly, but old template HMMs METHOD are not rebuilt. METHOD METHOD We also used a single-track HMM to score not just the template METHOD library, but a non-redundant copy of the entire PDB. METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence. 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 methods (mainly using the SAM hmmscore METHOD program, but a few alignments were made with Bob Edgar's MUSCLE METHOD profile-profile aligner). 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. The contact prediction method METHOD is expected to evolve over the summer, as new features are METHOD selected and new networks trained. METHOD METHOD Then the "undertaker" program (named because it optimizes burial) METHOD is used to try to combine the alignments and the fragments into a METHOD consistent 3D model. No single alignment or parent template was METHOD used as a frozen core, though in many cases one had much more METHOD influence than the others. The alignment scores were not passed METHOD to undertaker, but were used only to pick the set of alignments METHOD and fragments that undertaker would see. Helix and strand METHOD constraints generated from the secondary-structure predictions are METHOD passed to undertaker to use in the cost function, as are the METHOD residue-residue contact prediction. METHOD METHOD One important change in this server over previous methods is that METHOD sheet constraints are extracted from the top few alignments and METHOD passed to undertaker. 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 METHOD New this year, we are also occasionally using ProteinShop to METHOD manipulate proteins by hand, to produce starting points for undertaker METHOD optimization. We expect this to be most useful in new-fold all-alpha METHOD proteins, where undertaker often gets trapped in poor local minima by METHOD extending helices too far. METHOD METHOD Another new trick is to optimize models with gromacs to knock them out METHOD of a local minimum. The gromacs optimization does terrible things to METHOD the model (messing up sidechains and peptide planes), but is good at METHOD removing clashes. The resulting models are only a small distance from METHOD the pre-optimization models, but score much worse with the undertaker METHOD cost functions, so undertaker can move them more freely than models it METHOD has optimized itself. METHOD METHOD METHOD For T0327 we used Proteinshop to straighten out a helix that monomeric METHOD optimization had crumpled up (it likes to reduce radius of gyration). METHOD We then formed a dimer based on 1tbx[AB] (though 1ub9A might have METHOD been a better choice in retrospect), and optimized as a dimer. METHOD METHOD Model 1 is chain A from dimer/try14-opt2, our favorite dimer. METHOD METHOD Model 2 is chain A from dimer/try13-opt2, a rather less convincing METHOD dimer in which the helices barely interact. METHOD METHOD Model 3 is try4-opt2, a monomer optimized from alignments (mainly METHOD 1ub9A), showing the folded over helix. METHOD METHOD Model 4 is sidechain replacement by SCWRL on an alignment to 1tbxA. METHOD METHOD Model 5 is sidechain replacement by SCWRL on an alignment to 1ub9A. METHOD REMARK 6 REMARK 6 T0327 model 2 Sun Jul 2 22:00:36 2006 MODEL 2 PARENT 1tbx_A 1ub9_A 2a61_A 2fbi_A 2f2e_A REMARK 7 REMARK 7 ALLPARENTS 1tbx_A 1ub9_A 2a61_A 2fbi_A 2f2e_A 2g7u_A 1z7u_A REMARK 7 ALLPARENTS 2fsw_A 1r7j_A 1xma_A 1jgs_A 1yyv_A 1hw1_A 1mkm_A REMARK 7 ALLPARENTS 2fbh_A 1p4x_A ATOM 1 N MET 1 10.623 -0.520 3.291 1.00 0.00 ATOM 2 CA MET 1 11.984 -1.014 3.570 1.00 0.00 ATOM 3 CB MET 1 12.138 -1.470 5.014 1.00 0.00 ATOM 4 CG MET 1 12.344 -0.295 5.893 1.00 0.00 ATOM 5 SD MET 1 12.346 -0.691 7.588 1.00 0.00 ATOM 6 CE MET 1 13.817 -1.615 7.833 1.00 0.00 ATOM 7 O MET 1 11.342 -2.939 2.260 1.00 0.00 ATOM 8 C MET 1 12.257 -2.179 2.611 1.00 0.00 ATOM 9 N ASN 2 13.481 -2.329 2.161 1.00 0.00 ATOM 10 CA ASN 2 13.826 -3.411 1.239 1.00 0.00 ATOM 11 CB ASN 2 15.249 -3.386 0.768 1.00 0.00 ATOM 12 CG ASN 2 16.266 -3.483 1.921 1.00 0.00 ATOM 13 ND2 ASN 2 17.263 -4.329 1.713 1.00 0.00 ATOM 14 OD1 ASN 2 16.129 -2.857 2.993 1.00 0.00 ATOM 15 O ASN 2 13.468 -5.765 1.148 1.00 0.00 ATOM 16 C ASN 2 13.628 -4.774 1.860 1.00 0.00 ATOM 17 N LYS 3 13.679 -4.841 3.160 1.00 0.00 ATOM 18 CA LYS 3 13.502 -6.103 3.876 1.00 0.00 ATOM 19 CB LYS 3 13.678 -5.918 5.395 1.00 0.00 ATOM 20 CG LYS 3 15.140 -5.565 5.769 1.00 0.00 ATOM 21 CD LYS 3 15.148 -5.056 7.210 1.00 0.00 ATOM 22 CE LYS 3 16.525 -5.145 7.840 1.00 0.00 ATOM 23 NZ LYS 3 16.603 -4.262 9.047 1.00 0.00 ATOM 24 O LYS 3 11.892 -7.867 3.395 1.00 0.00 ATOM 25 C LYS 3 12.069 -6.667 3.598 1.00 0.00 ATOM 26 N ASP 4 11.073 -5.818 3.617 1.00 0.00 ATOM 27 CA ASP 4 9.702 -6.258 3.382 1.00 0.00 ATOM 28 CB ASP 4 8.727 -5.187 3.308 1.00 0.00 ATOM 29 CG ASP 4 7.313 -5.714 3.250 1.00 0.00 ATOM 30 OD1 ASP 4 7.014 -6.676 3.987 1.00 0.00 ATOM 31 OD2 ASP 4 6.446 -5.233 2.508 1.00 0.00 ATOM 32 O ASP 4 8.944 -7.861 1.735 1.00 0.00 ATOM 33 C ASP 4 9.548 -6.808 1.963 1.00 0.00 ATOM 34 N LYS 5 10.114 -6.143 0.943 1.00 0.00 ATOM 35 CA LYS 5 10.084 -6.682 -0.417 1.00 0.00 ATOM 36 CB LYS 5 10.807 -5.718 -1.374 1.00 0.00 ATOM 37 CG LYS 5 10.839 -6.165 -2.830 1.00 0.00 ATOM 38 CD LYS 5 9.456 -6.158 -3.451 1.00 0.00 ATOM 39 CE LYS 5 9.525 -6.506 -4.929 1.00 0.00 ATOM 40 NZ LYS 5 10.479 -5.611 -5.647 1.00 0.00 ATOM 41 O LYS 5 10.309 -8.981 -1.232 1.00 0.00 ATOM 42 C LYS 5 10.755 -8.047 -0.544 1.00 0.00 ATOM 43 N LEU 6 11.908 -8.243 0.148 1.00 0.00 ATOM 44 CA LEU 6 12.550 -9.549 0.102 1.00 0.00 ATOM 45 CB LEU 6 13.911 -9.496 0.820 1.00 0.00 ATOM 46 CG LEU 6 14.905 -8.451 0.309 1.00 0.00 ATOM 47 CD1 LEU 6 16.217 -8.577 1.073 1.00 0.00 ATOM 48 CD2 LEU 6 15.134 -8.644 -1.182 1.00 0.00 ATOM 49 O LEU 6 11.532 -11.742 0.218 1.00 0.00 ATOM 