PFRMAT TS TARGET T0331 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 characteristics of hydrogen METHOD bonds from the carbonyl oxygen METHOD N_NOTOR2 an alphabet for predicting characteristics 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 A new trick this year is to optimize models with gromacs to knock them METHOD out of a local minimum. The gromacs optimization does terrible things METHOD to the model (messing up sidechains and peptide planes), but is good METHOD at removing clashes. The resulting models are only a small distance METHOD from the pre-optimization models, but score much worse with the METHOD undertaker cost functions, so undertaker can move them more freely METHOD than models it has optimized itself. METHOD METHOD For T0331, our biggest decision was not between templates, but between METHOD alignments. Did we leave out a strand or a helix? The t2k multiple METHOD alignment appears to have some misalignment at the C-terminus (key METHOD residues in alignment doesn't match with target sequence), so we METHOD preferred the t06 multiple alignment. METHOD METHOD We also did some optimization in a dimeric context (based on dimer METHOD 2fhq[AB]). METHOD METHOD Model 1 is try7-opt2-monomer, our best-scoring model, optimized METHOD as a dimer. METHOD METHOD Model 2 is try9-opt2-monomer, a model from the alternative alignment, METHOD which keeps the helix but discards the C-terminal strands. METHOD It was also optimized as a monomer, and rosetta METHOD prefers repacking the sidechains on it (probably METHOD because the less-packed model allows more freedom for METHOD the sidechains). METHOD METHOD Model 3 is try8-opt2-monomer, which is very similar to Model 1. METHOD It was also optimized as a dimer. METHOD METHOD Model 4 is sidechain replacement by SCWRL for a t2k alignment to 1g79A. METHOD METHOD Model 5 is sidechain replacement by SCWRL for a t06 alignment to 2fhqA. METHOD REMARK 6 REMARK 6 T0331 model 4 Tue Jul 4 18:43:25 2006 MODEL 4 PARENT 1g79_A ATOM 1 N MET 1 15.035 1.223 -11.334 1.00 0.00 ATOM 2 CA MET 1 13.734 0.551 -11.421 1.00 0.00 ATOM 3 CB MET 1 13.367 -0.084 -10.078 1.00 0.00 ATOM 4 CG MET 1 14.226 -1.281 -9.704 1.00 0.00 ATOM 5 SD MET 1 13.830 -1.938 -8.072 1.00 0.00 ATOM 6 CE MET 1 12.202 -2.623 -8.369 1.00 0.00 ATOM 7 O MET 1 11.649 1.146 -12.504 1.00 0.00 ATOM 8 C MET 1 12.596 1.515 -11.797 1.00 0.00 ATOM 9 N GLU 2 12.682 2.744 -11.309 1.00 0.00 ATOM 10 CA GLU 2 11.652 3.736 -11.598 1.00 0.00 ATOM 11 CB GLU 2 11.873 4.997 -10.760 1.00 0.00 ATOM 12 CG GLU 2 11.603 4.812 -9.276 1.00 0.00 ATOM 13 CD GLU 2 11.949 6.044 -8.463 1.00 0.00 ATOM 14 OE1 GLU 2 12.468 7.016 -9.049 1.00 0.00 ATOM 15 OE2 GLU 2 11.701 6.036 -7.238 1.00 0.00 ATOM 16 O GLU 2 10.722 4.157 -13.785 1.00 0.00 ATOM 17 C GLU 2 11.732 4.082 -13.077 1.00 0.00 ATOM 18 N LEU 3 12.956 4.283 -13.536 1.00 0.00 ATOM 19 CA LEU 3 13.190 4.606 -14.926 1.00 0.00 ATOM 20 CB LEU 3 14.691 4.704 -15.208 1.00 0.00 ATOM 21 CG LEU 3 15.090 5.025 -16.650 1.00 0.00 ATOM 22 CD1 LEU 3 14.550 6.384 -17.066 1.00 0.00 ATOM 23 CD2 LEU 3 16.604 5.050 -16.795 1.00 0.00 ATOM 24 O LEU 3 11.892 3.826 -16.795 1.00 0.00 ATOM 25 C LEU 3 12.596 3.525 -15.829 1.00 0.00 ATOM 26 N LYS 4 12.864 2.263 -15.512 1.00 0.00 ATOM 27 CA LYS 4 12.341 1.165 -16.320 1.00 