50 C LEU 6 11.621 -10.619 0.719 1.00 0.00 ATOM 51 N ARG 7 10.936 -10.312 1.822 1.00 0.00 ATOM 52 CA ARG 7 9.968 -11.236 2.393 1.00 0.00 ATOM 53 CB ARG 7 9.485 -10.702 3.779 1.00 0.00 ATOM 54 CG ARG 7 10.576 -10.655 4.834 1.00 0.00 ATOM 55 CD ARG 7 10.109 -9.854 6.052 1.00 0.00 ATOM 56 NE ARG 7 10.994 -10.043 7.196 1.00 0.00 ATOM 57 CZ ARG 7 11.012 -9.270 8.260 1.00 0.00 ATOM 58 NH1 ARG 7 10.219 -8.198 8.323 1.00 0.00 ATOM 59 NH2 ARG 7 11.829 -9.564 9.250 1.00 0.00 ATOM 60 O ARG 7 8.338 -12.641 1.302 1.00 0.00 ATOM 61 C ARG 7 8.827 -11.519 1.426 1.00 0.00 ATOM 62 N TYR 8 8.428 -10.524 0.590 1.00 0.00 ATOM 63 CA TYR 8 7.384 -10.773 -0.415 1.00 0.00 ATOM 64 CB TYR 8 7.173 -9.475 -1.229 1.00 0.00 ATOM 65 CG TYR 8 6.381 -9.694 -2.502 1.00 0.00 ATOM 66 CD1 TYR 8 4.985 -9.760 -2.486 1.00 0.00 ATOM 67 CD2 TYR 8 7.032 -9.836 -3.724 1.00 0.00 ATOM 68 CE1 TYR 8 4.288 -9.932 -3.672 1.00 0.00 ATOM 69 CE2 TYR 8 6.338 -10.022 -4.911 1.00 0.00 ATOM 70 CZ TYR 8 4.947 -10.074 -4.879 1.00 0.00 ATOM 71 OH TYR 8 4.192 -10.254 -6.018 1.00 0.00 ATOM 72 O TYR 8 7.005 -12.793 -1.695 1.00 0.00 ATOM 73 C TYR 8 7.778 -11.896 -1.374 1.00 0.00 ATOM 74 N ALA 9 9.046 -11.866 -1.828 1.00 0.00 ATOM 75 CA ALA 9 9.526 -12.893 -2.743 1.00 0.00 ATOM 76 CB ALA 9 10.908 -12.539 -3.257 1.00 0.00 ATOM 77 O ALA 9 9.220 -15.284 -2.653 1.00 0.00 ATOM 78 C ALA 9 9.519 -14.239 -2.034 1.00 0.00 ATOM 79 N ILE 10 9.847 -14.263 -0.745 1.00 0.00 ATOM 80 CA ILE 10 9.882 -15.502 0.013 1.00 0.00 ATOM 81 CB ILE 10 10.442 -15.199 1.407 1.00 0.00 ATOM 82 CG1 ILE 10 11.837 -14.572 1.335 1.00 0.00 ATOM 83 CG2 ILE 10 10.521 -16.486 2.197 1.00 0.00 ATOM 84 CD1 ILE 10 12.629 -14.326 2.626 1.00 0.00 ATOM 85 O ILE 10 8.366 -17.371 0.125 1.00 0.00 ATOM 86 C ILE 10 8.490 -16.146 0.120 1.00 0.00 ATOM 87 N LEU 11 7.453 -15.335 0.211 1.00 0.00 ATOM 88 CA LEU 11 6.079 -15.845 0.307 1.00 0.00 ATOM 89 CB LEU 11 5.114 -14.701 0.628 1.00 0.00 ATOM 90 CG LEU 11 5.310 -14.086 1.989 1.00 0.00 ATOM 91 CD1 LEU 11 4.435 -12.856 2.122 1.00 0.00 ATOM 92 CD2 LEU 11 5.015 -15.051 3.089 1.00 0.00 ATOM 93 O LEU 11 5.071 -17.641 -0.902 1.00 0.00 ATOM 94 C LEU 11 5.655 -16.571 -0.972 1.00 0.00 ATOM 95 N LYS 12 6.038 -16.006 -2.114 1.00 0.00 ATOM 96 CA LYS 12 5.814 -16.649 -3.408 1.00 0.00 ATOM 97 CB LYS 12 6.304 -15.771 -4.561 1.00 0.00 ATOM 98 CG LYS 12 6.074 -16.377 -5.933 1.00 0.00 ATOM 99 CD LYS 12 6.499 -15.402 -7.022 1.00 0.00 ATOM 100 CE LYS 12 6.260 -15.974 -8.408 1.00 0.00 ATOM 101 NZ LYS 12 6.715 -14.984 -9.440 1.00 0.00 ATOM 102 O LYS 12 5.966 -19.013 -3.803 1.00 0.00 ATOM 103 C LYS 12 6.558 -17.984 -3.490 1.00 0.00 ATOM 104 N GLU 13 7.870 -17.993 -3.153 1.00 0.00 ATOM 105 CA GLU 13 8.660 -19.230 -3.140 1.00 0.00 ATOM 106 CB GLU 13 9.994 -19.091 -2.589 1.00 0.00 ATOM 107 CG GLU 13 10.760 -20.390 -2.381 1.00 0.00 ATOM 108 CD GLU 13 12.232 -20.151 -2.056 1.00 0.00 ATOM 109 OE1 GLU 13 12.533 -19.322 -1.167 1.00 0.00 ATOM 110 OE2 GLU 13 13.102 -20.802 -2.688 1.00 0.00 ATOM 111 O GLU 13 7.663 -21.362 -2.599 1.00 0.00 ATOM 112 C GLU 13 8.064 -20.284 -2.184 1.00 0.00 ATOM 113 N ILE 14 7.698 -19.855 -0.986 1.00 0.00 ATOM 114 CA ILE 14 7.163 -20.791 0.019 1.00 0.00 ATOM 115 CB ILE 14 7.512 -20.290 1.438 1.00 0.00 ATOM 116 CG1 ILE 14 8.999 -19.963 1.611 1.00 0.00 ATOM 117 CG2 ILE 14 7.236 -21.349 2.503 1.00 0.00 ATOM 118 CD1 ILE 14 10.010 -21.126 1.527 1.00 0.00 ATOM 119 O ILE 14 5.143 -22.044 0.315 1.00 0.00 ATOM 120 C ILE 14 5.684 -21.083 -0.233 1.00 0.00 ATOM 121 N PHE 15 4.946 -20.340 -1.139 1.00 0.00 ATOM 122 CA PHE 15 3.536 -20.587 -1.415 1.00 0.00 ATOM 123 CB PHE 15 3.064 -19.492 -2.430 1.00 0.00 ATOM 124 CG PHE 15 1.590 -19.519 -2.728 1.00 0.00 ATOM 125 CD1 PHE 15 0.713 -18.661 -2.071 1.00 0.00 ATOM 126 CD2 PHE 15 1.077 -20.405 -3.669 1.00 0.00 ATOM 127 CE1 PHE 15 -0.654 -18.686 -2.350 1.00 0.00 ATOM 128 CE2 PHE 15 -0.286 -20.439 -3.956 1.00 0.00 ATOM 129 CZ PHE 15 -1.152 -19.579 -3.299 1.00 0.00 ATOM 130 O PHE 15 2.373 -22.695 -1.428 1.00 0.00 ATOM 131 C PHE 15 3.218 -21.978 -1.970 1.00 0.00 ATOM 132 N GLU 16 3.939 -22.330 -3.024 1.00 0.00 ATOM 133 CA GLU 16 3.784 -23.630 -3.697 1.00 0.00 ATOM 134 CB GLU 16 4.634 -23.634 -4.966 1.00 0.00 ATOM 135 CG GLU 16 4.354 -24.794 -5.932 1.00 0.00 ATOM 136 CD GLU 16 5.194 -24.718 -7.223 1.00 0.00 ATOM 137 OE1 GLU 16 5.022 -25.609 -8.085 1.00 0.00 ATOM 138 OE2 GLU 16 6.106 -23.859 -7.273 1.00 0.00 ATOM 139 O GLU 16 3.685 -25.921 -2.944 1.00 0.00 ATOM 140 C GLU 16 4.052 -24.772 -2.699 1.00 0.00 ATOM 141 N GLY 17 4.716 -24.498 -1.509 1.00 0.00 ATOM 142 CA GLY 17 5.026 -25.502 -0.501 1.00 0.00 ATOM 143 O GLY 17 6.143 -25.153 1.572 1.00 0.00 ATOM 144 C GLY 17 6.276 -25.457 0.393 1.00 0.00 ATOM 145 N ASN 18 7.341 -26.123 -0.057 1.00 0.00 ATOM 146 CA ASN 18 8.597 -26.214 0.731 1.00 0.00 ATOM 147 CB ASN 18 8.680 -27.530 1.499 1.00 0.00 ATOM 148 CG ASN 18 8.694 -28.724 0.555 1.00 0.00 ATOM 149 ND2 ASN 18 7.558 -29.326 0.418 1.00 0.00 ATOM 150 OD1 ASN 18 9.670 -29.086 -0.091 1.00 0.00 ATOM 151 O ASN 18 9.871 -26.686 -1.210 1.00 0.00 ATOM 152 C ASN 18 9.862 -26.102 -0.137 1.00 0.00 ATOM 153 N THR 19 10.962 -25.690 0.487 1.00 0.00 ATOM 154 CA THR 19 12.280 -25.595 -0.171 1.00 0.00 ATOM 155 CB THR 19 12.495 -24.202 -0.711 1.00 0.00 ATOM 156 CG2 THR 19 13.763 -24.203 -1.571 1.00 0.00 ATOM 157 OG1 THR 19 11.435 -23.871 -1.618 1.00 0.00 ATOM 158 O THR 19 13.187 -25.189 2.018 1.00 0.00 ATOM 159 C THR 19 13.419 -25.616 0.875 1.00 0.00 ATOM 160 N PRO 20 14.599 -26.149 0.545 1.00 0.00 ATOM 161 CA PRO 20 15.772 -26.096 1.438 1.00 0.00 ATOM 162 CB PRO 20 16.875 -26.675 0.577 1.00 0.00 ATOM 163 CG PRO 20 16.141 -27.676 -0.269 1.00 0.00 ATOM 164 CD PRO 20 14.935 -26.902 -0.692 1.00 0.00 ATOM 165 O PRO 20 15.927 -23.738 0.926 1.00 0.00 ATOM 166 C PRO 20 16.089 -24.634 1.748 1.00 0.00 ATOM 167 N LEU 21 16.550 -24.438 2.971 1.00 0.00 ATOM 168 CA LEU 21 17.028 -23.145 3.498 1.00 0.00 ATOM 169 CB LEU 21 17.666 -23.438 4.864 1.00 0.00 ATOM 170 CG LEU 21 19.148 -23.828 4.795 1.00 0.00 ATOM 171 CD1 LEU 21 20.024 -22.685 5.301 1.00 0.00 ATOM 172 CD2 LEU 21 19.484 -25.194 5.399 1.00 0.00 ATOM 173 O LEU 21 18.268 -21.341 2.508 1.00 0.00 ATOM 174 C LEU 21 18.143 -22.561 2.632 1.00 0.00 ATOM 175 N SER 22 18.933 -23.416 1.982 1.00 0.00 ATOM 176 CA SER 22 20.037 -22.983 1.131 1.00 0.00 ATOM 177 CB SER 22 20.874 -24.574 1.164 1.00 0.00 ATOM 178 OG SER 22 20.388 -25.187 -0.015 1.00 0.00 ATOM 179 O SER 22 20.489 -21.831 -0.901 1.00 0.00 ATOM 180 C SER 22 19.638 -22.397 -0.223 1.00 0.00 ATOM 181 N GLU 23 18.377 -22.522 -0.603 1.00 0.00 ATOM 182 CA GLU 23 18.003 -22.018 -1.945 1.00 0.00 ATOM 183 CB GLU 23 16.744 -22.840 -2.362 1.00 0.00 ATOM 184 CG GLU 23 16.856 -24.381 -2.432 1.00 0.00 ATOM 185 CD GLU 23 17.960 -25.004 -3.303 1.00 0.00 ATOM 186 OE1 GLU 23 18.177 -24.498 -4.431 1.00 0.00 ATOM 187 OE2 GLU 23 18.668 -25.932 -2.812 1.00 0.00 ATOM 188 O GLU 23 18.148 -19.770 -1.108 1.00 0.00 ATOM 189 C GLU 23 18.362 -20.543 -2.044 1.00 0.00 ATOM 190 N ASN 24 18.936 -20.100 -3.253 1.00 0.00 ATOM 191 CA ASN 24 19.303 -18.717 -3.497 1.00 0.00 ATOM 192 CB ASN 24 20.812 -18.575 -3.723 1.00 0.00 ATOM 193 CG ASN 24 21.295 -17.153 -3.475 1.00 0.00 ATOM 194 ND2 ASN 24 22.508 -16.835 -3.925 1.00 0.00 ATOM 195 OD1 ASN 24 20.583 -16.347 -2.874 1.00 0.00 ATOM 196 O ASN 24 18.984 -17.372 -5.479 1.00 0.00 ATOM 197 C ASN 24 18.490 -18.161 -4.666 1.00 0.00 ATOM 198 N ASP 25 17.215 -18.542 -4.795 1.00 0.00 ATOM 199 CA ASP 25 16.314 -18.093 -5.850 1.00 0.00 ATOM 200 CB ASP 25 15.277 -19.283 -6.114 1.00 0.00 ATOM 201 CG ASP 25 15.914 -20.571 -6.675 1.00 0.00 ATOM 202 OD1 ASP 25 17.066 -20.571 -7.165 1.00 0.00 ATOM 203 OD2 ASP 25 15.196 -21.636 -6.566 1.00 0.00 ATOM 204 O ASP 25 15.345 -15.995 -6.511 1.00 0.00 ATOM 205 C ASP 25 15.684 -16.734 -5.590 1.00 0.00 ATOM 206 N ILE 26 15.534 -16.411 -4.308 1.00 0.00 ATOM 207 CA ILE 26 15.001 -15.087 -3.915 1.00 0.00 ATOM 208 CB ILE 26 14.269 -15.141 -2.548 1.00 0.00 ATOM 209 CG1 ILE 26 15.245 -15.408 -1.383 1.00 0.00 ATOM 210 CG2 ILE 26 13.158 -16.210 -2.586 1.00 0.00 ATOM 211 CD1 ILE 26 14.600 -15.336 -0.026 1.00 0.00 ATOM 212 O ILE 26 15.781 -12.826 -3.649 1.00 0.00 ATOM 213 C ILE 26 16.088 -14.003 -3.801 1.00 0.00 ATOM 214 N GLY 27 17.342 -14.451 -3.788 1.00 0.00 ATOM 215 CA GLY 27 18.524 -13.569 -3.761 1.00 0.00 ATOM 216 O GLY 27 19.481 -11.918 -2.340 1.00 0.00 ATOM 217 C GLY 27 18.825 -12.958 -2.406 1.00 0.00 ATOM 218 N VAL 28 18.352 -13.606 -1.364 1.00 0.00 ATOM 219 CA VAL 28 18.616 -13.100 -0.017 1.00 0.00 ATOM 220 CB VAL 28 17.416 -13.387 0.919 1.00 0.00 ATOM 221 CG1 VAL 28 17.639 -12.929 2.350 1.00 0.00 ATOM 222 CG2 VAL 28 16.170 -12.722 0.338 1.00 0.00 ATOM 223 O VAL 28 20.202 -14.861 0.449 1.00 0.00 ATOM 224 C VAL 28 19.855 -13.687 0.660 1.00 0.00 ATOM 225 N THR 29 20.536 -12.887 1.490 1.00 0.00 ATOM 226 CA THR 29 21.622 -13.384 2.302 1.00 0.00 ATOM 227 CB THR 29 22.328 -12.227 3.049 1.00 0.00 ATOM 228 CG2 THR 29 22.956 -11.218 2.076 1.00 0.00 ATOM 229 OG1 THR 29 21.348 -11.563 3.859 1.00 0.00 ATOM 230 O THR 29 19.914 -14.375 3.659 1.00 0.00 ATOM 231 C THR 29 21.090 -14.426 3.284 1.00 0.00 ATOM 232 N GLU 30 21.959 -15.360 3.673 1.00 0.00 ATOM 233 CA GLU 30 21.587 -16.409 4.650 1.00 0.00 ATOM 234 CB GLU 30 22.797 -17.296 4.902 1.00 0.00 ATOM 235 CG GLU 30 23.346 -18.093 3.710 1.00 0.00 ATOM 236 CD GLU 30 24.530 -18.954 4.106 1.00 0.00 ATOM 237 OE1 GLU 30 25.147 -18.674 5.155 1.00 0.00 ATOM 238 OE2 GLU 30 24.841 -19.912 3.369 1.00 0.00 ATOM 239 O GLU 30 20.123 -16.215 6.548 1.00 0.00 ATOM 240 C GLU 30 21.099 -15.766 5.941 1.00 0.00 ATOM 241 N ASP 31 21.753 -14.733 6.361 1.00 0.00 ATOM 242 CA ASP 31 21.450 -14.013 7.589 1.00 0.00 ATOM 243 CB ASP 31 22.467 -12.895 7.847 1.00 0.00 ATOM 244 CG ASP 31 23.890 -13.368 8.160 1.00 0.00 ATOM 245 OD1 ASP 31 24.049 -14.537 8.520 1.00 0.00 ATOM 246 OD2 ASP 31 24.818 -12.582 7.909 1.00 0.00 ATOM 247 O ASP 31 19.195 -13.696 8.390 1.00 0.00 ATOM 248 C ASP 31 20.047 -13.403 7.559 1.00 0.00 ATOM 249 N GLN 32 19.780 -12.624 6.505 1.00 0.00 ATOM 250 CA GLN 32 18.451 -12.000 6.365 1.00 0.00 ATOM 251 CB GLN 32 18.430 -11.055 5.181 1.00 0.00 ATOM 252 CG GLN 32 19.257 -9.797 5.454 1.00 0.00 ATOM 253 CD GLN 32 19.478 -9.062 4.146 1.00 0.00 ATOM 254 OE1 GLN 32 19.620 -9.658 3.091 1.00 0.00 ATOM 255 NE2 GLN 32 19.609 -7.752 4.234 1.00 0.00 ATOM 256 O GLN 32 16.257 -12.905 6.748 1.00 0.00 ATOM 257 C GLN 32 17.356 -13.052 6.206 1.00 0.00 ATOM 258 N PHE 33 17.628 -14.154 5.440 1.00 0.00 ATOM 259 CA PHE 33 16.659 -15.224 5.244 1.00 0.00 ATOM 260 CB PHE 33 17.473 -16.329 4.546 1.00 0.00 ATOM 261 CG PHE 33 16.703 -17.191 3.552 1.00 0.00 ATOM 262 CD1 PHE 33 16.852 -16.857 2.223 1.00 0.00 ATOM 263 CD2 PHE 33 16.001 -18.348 3.912 1.00 0.00 ATOM 264 CE1 PHE 33 16.322 -17.669 1.236 1.00 0.00 ATOM 265 CE2 PHE 33 15.441 -19.141 2.913 1.00 0.00 ATOM 266 CZ PHE 33 15.592 -18.796 1.573 1.00 0.00 ATOM 267 O PHE 33 15.162 -16.122 6.895 1.00 0.00 ATOM 268 C PHE 33 16.322 -15.837 6.599 1.00 0.00 ATOM 269 N ASP 34 17.351 -16.045 7.459 1.00 0.00 ATOM 270 CA ASP 34 17.169 -16.635 8.778 1.00 0.00 ATOM 271 CB ASP 34 18.501 -16.828 9.519 1.00 0.00 ATOM 272 CG ASP 34 19.270 -18.067 9.052 1.00 0.00 ATOM 273 OD1 ASP 34 18.685 -18.918 8.338 1.00 0.00 ATOM 274 OD2 ASP 34 20.469 -18.273 9.361 1.00 0.00 ATOM 275 O ASP 34 15.393 -16.293 10.343 1.00 0.00 ATOM 276 C ASP 34 16.285 -15.779 9.672 1.00 0.00 ATOM 277 N ASP 35 16.538 -14.461 9.677 1.00 0.00 ATOM 278 CA ASP 35 15.752 -13.559 10.510 1.00 0.00 ATOM 279 CB ASP 35 16.232 -12.130 10.442 1.00 0.00 ATOM 280 CG ASP 35 17.602 -11.960 11.061 1.00 0.00 ATOM 281 OD1 ASP 35 18.014 -12.832 11.857 1.00 0.00 ATOM 282 OD2 ASP 35 18.334 -10.974 10.820 1.00 0.00 ATOM 283 O ASP 35 13.364 -13.616 10.935 1.00 0.00 ATOM 284 C ASP 35 14.286 -13.557 10.076 1.00 0.00 ATOM 285 N ALA 36 14.012 -13.459 8.756 1.00 0.00 ATOM 286 CA ALA 36 12.653 -13.408 8.269 1.00 0.00 ATOM 287 CB ALA 36 12.680 -13.165 6.757 1.00 0.00 ATOM 288 O ALA 36 10.757 -14.709 8.943 1.00 0.00 ATOM 289 C ALA 36 11.924 -14.716 8.559 1.00 0.00 ATOM 290 N VAL 37 12.613 -15.867 8.389 1.00 0.00 ATOM 291 CA VAL 37 12.002 -17.166 8.637 1.00 0.00 ATOM 292 CB VAL 37 12.892 -18.350 8.239 1.00 0.00 ATOM 293 CG1 VAL 37 13.089 -18.383 6.722 1.00 0.00 ATOM 294 CG2 VAL 37 14.245 -18.374 8.962 1.00 0.00 ATOM 295 O VAL 37 10.526 -17.847 10.408 1.00 0.00 ATOM 296 C VAL 37 11.591 -17.305 10.100 1.00 0.00 ATOM 297 N ASN 38 12.443 -16.807 11.007 1.00 0.00 ATOM 298 CA ASN 38 12.146 -16.877 12.429 1.00 0.00 ATOM 299 CB ASN 38 13.359 -16.302 13.144 1.00 0.00 ATOM 300 CG ASN 38 13.162 -16.500 14.632 1.00 0.00 ATOM 301 ND2 ASN 38 13.230 -17.716 15.114 1.00 0.00 ATOM 302 OD1 ASN 38 12.774 -15.584 15.336 1.00 0.00 ATOM 303 O ASN 38 10.019 -16.528 13.505 1.00 0.00 ATOM 304 C ASN 38 10.888 -16.065 12.733 1.00 0.00 ATOM 305 N PHE 39 10.756 -14.883 12.159 1.00 0.00 ATOM 306 CA PHE 39 9.556 -14.058 12.341 1.00 0.00 ATOM 307 CB PHE 39 9.778 -12.688 11.665 1.00 0.00 ATOM 308 CG PHE 39 8.555 -11.811 11.643 1.00 0.00 ATOM 309 CD1 PHE 39 8.131 -11.187 12.812 1.00 0.00 ATOM 310 CD2 PHE 39 7.825 -11.659 10.472 1.00 0.00 ATOM 311 CE1 PHE 39 6.967 -10.386 12.810 1.00 0.00 ATOM 312 CE2 PHE 39 6.683 -10.865 10.459 1.00 0.00 ATOM 313 CZ PHE 39 6.284 -10.218 11.612 1.00 0.00 ATOM 314 O PHE 39 7.293 -14.876 12.544 1.00 0.00 ATOM 315 C PHE 39 8.305 -14.795 11.843 1.00 0.00 ATOM 316 N LEU 40 8.437 -15.405 10.667 1.00 0.00 ATOM 317 CA LEU 40 7.331 -16.154 10.045 1.00 0.00 ATOM 318 CB LEU 40 7.724 -16.626 8.657 1.00 0.00 ATOM 319 CG LEU 40 8.029 -15.514 7.674 1.00 0.00 ATOM 320 CD1 LEU 40 8.390 -16.096 6.328 1.00 0.00 ATOM 321 CD2 LEU 40 6.755 -14.756 7.447 1.00 0.00 ATOM 322 O LEU 40 5.724 -17.565 11.128 1.00 0.00 ATOM 323 C LEU 40 6.910 -17.369 10.855 1.00 0.00 ATOM 324 N LYS 41 7.900 -18.125 11.305 1.00 0.00 ATOM 325 CA LYS 41 7.650 -19.318 12.098 1.00 0.00 ATOM 326 CB LYS 41 8.946 -20.108 12.238 1.00 0.00 ATOM 327 CG LYS 41 8.626 -21.341 13.050 1.00 0.00 ATOM 328 CD LYS 41 9.331 -22.477 12.388 1.00 0.00 ATOM 329 CE LYS 41 9.316 -23.538 13.425 1.00 0.00 ATOM 330 NZ LYS 41 10.489 -24.391 13.262 1.00 0.00 ATOM 331 O LYS 41 6.189 -19.699 13.960 1.00 0.00 ATOM 332 C LYS 41 7.066 -18.988 13.466 1.00 0.00 ATOM 333 N ARG 42 7.569 -17.873 14.110 1.00 0.00 ATOM 334 CA ARG 42 7.070 -17.480 15.420 1.00 0.00 ATOM 335 CB ARG 42 7.753 -16.138 15.696 1.00 0.00 ATOM 336 CG ARG 42 7.628 -15.696 17.160 1.00 0.00 ATOM 337 CD ARG 42 8.314 -14.346 17.365 1.00 0.00 ATOM 338 NE ARG 42 9.742 -14.338 17.010 1.00 0.00 ATOM 339 CZ ARG 42 10.480 -13.261 16.720 1.00 0.00 ATOM 340 NH1 ARG 42 10.023 -12.011 16.687 1.00 0.00 ATOM 341 NH2 ARG 42 11.766 -13.374 16.530 1.00 0.00 ATOM 342 O ARG 42 4.870 -17.427 16.369 1.00 0.00 ATOM 343 C ARG 42 5.569 -17.230 15.377 1.00 0.00 ATOM 344 N GLU 43 5.100 -16.829 14.199 1.00 0.00 ATOM 345 CA GLU 43 3.688 -16.519 14.020 1.00 0.00 ATOM 346 CB GLU 43 3.636 -14.929 13.671 1.00 0.00 ATOM 347 CG GLU 43 4.150 -13.978 14.744 1.00 0.00 ATOM 348 CD GLU 43 3.388 -12.666 14.750 1.00 0.00 ATOM 349 OE1 GLU 43 2.440 -12.524 15.563 1.00 0.00 ATOM 350 OE2 GLU 43 3.729 -11.781 13.932 1.00 0.00 ATOM 351 O GLU 43 1.686 -17.565 13.225 1.00 0.00 ATOM 352 C GLU 43 2.900 -17.674 13.411 1.00 0.00 ATOM 353 N GLY 44 3.576 -18.804 13.071 1.00 0.00 ATOM 354 CA GLY 44 2.893 -19.951 12.498 1.00 0.00 ATOM 355 O GLY 44 1.850 -20.744 10.500 1.00 0.00 ATOM 356 C GLY 44 2.621 -19.927 11.006 1.00 0.00 ATOM 357 N TYR 45 3.257 -19.002 10.308 1.00 0.00 ATOM 358 CA TYR 45 3.072 -18.872 8.863 1.00 0.00 ATOM 359 CB TYR 45 3.542 -17.465 8.512 1.00 0.00 ATOM 360 CG TYR 45 2.591 -16.370 8.960 1.00 0.00 ATOM 361 CD1 TYR 45 3.119 -15.484 9.866 1.00 0.00 ATOM 362 CD2 TYR 45 1.260 -16.273 8.556 1.00 0.00 ATOM 363 CE1 TYR 45 2.337 -14.488 10.409 1.00 0.00 ATOM 364 CE2 TYR 45 0.466 -15.267 9.090 1.00 0.00 ATOM 365 CZ TYR 45 1.005 -14.380 10.016 1.00 0.00 ATOM 366 OH TYR 45 0.309 -13.248 10.249 1.00 0.00 ATOM 367 O TYR 45 3.352 -20.614 7.192 1.00 0.00 ATOM 368 C TYR 45 3.862 -19.948 8.093 1.00 0.00 ATOM 369 N ILE 46 5.096 -20.157 8.519 1.00 0.00 ATOM 370 CA ILE 46 5.924 -21.231 7.952 1.00 0.00 ATOM 371 CB ILE 46 7.154 -20.728 7.176 1.00 0.00 ATOM 372 CG1 ILE 46 8.042 -19.901 8.111 1.00 0.00 ATOM 373 CG2 ILE 46 6.733 -19.978 5.910 1.00 0.00 ATOM 374 CD1 ILE 46 9.394 -19.477 7.581 1.00 0.00 ATOM 375 O ILE 46 6.614 -21.628 10.241 1.00 0.00 ATOM 376 C ILE 46 6.417 -22.093 9.112 1.00 0.00 ATOM 377 N ILE 47 6.899 -23.252 8.709 1.00 0.00 ATOM 378 CA ILE 47 7.563 -24.208 9.607 1.00 0.00 ATOM 379 CB ILE 47 6.786 -25.540 9.721 1.00 0.00 ATOM 380 CG1 ILE 47 6.591 -26.176 8.338 1.00 0.00 ATOM 381 CG2 ILE 47 5.445 -25.295 10.403 1.00 0.00 ATOM 382 CD1 ILE 47 5.989 -27.572 8.387 1.00 0.00 ATOM 383 O ILE 47 9.239 -24.228 7.864 1.00 0.00 ATOM 384 C ILE 47 8.957 -24.474 9.043 1.00 0.00 ATOM 385 N GLY 48 9.779 -25.018 9.914 1.00 0.00 ATOM 386 CA GLY 48 11.145 -25.371 9.503 1.00 0.00 ATOM 387 O GLY 48 11.394 -26.778 11.429 1.00 0.00 ATOM 388 C GLY 48 11.603 -26.631 10.207 1.00 0.00 ATOM 389 N VAL 49 12.275 -27.475 9.445 1.00 0.00 ATOM 390 CA VAL 49 12.777 -28.725 9.998 1.00 0.00 ATOM 391 CB VAL 49 11.646 -29.775 10.049 1.00 0.00 ATOM 392 CG1 VAL 49 10.958 -30.016 8.705 1.00 0.00 ATOM 393 CG2 VAL 49 12.099 -31.070 10.733 1.00 0.00 ATOM 394 O VAL 49 14.047 -29.312 8.071 1.00 0.00 ATOM 395 C VAL 49 14.030 -29.222 9.297 1.00 0.00 ATOM 396 N HIS 50 15.045 -29.636 10.116 1.00 0.00 ATOM 397 CA HIS 50 16.237 -30.261 9.585 1.00 0.00 ATOM 398 CB HIS 50 17.373 -30.264 10.604 1.00 0.00 ATOM 399 CG HIS 50 17.017 -30.541 12.057 1.00 0.00 ATOM 400 CD2 HIS 50 17.051 -31.717 12.678 1.00 0.00 ATOM 401 ND1 HIS 50 16.646 -29.614 12.930 1.00 0.00 ATOM 402 CE1 HIS 50 16.407 -30.215 14.090 1.00 0.00 ATOM 403 NE2 HIS 50 16.670 -31.515 13.938 1.00 0.00 ATOM 404 O HIS 50 16.008 -32.618 9.798 1.00 0.00 ATOM 405 C HIS 50 16.031 -31.656 9.042 1.00 0.00 ATOM 406 N TYR 51 15.985 -31.746 7.645 1.00 0.00 ATOM 407 CA TYR 51 15.892 -33.038 7.001 1.00 0.00 ATOM 408 CB TYR 51 15.317 -32.859 5.596 1.00 0.00 ATOM 409 CG TYR 51 14.964 -34.155 4.867 1.00 0.00 ATOM 410 CD1 TYR 51 14.220 -35.190 5.446 1.00 0.00 ATOM 411 CD2 TYR 51 15.406 -34.286 3.559 1.00 0.00 ATOM 412 CE1 TYR 51 13.956 -36.337 4.720 1.00 0.00 ATOM 413 CE2 TYR 51 15.154 -35.442 2.832 1.00 0.00 ATOM 414 CZ TYR 51 14.419 -36.466 3.412 1.00 0.00 ATOM 415 OH TYR 51 14.016 -37.512 2.639 1.00 0.00 ATOM 416 O TYR 51 18.157 -33.235 6.134 1.00 0.00 ATOM 417 C TYR 51 17.317 -33.597 6.951 1.00 0.00 ATOM 418 N SER 52 17.664 -34.341 7.964 1.00 0.00 ATOM 419 CA SER 52 18.982 -34.967 8.163 1.00 0.00 ATOM 420 CB SER 52 18.930 -35.860 9.402 1.00 0.00 ATOM 421 OG SER 52 18.044 -36.956 9.231 1.00 0.00 ATOM 422 O SER 52 20.655 -36.058 6.847 1.00 0.00 ATOM 423 C SER 52 19.456 -35.856 7.003 1.00 0.00 ATOM 424 N ASP 53 18.525 -36.393 6.202 1.00 0.00 ATOM 425 CA ASP 53 18.894 -37.190 5.021 1.00 0.00 ATOM 426 CB ASP 53 17.613 -37.729 4.363 1.00 0.00 ATOM 427 CG ASP 53 16.868 -38.761 5.233 1.00 0.00 ATOM 428 OD1 ASP 53 17.465 -39.222 6.241 1.00 0.00 ATOM 429 OD2 ASP 53 15.681 -39.005 4.963 1.00 0.00 ATOM 430 O ASP 53 20.456 -37.147 3.227 1.00 0.00 ATOM 431 C ASP 53 19.722 -36.479 3.961 1.00 0.00 ATOM 432 N ASP 54 19.591 -35.196 3.876 1.00 0.00 ATOM 433 CA ASP 54 20.369 -34.350 2.959 1.00 0.00 ATOM 434 CB ASP 54 19.576 -34.152 1.651 1.00 0.00 ATOM 435 CG ASP 54 18.257 -33.378 1.795 1.00 0.00 ATOM 436 OD1 ASP 54 18.093 -32.693 2.822 1.00 0.00 ATOM 437 OD2 ASP 54 17.485 -33.405 0.820 1.00 0.00 ATOM 438 O ASP 54 20.259 -32.731 4.773 1.00 0.00 ATOM 439 C ASP 54 20.596 -32.971 3.607 1.00 0.00 ATOM 440 N ARG 55 21.301 -32.115 2.883 1.00 0.00 ATOM 441 CA ARG 55 21.479 -30.715 3.282 1.00 0.00 ATOM 442 CB ARG 55 22.352 -29.987 2.235 1.00 0.00 ATOM 443 CG ARG 55 21.790 -29.981 0.826 1.00 0.00 ATOM 444 CD ARG 55 20.698 -28.937 0.659 1.00 0.00 ATOM 445 NE ARG 55 20.673 -28.412 -0.703 1.00 0.00 ATOM 446 CZ ARG 55 20.159 -29.044 -1.754 1.00 0.00 ATOM 447 NH1 ARG 55 19.606 -30.242 -1.615 1.00 0.00 ATOM 448 NH2 ARG 55 20.214 -28.477 -2.953 1.00 0.00 ATOM 449 O ARG 55 19.271 -30.445 2.917 1.00 0.00 ATOM 450 C ARG 55 20.146 -30.097 3.717 1.00 0.00 ATOM 451 N PRO 56 20.046 -29.931 5.106 1.00 0.00 ATOM 452 CA PRO 56 18.887 -30.343 5.892 1.00 0.00 ATOM 453 CB PRO 56 19.412 -30.353 7.314 1.00 0.00 ATOM 454 CG PRO 56 20.462 -29.242 7.362 1.00 0.00 ATOM 455 CD PRO 56 21.096 -29.364 5.978 1.00 0.00 ATOM 456 O PRO 56 16.552 -30.135 5.801 1.00 0.00 ATOM 457 C PRO 56 17.620 -29.523 5.805 1.00 0.00 ATOM 458 N HIS 57 17.770 -28.220 6.273 1.00 0.00 ATOM 459 CA HIS 57 16.634 -27.507 6.846 1.00 0.00 ATOM 460 CB HIS 57 17.127 -26.341 7.701 1.00 0.00 ATOM 461 CG HIS 57 16.001 -25.816 8.587 1.00 0.00 ATOM 462 CD2 HIS 57 15.274 -24.728 8.348 1.00 0.00 ATOM 463 ND1 HIS 57 15.629 -26.338 9.750 1.00 0.00 ATOM 464 CE1 HIS 57 14.724 -25.515 10.260 1.00 0.00 ATOM 465 NE2 HIS 57 14.466 -24.552 9.384 1.00 0.00 ATOM 466 O HIS 57 16.042 -26.644 4.685 1.00 0.00 ATOM 467 C HIS 57 15.640 -27.162 5.722 1.00 0.00 ATOM 468 N LEU 58 14.421 -27.569 5.931 1.00 0.00 ATOM 469 CA LEU 58 13.395 -27.319 4.924 1.00 0.00 ATOM 470 CB LEU 58 12.620 -28.575 4.511 1.00 0.00 ATOM 471 CG LEU 58 13.479 -29.724 3.991 1.00 0.00 ATOM 472 CD1 LEU 58 12.585 -30.874 3.655 1.00 0.00 ATOM 473 CD2 LEU 58 14.342 -29.361 2.831 1.00 0.00 ATOM 474 O LEU 58 12.149 -26.280 6.713 1.00 0.00 ATOM 475 C LEU 58 12.451 -26.279 5.519 1.00 0.00 ATOM 476 N TYR 59 12.088 -25.341 4.664 1.00 0.00 ATOM 477 CA TYR 59 11.105 -24.313 4.987 1.00 0.00 ATOM 478 CB TYR 59 11.600 -22.912 4.607 1.00 0.00 ATOM 479 CG TYR 59 12.759 -22.382 5.434 1.00 0.00 ATOM 480 CD1 TYR 59 12.540 -21.999 6.741 1.00 0.00 ATOM 481 CD2 TYR 59 13.998 -22.228 4.853 1.00 0.00 ATOM 482 CE1 TYR 59 13.571 -21.447 7.469 1.00 0.00 ATOM 483 CE2 TYR 59 15.033 -21.673 5.577 1.00 0.00 ATOM 484 CZ TYR 59 14.807 -21.291 6.870 1.00 0.00 ATOM 485 OH TYR 59 15.837 -20.743 7.606 1.00 0.00 ATOM 486 O TYR 59 9.830 -24.891 3.066 1.00 0.00 ATOM 487 C TYR 59 9.800 -24.646 4.266 1.00 0.00 ATOM 488 N LYS 60 8.710 -24.729 5.022 1.00 0.00 ATOM 489 CA LYS 60 7.390 -25.046 4.450 1.00 0.00 ATOM 490 CB LYS 60 6.925 -26.278 5.184 1.00 0.00 ATOM 491 CG LYS 60 7.444 -27.504 4.376 1.00 0.00 ATOM 492 CD LYS 60 6.819 -28.846 4.815 1.00 0.00 ATOM 493 CE LYS 60 7.483 -30.001 4.067 1.00 0.00 ATOM 494 NZ LYS 60 7.065 -31.338 4.619 1.00 0.00 ATOM 495 O LYS 60 6.114 -23.877 6.083 1.00 0.00 ATOM 496 C LYS 60 6.351 -24.016 4.888 1.00 0.00 ATOM 497 N LEU 61 5.622 -23.502 3.908 1.00 0.00 ATOM 498 CA LEU 61 4.482 -22.583 4.120 1.00 0.00 ATOM 499 CB LEU 61 3.917 -22.055 2.800 1.00 0.00 ATOM 500 CG LEU 61 3.321 -20.644 2.924 1.00 0.00 ATOM 501 CD1 LEU 61 4.443 -19.641 2.768 1.00 0.00 ATOM 502 CD2 LEU 61 2.401 -20.295 1.766 1.00 0.00 ATOM 503 O LEU 61 2.711 -24.226 4.020 1.00 0.00 ATOM 504 C LEU 61 3.268 -23.320 4.664 1.00 0.00 ATOM 505 N GLY 62 2.778 -22.899 5.812 1.00 0.00 ATOM 506 CA GLY 62 1.636 -23.498 6.431 1.00 0.00 ATOM 507 O GLY 62 0.424 -22.129 4.930 1.00 0.00 ATOM 508 C GLY 62 0.359 -23.050 5.741 1.00 0.00 ATOM 509 N PRO 63 -0.724 -23.884 5.820 1.00 0.00 ATOM 510 CA PRO 63 -2.001 -23.533 5.183 1.00 0.00 ATOM 511 CB PRO 63 -2.949 -24.562 5.689 1.00 0.00 ATOM 512 CG PRO 63 -2.097 -25.724 5.845 1.00 0.00 ATOM 513 CD PRO 63 -0.862 -25.212 6.516 1.00 0.00 ATOM 514 O PRO 63 -2.960 -21.432 4.804 1.00 0.00 ATOM 515 C PRO 63 -2.391 -22.142 5.606 1.00 0.00 ATOM 516 N GLU 64 -2.120 -21.720 6.868 1.00 0.00 ATOM 517 CA GLU 64 -2.496 -20.396 7.356 1.00 0.00 ATOM 518 CB GLU 64 -2.157 -20.275 8.825 1.00 0.00 ATOM 519 CG GLU 64 -3.103 -21.059 9.724 1.00 0.00 ATOM 520 CD GLU 64 -2.625 -21.076 11.168 1.00 0.00 ATOM 521 OE1 GLU 64 -1.492 -20.595 11.408 1.00 0.00 ATOM 522 OE2 GLU 64 -3.349 -21.691 11.982 1.00 0.00 ATOM 523 O GLU 64 -2.306 -18.360 6.068 1.00 0.00 ATOM 524 C GLU 64 -1.709 -19.338 6.566 1.00 0.00 ATOM 525 N LEU 65 -0.414 -19.607 6.323 1.00 0.00 ATOM 526 CA LEU 65 0.359 -18.660 5.515 1.00 0.00 ATOM 527 CB LEU 65 1.858 -18.910 5.610 1.00 0.00 ATOM 528 CG LEU 65 2.716 -17.805 4.964 1.00 0.00 ATOM 529 CD1 LEU 65 2.275 -16.392 5.332 1.00 0.00 ATOM 530 CD2 LEU 65 4.165 -17.902 5.438 1.00 0.00 ATOM 531 O LEU 65 -0.151 -17.590 3.412 1.00 0.00 ATOM 532 C LEU 65 -0.114 -18.654 4.050 1.00 0.00 ATOM 533 N THR 66 -0.525 -19.832 3.523 1.00 0.00 ATOM 534 CA THR 66 -1.047 -19.936 2.148 1.00 0.00 ATOM 535 CB THR 66 -1.344 -21.398 1.811 1.00 0.00 ATOM 536 CG2 THR 66 -1.908 -21.587 0.397 1.00 0.00 ATOM 537 OG1 THR 66 -0.157 -22.181 1.897 1.00 0.00 ATOM 538 O THR 66 -2.501 -18.443 1.008 1.00 0.00 ATOM 539 C THR 66 -2.306 -19.083 2.024 1.00 0.00 ATOM 540 N GLU 67 -3.153 -19.108 3.029 1.00 0.00 ATOM 541 CA GLU 67 -4.380 -18.278 3.011 1.00 0.00 ATOM 542 CB GLU 67 -5.305 -18.611 4.203 1.00 0.00 ATOM 543 CG GLU 67 -6.070 -19.919 3.999 1.00 0.00 ATOM 544 CD GLU 67 -7.205 -20.150 4.989 1.00 0.00 ATOM 545 OE1 GLU 67 -7.901 -19.190 5.410 1.00 0.00 ATOM 546 OE2 GLU 67 -7.403 -21.330 5.334 1.00 0.00 ATOM 547 O GLU 67 -4.699 -16.037 2.215 1.00 0.00 ATOM 548 C GLU 67 -4.056 -16.789 2.954 1.00 0.00 ATOM 549 N LYS 68 -3.070 -16.339 3.741 1.00 0.00 ATOM 550 CA LYS 68 -2.684 -14.932 3.730 1.00 0.00 ATOM 551 CB LYS 68 -1.708 -14.731 4.930 1.00 0.00 ATOM 552 CG LYS 68 -1.056 -13.349 5.040 1.00 0.00 ATOM 553 CD LYS 68 -2.044 -12.283 5.489 1.00 0.00 ATOM 554 CE LYS 68 -1.349 -11.186 6.311 1.00 0.00 ATOM 555 NZ LYS 68 -0.282 -10.450 5.566 1.00 0.00 ATOM 556 O LYS 68 -2.526 -13.469 1.848 1.00 0.00 ATOM 557 C LYS 68 -2.181 -14.529 2.344 1.00 0.00 ATOM 558 N GLY 69 -1.376 -15.397 1.715 1.00 0.00 ATOM 559 CA GLY 69 -0.887 -15.113 0.369 1.00 0.00 ATOM 560 O GLY 69 -1.918 -14.212 -1.596 1.00 0.00 ATOM 561 C GLY 69 -2.003 -15.009 -0.656 1.00 0.00 ATOM 562 N GLU 70 -3.045 -15.830 -0.487 1.00 0.00 ATOM 563 CA GLU 70 -4.173 -15.817 -1.412 1.00 0.00 ATOM 564 CB GLU 70 -5.168 -16.934 -1.067 1.00 0.00 ATOM 565 CG GLU 70 -4.582 -18.334 -1.150 1.00 0.00 ATOM 566 CD GLU 70 -5.598 -19.418 -0.837 1.00 0.00 ATOM 567 OE1 GLU 70 -6.512 -19.171 -0.025 1.00 0.00 ATOM 568 OE2 GLU 70 -5.460 -20.530 -1.389 1.00 0.00 ATOM 569 O GLU 70 -5.156 -13.841 -2.347 1.00 0.00 ATOM 570 C GLU 70 -4.857 -14.456 -1.328 1.00 0.00 ATOM 571 N ASN 71 -5.112 -14.000 -0.119 1.00 0.00 ATOM 572 CA ASN 71 -5.750 -12.707 0.086 1.00 0.00 ATOM 573 CB ASN 71 -5.999 -12.438 1.551 1.00 0.00 ATOM 574 CG ASN 71 -7.106 -13.295 2.111 1.00 0.00 ATOM 575 ND2 ASN 71 -7.136 -13.420 3.428 1.00 0.00 ATOM 576 OD1 ASN 71 -7.904 -13.853 1.379 1.00 0.00 ATOM 577 O ASN 71 -5.413 -10.675 -1.146 1.00 0.00 ATOM 578 C ASN 71 -4.895 -11.583 -0.488 1.00 0.00 ATOM 579 N TYR 72 -3.575 -11.690 -0.311 1.00 0.00 ATOM 580 CA TYR 72 -2.673 -10.667 -0.817 1.00 0.00 ATOM 581 CB TYR 72 -1.269 -10.971 -0.359 1.00 0.00 ATOM 582 CG TYR 72 -0.185 -9.922 -0.529 1.00 0.00 ATOM 583 CD1 TYR 72 -0.036 -8.872 0.364 1.00 0.00 ATOM 584 CD2 TYR 72 0.699 -9.983 -1.572 1.00 0.00 ATOM 585 CE1 TYR 72 0.945 -7.891 0.219 1.00 0.00 ATOM 586 CE2 TYR 72 1.709 -9.048 -1.722 1.00 0.00 ATOM 587 CZ TYR 72 1.833 -7.988 -0.813 1.00 0.00 ATOM 588 OH TYR 72 2.879 -7.116 -0.963 1.00 0.00 ATOM 589 O TYR 72 -2.673 -9.559 -2.954 1.00 0.00 ATOM 590 C TYR 72 -2.681 -10.632 -2.342 1.00 0.00 ATOM 591 N LEU 73 -2.702 -11.816 -2.962 1.00 0.00 ATOM 592 CA LEU 73 -2.710 -11.880 -4.414 1.00 0.00 ATOM 593 CB LEU 73 -2.600 -13.319 -4.906 1.00 0.00 ATOM 594 CG LEU 73 -1.401 -14.091 -4.340 1.00 0.00 ATOM 595 CD1 LEU 73 -1.306 -15.452 -5.019 1.00 0.00 ATOM 596 CD2 LEU 73 -0.114 -13.308 -4.548 1.00 0.00 ATOM 597 O LEU 73 -3.965 -10.559 -5.977 1.00 0.00 ATOM 598 C LEU 73 -3.989 -11.256 -4.961 1.00 0.00 ATOM 599 N LYS 74 -5.115 -11.520 -4.286 1.00 0.00 ATOM 600 CA LYS 74 -6.396 -10.978 -4.716 1.00 0.00 ATOM 601 CB LYS 74 -7.559 -11.476 -3.866 1.00 0.00 ATOM 602 CG LYS 74 -7.874 -12.926 -4.230 1.00 0.00 ATOM 603 CD LYS 74 -8.954 -13.443 -3.263 1.00 0.00 ATOM 604 CE LYS 74 -9.156 -14.940 -3.489 1.00 0.00 ATOM 605 NZ LYS 74 -10.316 -15.433 -2.671 1.00 0.00 ATOM 606 O LYS 74 -6.864 -8.776 -5.552 1.00 0.00 ATOM 607 C LYS 74 -6.377 -9.453 -4.643 1.00 0.00 ATOM 608 N GLU 75 -5.793 -8.922 -3.576 1.00 0.00 ATOM 609 CA GLU 75 -5.707 -7.475 -3.398 1.00 0.00 ATOM 610 CB GLU 75 -5.121 -7.164 -2.022 1.00 0.00 ATOM 611 CG GLU 75 -6.156 -7.418 -0.932 1.00 0.00 ATOM 612 CD GLU 75 -5.636 -7.144 0.464 1.00 0.00 ATOM 613 OE1 GLU 75 -4.456 -6.773 0.610 1.00 0.00 ATOM 614 OE2 GLU 75 -6.434 -7.334 1.407 1.00 0.00 ATOM 615 O GLU 75 -5.225 -5.838 -5.071 1.00 0.00 ATOM 616 C GLU 75 -4.855 -6.861 -4.500 1.00 0.00 ATOM 617 N ASN 76 -3.731 -7.495 -4.824 1.00 0.00 ATOM 618 CA ASN 76 -2.862 -6.972 -5.871 1.00 0.00 ATOM 619 CB ASN 76 -1.579 -7.765 -5.992 1.00 0.00 ATOM 620 CG ASN 76 -0.573 -7.405 -4.900 1.00 0.00 ATOM 621 ND2 ASN 76 0.401 -8.285 -4.670 1.00 0.00 ATOM 622 OD1 ASN 76 -0.665 -6.337 -4.286 1.00 0.00 ATOM 623 O ASN 76 -3.564 -6.030 -7.939 1.00 0.00 ATOM 624 C ASN 76 -3.604 -7.003 -7.201 1.00 0.00 ATOM 625 N GLY 77 -4.279 -8.089 -7.517 1.00 0.00 ATOM 626 CA GLY 77 -5.019 -8.152 -8.777 1.00 0.00 ATOM 627 O GLY 77 -6.383 -6.546 -9.891 1.00 0.00 ATOM 628 C GLY 77 -6.108 -7.095 -8.827 1.00 0.00 ATOM 629 N THR 78 -6.724 -6.813 -7.640 1.00 0.00 ATOM 630 CA THR 78 -7.806 -5.810 -7.649 1.00 0.00 ATOM 631 CB THR 78 -8.471 -5.773 -6.239 1.00 0.00 ATOM 632 CG2 THR 78 -9.517 -4.683 -6.202 1.00 0.00 ATOM 633 OG1 THR 78 -9.079 -7.035 -5.969 1.00 0.00 ATOM 634 O THR 78 -7.986 -3.679 -8.720 1.00 0.00 ATOM 635 C THR 78 -7.309 -4.417 -7.993 1.00 0.00 ATOM 636 N TRP 79 -6.151 -4.019 -7.456 1.00 0.00 ATOM 637 CA TRP 79 -5.607 -2.694 -7.729 1.00 0.00 ATOM 638 CB TRP 79 -4.263 -2.537 -7.010 1.00 0.00 ATOM 639 CG TRP 79 -3.730 -1.150 -7.084 1.00 0.00 ATOM 640 CD1 TRP 79 -3.999 -0.131 -6.229 1.00 0.00 ATOM 641 CD2 TRP 79 -2.882 -0.618 -8.099 1.00 0.00 ATOM 642 CE2 TRP 79 -2.659 0.737 -7.792 1.00 0.00 ATOM 643 CE3 TRP 79 -2.294 -1.148 -9.250 1.00 0.00 ATOM 644 NE1 TRP 79 -3.338 1.003 -6.630 1.00 0.00 ATOM 645 CZ2 TRP 79 -1.859 1.570 -8.588 1.00 0.00 ATOM 646 CZ3 TRP 79 -1.496 -0.326 -10.042 1.00 0.00 ATOM 647 CH2 TRP 79 -1.284 1.031 -9.701 1.00 0.00 ATOM 648 O TRP 79 -5.631 -1.513 -9.864 1.00 0.00 ATOM 649 C TRP 79 -5.343 -2.557 -9.249 1.00 0.00 ATOM 650 N SER 80 -4.838 -3.638 -9.853 1.00 0.00 ATOM 651 CA SER 80 -4.579 -3.674 -11.298 1.00 0.00 ATOM 652 CB SER 80 -3.888 -4.917 -11.737 1.00 0.00 ATOM 653 OG SER 80 -2.582 -5.004 -11.236 1.00 0.00 ATOM 654 O SER 80 -5.900 -2.764 -13.074 1.00 0.00 ATOM 655 C SER 80 -5.864 -3.508 -12.095 1.00 0.00 ATOM 656 N LYS 81 -6.933 -4.225 -11.699 1.00 0.00 ATOM 657 CA LYS 81 -8.212 -4.122 -12.387 1.00 0.00 ATOM 658 CB LYS 81 -9.252 -5.024 -11.790 1.00 0.00 ATOM 659 CG LYS 81 -8.939 -6.479 -12.092 1.00 0.00 ATOM 660 CD LYS 81 -9.835 -7.432 -11.346 1.00 0.00 ATOM 661 CE LYS 81 -9.407 -8.863 -11.647 1.00 0.00 ATOM 662 NZ LYS 81 -10.209 -9.843 -10.905 1.00 0.00 ATOM 663 O LYS 81 -9.261 -2.104 -13.291 1.00 0.00 ATOM 664 C LYS 81 -8.763 -2.671 -12.299 1.00 0.00 ATOM 665 N ALA 82 -8.608 -2.066 -11.116 1.00 0.00 ATOM 666 CA ALA 82 -9.099 -0.705 -10.908 1.00 0.00 ATOM 667 CB ALA 82 -8.919 -0.342 -9.442 1.00 0.00 ATOM 668 O ALA 82 -8.916 1.182 -12.376 1.00 0.00 ATOM 669 C ALA 82 -8.327 0.262 -11.792 1.00 0.00 ATOM 670 N TYR 83 -7.018 0.061 -11.894 1.00 0.00 ATOM 671 CA TYR 83 -6.180 0.928 -12.717 1.00 0.00 ATOM 672 CB TYR 83 -4.729 0.504 -12.504 1.00 0.00 ATOM 673 CG TYR 83 -3.760 1.420 -13.225 1.00 0.00 ATOM 674 CD1 TYR 83 -3.379 2.606 -12.623 1.00 0.00 ATOM 675 CD2 TYR 83 -3.254 1.095 -14.474 1.00 0.00 ATOM 676 CE1 TYR 83 -2.494 3.470 -13.253 1.00 0.00 ATOM 677 CE2 TYR 83 -2.368 1.948 -15.115 1.00 0.00 ATOM 678 CZ TYR 83 -2.003 3.125 -14.494 1.00 0.00 ATOM 679 OH TYR 83 -1.127 3.978 -15.132 1.00 0.00 ATOM 680 O TYR 83 -6.678 1.845 -14.880 1.00 0.00 ATOM 681 C TYR 83 -6.591 0.834 -14.186 1.00 0.00 ATOM 682 N LYS 84 -6.803 -0.405 -14.680 1.00 0.00 ATOM 683 CA LYS 84 -7.197 -0.634 -16.064 1.00 0.00 ATOM 684 CB LYS 84 -7.342 -2.133 -16.358 1.00 0.00 ATOM 685 CG LYS 84 -7.757 -2.506 -17.770 1.00 0.00 ATOM 686 CD LYS 84 -8.051 -3.986 -17.955 1.00 0.00 ATOM 687 CE LYS 84 -8.543 -4.308 -19.356 1.00 0.00 ATOM 688 NZ LYS 84 -8.760 -5.760 -19.607 1.00 0.00 ATOM 689 O LYS 84 -8.703 0.686 -17.409 1.00 0.00 ATOM 690 C LYS 84 -8.520 0.042 -16.366 1.00 0.00 ATOM 691 N THR 85 -9.472 -0.063 -15.433 1.00 0.00 ATOM 692 CA THR 85 -10.779 0.529 -15.605 1.00 0.00 ATOM 693 CB THR 85 -11.843 0.038 -14.644 1.00 0.00 ATOM 694 CG2 THR 85 -12.082 -1.447 -14.832 1.00 0.00 ATOM 695 OG1 THR 85 -11.417 0.273 -13.300 1.00 0.00 ATOM 696 O THR 85 -11.347 2.724 -16.370 1.00 0.00 ATOM 697 C THR 85 -10.707 2.057 -15.559 1.00 0.00 ATOM 698 N ILE 86 -9.901 2.619 -14.661 1.00 0.00 ATOM 699 CA ILE 86 -9.718 4.085 -14.653 1.00 0.00 ATOM 700 CB ILE 86 -8.832 4.441 -13.428 1.00 0.00 ATOM 701 CG1 ILE 86 -9.651 4.204 -12.150 1.00 0.00 ATOM 702 CG2 ILE 86 -8.339 5.883 -13.523 1.00 0.00 ATOM 703 CD1 ILE 86 -8.804 4.324 -10.871 1.00 0.00 ATOM 704 O ILE 86 -9.465 5.523 -16.556 1.00 0.00 ATOM 705 C ILE 86 -9.076 4.514 -15.972 1.00 0.00 ATOM 706 N LYS 87 -8.097 3.743 -16.442 1.00 0.00 ATOM 707 CA LYS 87 -7.425 4.056 -17.702 1.00 0.00 ATOM 708 CB LYS 87 -6.346 3.024 -17.982 1.00 0.00 ATOM 709 CG LYS 87 -5.641 3.193 -19.306 1.00 0.00 ATOM 710 CD LYS 87 -4.568 2.135 -19.462 1.00 0.00 ATOM 711 CE LYS 87 -3.789 2.297 -20.744 1.00 0.00 ATOM 712 NZ LYS 87 -2.692 1.290 -20.816 1.00 0.00 ATOM 713 O LYS 87 -8.471 5.014 -19.653 1.00 0.00 ATOM 714 C LYS 87 -8.460 4.089 -18.848 1.00 0.00 ATOM 715 N GLU 88 -9.336 3.082 -18.905 1.00 0.00 ATOM 716 CA GLU 88 -10.359 3.011 -19.967 1.00 0.00 ATOM 717 CB GLU 88 -11.245 1.850 -19.807 1.00 0.00 ATOM 718 CG GLU 88 -12.271 1.688 -20.908 1.00 0.00 ATOM 719 CD GLU 88 -13.220 0.543 -20.626 1.00 0.00 ATOM 720 OE1 GLU 88 -13.258 0.074 -19.463 1.00 0.00 ATOM 721 OE2 GLU 88 -13.924 0.111 -21.565 1.00 0.00 ATOM 722 O GLU 88 -11.697 4.780 -20.873 1.00 0.00 ATOM 723 C GLU 88 -11.313 4.191 -19.864 1.00 0.00 ATOM 724 N ILE 89 -11.705 4.534 -18.624 1.00 0.00 ATOM 725 CA ILE 89 -12.606 5.654 -18.382 1.00 0.00 ATOM 726 CB ILE 89 -12.860 5.797 -16.863 1.00 0.00 ATOM 727 CG1 ILE 89 -13.804 4.671 -16.421 1.00 0.00 ATOM 728 CG2 ILE 89 -13.422 7.180 -16.522 1.00 0.00 ATOM 729 CD1 ILE 89 -13.919 4.525 -14.879 1.00 0.00 ATOM 730 O ILE 89 -12.682 7.676 -19.681 1.00 0.00 ATOM 731 C ILE 89 -12.003 6.934 -18.957 1.00 0.00 ATOM 732 N LYS 90 -10.718 7.166 -18.688 1.00 0.00 ATOM 733 CA LYS 90 -10.053 8.362 -19.189 1.00 0.00 ATOM 734 CB LYS 90 -8.640 8.475 -18.643 1.00 0.00 ATOM 735 CG LYS 90 -8.588 8.774 -17.154 1.00 0.00 ATOM 736 CD LYS 90 -7.155 8.852 -16.656 1.00 0.00 ATOM 737 CE LYS 90 -7.109 9.160 -15.167 1.00 0.00 ATOM 738 NZ LYS 90 -5.711 9.227 -14.653 1.00 0.00 ATOM 739 O LYS 90 -10.167 9.380 -21.360 1.00 0.00 ATOM 740 C LYS 90 -9.927 8.357 -20.704 1.00 0.00 ATOM 741 N ASP 91 -9.521 7.233 -21.252 1.00 0.00 ATOM 742 CA ASP 91 -9.361 7.121 -22.725 1.00 0.00 ATOM 743 CB ASP 91 -8.833 5.756 -23.128 1.00 0.00 ATOM 744 CG ASP 91 -7.345 5.646 -23.360 1.00 0.00 ATOM 745 OD1 ASP 91 -6.750 6.642 -23.820 1.00 0.00 ATOM 746 OD2 ASP 91 -6.808 4.552 -23.098 1.00 0.00 ATOM 747 O ASP 91 -10.748 8.102 -24.412 1.00 0.00 ATOM 748 C ASP 91 -10.712 7.382 -23.393 1.00 0.00 ATOM 749 N TRP 92 -11.788 6.881 -22.858 1.00 0.00 ATOM 750 CA TRP 92 -13.130 7.126 -23.418 1.00 0.00 ATOM 751 CB TRP 92 -14.125 6.149 -22.760 1.00 0.00 ATOM 752 CG TRP 92 -15.531 6.469 -23.066 1.00 0.00 ATOM 753 CD1 TRP 92 -16.231 6.124 -24.183 1.00 0.00 ATOM 754 CD2 TRP 92 -16.440 7.207 -22.234 1.00 0.00 ATOM 755 CE2 TRP 92 -17.679 7.269 -22.915 1.00 0.00 ATOM 756 CE3 TRP 92 -16.382 7.818 -20.984 1.00 0.00 ATOM 757 NE1 TRP 92 -17.524 6.598 -24.116 1.00 0.00 ATOM 758 CZ2 TRP 92 -18.809 7.906 -22.408 1.00 0.00 ATOM 759 CZ3 TRP 92 -17.490 8.453 -20.471 1.00 0.00 ATOM 760 CH2 TRP 92 -18.684 8.492 -21.183 1.00 0.00 ATOM 761 O TRP 92 -14.207 9.151 -24.118 1.00 0.00 ATOM 762 C TRP 92 -13.557 8.567 -23.221 1.00 0.00 ATOM 763 N ILE 93 -13.305 9.187 -22.070 1.00 0.00 ATOM 764 CA ILE 93 -13.695 10.567 -21.864 1.00 0.00 ATOM 765 CB ILE 93 -13.399 11.052 -20.427 1.00 0.00 ATOM 766 CG1 ILE 93 -14.175 10.235 -19.375 1.00 0.00 ATOM 767 CG2 ILE 93 -13.714 12.531 -20.289 1.00 0.00 ATOM 768 CD1 ILE 93 -13.798 10.576 -17.934 1.00 0.00 ATOM 769 O ILE 93 -13.661 12.311 -23.522 1.00 0.00 ATOM 770 C ILE 93 -13.032 11.457 -22.900 1.00 0.00 ATOM 771 N LYS 94 -11.726 11.230 -23.114 1.00 0.00 ATOM 772 CA LYS 94 -10.986 12.026 -24.089 1.00 0.00 ATOM 773 CB LYS 94 -9.485 11.625 -24.037 1.00 0.00 ATOM 774 CG LYS 94 -8.668 12.363 -25.113 1.00 0.00 ATOM 775 CD LYS 94 -7.182 12.160 -24.951 1.00 0.00 ATOM 776 CE LYS 94 -6.390 12.774 -26.078 1.00 0.00 ATOM 777 NZ LYS 94 -4.923 12.651 -25.814 1.00 0.00 ATOM 778 O LYS 94 -11.659 12.781 -26.289 1.00 0.00 ATOM 779 C LYS 94 -11.535 11.817 -25.511 1.00 0.00 ATOM 780 N LEU 95 -11.795 10.585 -25.873 1.00 0.00 ATOM 781 CA LEU 95 -12.361 10.289 -27.204 1.00 0.00 ATOM 782 CB LEU 95 -12.524 8.776 -27.316 1.00 0.00 ATOM 783 CG LEU 95 -13.073 8.337 -28.688 1.00 0.00 ATOM 784 CD1 LEU 95 -12.133 8.847 -29.841 1.00 0.00 ATOM 785 CD2 LEU 95 -13.066 6.782 -28.721 1.00 0.00 ATOM 786 O LEU 95 -14.016 11.561 -28.361 1.00 0.00 ATOM 787 C LEU 95 -13.697 11.021 -27.323 1.00 0.00 ATOM 788 N GLU 96 -14.517 11.056 -26.237 1.00 0.00 ATOM 789 CA GLU 96 -15.797 11.742 -26.319 1.00 0.00 ATOM 790 CB GLU 96 -16.675 11.412 -25.097 1.00 0.00 ATOM 791 CG GLU 96 -18.072 12.086 -25.248 1.00 0.00 ATOM 792 CD GLU 96 -18.850 11.967 -23.946 1.00 0.00 ATOM 793 OE1 GLU 96 -18.371 11.313 -22.986 1.00 0.00 ATOM 794 OE2 GLU 96 -19.932 12.611 -23.861 1.00 0.00 ATOM 795 O GLU 96 -16.331 13.838 -27.358 1.00 0.00 ATOM 796 C GLU 96 -15.599 13.229 -26.577 1.00 0.00 ATOM 797 N HIS 97 -14.601 13.810 -25.924 1.00 0.00 ATOM 798 CA HIS 97 -14.294 15.224 -26.087 1.00 0.00 ATOM 799 CB HIS 97 -13.288 15.677 -25.064 1.00 0.00 ATOM 800 CG HIS 97 -13.936 15.948 -23.748 1.00 0.00 ATOM 801 CD2 HIS 97 -14.181 15.140 -22.688 1.00 0.00 ATOM 802 ND1 HIS 97 -14.550 17.151 -23.465 1.00 0.00 ATOM 803 CE1 HIS 97 -15.099 17.085 -22.263 1.00 0.00 ATOM 804 NE2 HIS 97 -14.890 15.876 -21.773 1.00 0.00 ATOM 805 O HIS 97 -14.112 16.606 -28.038 1.00 0.00 ATOM 806 C HIS 97 -13.839 15.528 -27.508 1.00 0.00 ATOM 807 N HIS 98 -13.147 14.576 -28.127 1.00 0.00 ATOM 808 CA HIS 98 -12.682 14.779 -29.488 1.00 0.00 ATOM 809 CB HIS 98 -11.866 13.609 -29.943 1.00 0.00 ATOM 810 CG HIS 98 -11.454 13.677 -31.377 1.00 0.00 ATOM 811 CD2 HIS 98 -11.937 13.050 -32.475 1.00 0.00 ATOM 812 ND1 HIS 98 -10.407 14.462 -31.813 1.00 0.00 ATOM 813 CE1 HIS 98 -10.268 14.321 -33.119 1.00 0.00 ATOM 814 NE2 HIS 98 -11.186 13.471 -33.546 1.00 0.00 ATOM 815 O HIS 98 -13.813 15.756 -31.370 1.00 0.00 ATOM 816 C HIS 98 -13.861 14.933 -30.458 1.00 0.00 ATOM 817 N HIS 99 -14.899 14.121 -30.287 1.00 0.00 ATOM 818 CA HIS 99 -16.059 14.222 -31.164 1.00 0.00 ATOM 819 CB HIS 99 -17.075 13.155 -30.874 1.00 0.00 ATOM 820 CG HIS 99 -18.275 13.214 -31.763 1.00 0.00 ATOM 821 CD2 HIS 99 -19.569 13.500 -31.494 1.00 0.00 ATOM 822 ND1 HIS 99 -18.205 12.978 -33.119 1.00 0.00 ATOM 823 CE1 HIS 99 -19.411 13.098 -33.644 1.00 0.00 ATOM 824 NE2 HIS 99 -20.256 13.420 -32.680 1.00 0.00 ATOM 825 O HIS 99 -17.078 16.240 -32.054 1.00 0.00 ATOM 826 C HIS 99 -16.704 15.621 -31.043 1.00 0.00 ATOM 827 N HIS 100 -16.817 16.112 -29.805 1.00 0.00 ATOM 828 CA HIS 100 -17.389 17.432 -29.563 1.00 0.00 ATOM 829 CB HIS 100 -17.620 17.703 -28.109 1.00 0.00 ATOM 830 CG HIS 100 -18.751 16.916 -27.527 1.00 0.00 ATOM 831 CD2 HIS 100 -18.775 15.968 -26.560 1.00 0.00 ATOM 832 ND1 HIS 100 -20.051 17.050 -27.963 1.00 0.00 ATOM 833 CE1 HIS 100 -20.828 16.218 -27.292 1.00 0.00 ATOM 834 NE2 HIS 100 -20.078 15.551 -26.433 1.00 0.00 ATOM 835 O HIS 100 -16.989 19.466 -30.826 1.00 0.00 ATOM 836 C HIS 100 -16.494 18.539 -30.165 1.00 0.00 ATOM 837 N HIS 101 -15.196 18.386 -29.978 1.00 0.00 ATOM 838 CA HIS 101 -14.248 19.352 -30.521 1.00 0.00 ATOM 839 CB HIS 101 -12.820 19.054 -30.010 1.00 0.00 ATOM 840 CG HIS 101 -11.760 19.842 -30.722 1.00 0.00 ATOM 841 CD2 HIS 101 -11.015 19.635 -31.834 1.00 0.00 ATOM 842 ND1 HIS 101 -11.343 21.071 -30.259 1.00 0.00 ATOM 843 CE1 HIS 101 -10.414 21.575 -31.043 1.00 0.00 ATOM 844 NE2 HIS 101 -10.192 20.717 -32.020 1.00 0.00 ATOM 845 O HIS 101 -14.297 20.394 -32.692 1.00 0.00 ATOM 846 C HIS 101 -14.321 19.346 -32.050 1.00 0.00 ATOM 847 N HIS 102 -14.341 18.155 -32.634 1.00 0.00 ATOM 848 CA HIS 102 -14.432 18.027 -34.076 1.00 0.00 ATOM 849 CB HIS 102 -14.387 16.545 -34.417 1.00 0.00 ATOM 850 CG HIS 102 -14.462 16.246 -35.888 1.00 0.00 ATOM 851 CD2 HIS 102 -15.484 15.782 -36.646 1.00 0.00 ATOM 852 ND1 HIS 102 -13.369 16.368 -36.736 1.00 0.00 ATOM 853 CE1 HIS 102 -13.736 15.997 -37.950 1.00 0.00 ATOM 854 NE2 HIS 102 -15.015 15.633 -37.947 1.00 0.00 ATOM 855 O HIS 102 -15.650 19.509 -35.528 1.00 0.00 ATOM 856 C HIS 102 -15.695 18.740 -34.567 1.00 0.00 TER END