0.00 ATOM 28 CB LYS 4 12.911 -0.172 -15.841 1.00 0.00 ATOM 29 CG LYS 4 14.389 -0.358 -16.137 1.00 0.00 ATOM 30 CD LYS 4 14.889 -1.701 -15.631 1.00 0.00 ATOM 31 CE LYS 4 16.369 -1.888 -15.928 1.00 0.00 ATOM 32 NZ LYS 4 16.879 -3.188 -15.411 1.00 0.00 ATOM 33 O LYS 4 10.165 0.663 -17.200 1.00 0.00 ATOM 34 C LYS 4 10.813 1.074 -16.242 1.00 0.00 ATOM 35 N ASP 5 10.241 1.454 -15.104 1.00 0.00 ATOM 36 CA ASP 5 8.793 1.431 -14.945 1.00 0.00 ATOM 37 CB ASP 5 8.405 1.786 -13.509 1.00 0.00 ATOM 38 CG ASP 5 8.714 0.671 -12.529 1.00 0.00 ATOM 39 OD1 ASP 5 8.995 -0.457 -12.983 1.00 0.00 ATOM 40 OD2 ASP 5 8.676 0.926 -11.308 1.00 0.00 ATOM 41 O ASP 5 7.149 2.162 -16.542 1.00 0.00 ATOM 42 C ASP 5 8.162 2.451 -15.901 1.00 0.00 ATOM 43 N ILE 6 8.756 3.645 -15.978 1.00 0.00 ATOM 44 CA ILE 6 8.264 4.694 -16.869 1.00 0.00 ATOM 45 CB ILE 6 9.052 6.005 -16.685 1.00 0.00 ATOM 46 CG1 ILE 6 8.774 6.606 -15.306 1.00 0.00 ATOM 47 CG2 ILE 6 8.649 7.021 -17.744 1.00 0.00 ATOM 48 CD1 ILE 6 9.705 7.740 -14.936 1.00 0.00 ATOM 49 O ILE 6 7.498 4.185 -19.070 1.00 0.00 ATOM 50 C ILE 6 8.437 4.185 -18.284 1.00 0.00 ATOM 51 N MET 7 9.651 3.739 -18.585 1.00 0.00 ATOM 52 CA MET 7 9.997 3.199 -19.891 1.00 0.00 ATOM 53 CB MET 7 11.371 2.526 -19.846 1.00 0.00 ATOM 54 CG MET 7 12.531 3.492 -19.678 1.00 0.00 ATOM 55 SD MET 7 14.113 2.651 -19.478 1.00 0.00 ATOM 56 CE MET 7 14.291 1.877 -21.083 1.00 0.00 ATOM 57 O MET 7 8.636 2.102 -21.533 1.00 0.00 ATOM 58 C MET 7 8.976 2.156 -20.355 1.00 0.00 ATOM 59 N HIS 8 8.484 1.337 -19.429 1.00 0.00 ATOM 60 CA HIS 8 7.511 0.295 -19.760 1.00 0.00 ATOM 61 CB HIS 8 7.540 -0.818 -18.710 1.00 0.00 ATOM 62 CG HIS 8 8.804 -1.619 -18.714 1.00 0.00 ATOM 63 CD2 HIS 8 10.006 -1.658 -19.536 1.00 0.00 ATOM 64 ND1 HIS 8 9.066 -2.601 -17.784 1.00 0.00 ATOM 65 CE1 HIS 8 10.270 -3.140 -18.042 1.00 0.00 ATOM 66 NE2 HIS 8 10.840 -2.579 -19.092 1.00 0.00 ATOM 67 O HIS 8 5.141 0.086 -20.055 1.00 0.00 ATOM 68 C HIS 8 6.088 0.834 -19.817 1.00 0.00 ATOM 69 N ILE 9 5.945 2.134 -19.605 1.00 0.00 ATOM 70 CA ILE 9 4.642 2.778 -19.624 1.00 0.00 ATOM 71 CB ILE 9 3.986 2.684 -21.015 1.00 0.00 ATOM 72 CG1 ILE 9 4.964 3.146 -22.097 1.00 0.00 ATOM 73 CG2 ILE 9 2.746 3.562 -21.079 1.00 0.00 ATOM 74 CD1 ILE 9 4.340 3.261 -23.472 1.00 0.00 ATOM 75 O ILE 9 2.475 1.971 -18.954 1.00 0.00 ATOM 76 C ILE 9 3.652 2.162 -18.634 1.00 0.00 ATOM 77 N LEU 10 4.119 1.838 -17.433 1.00 0.00 ATOM 78 CA LEU 10 3.209 1.307 -16.431 1.00 0.00 ATOM 79 CB LEU 10 3.990 0.753 -15.237 1.00 0.00 ATOM 80 CG LEU 10 4.896 -0.446 -15.518 1.00 0.00 ATOM 81 CD1 LEU 10 5.699 -0.815 -14.280 1.00 0.00 ATOM 82 CD2 LEU 10 4.073 -1.657 -15.929 1.00 0.00 ATOM 83 O LEU 10 2.786 3.633 -16.061 1.00 0.00 ATOM 84 C LEU 10 2.344 2.482 -16.024 1.00 0.00 ATOM 85 N GLU 11 1.111 2.200 -15.639 1.00 0.00 ATOM 86 CA GLU 11 0.224 3.266 -15.217 1.00 0.00 ATOM 87 CB GLU 11 -1.199 2.736 -15.034 1.00 0.00 ATOM 88 CG GLU 11 -2.222 3.809 -14.695 1.00 0.00 ATOM 89 CD GLU 11 -3.627 3.256 -14.569 1.00 0.00 ATOM 90 OE1 GLU 11 -3.803 2.032 -14.749 1.00 0.00 ATOM 91 OE2 GLU 11 -4.554 4.044 -14.290 1.00 0.00 ATOM 92 O GLU 11 1.084 3.084 -12.972 1.00 0.00 ATOM 93 C GLU 11 0.724 3.833 -13.885 1.00 0.00 ATOM 94 N ASP 12 0.752 5.159 -13.794 1.00 0.00 ATOM 95 CA ASP 12 1.185 5.843 -12.583 1.00 0.00 ATOM 96 CB ASP 12 0.103 5.760 -11.504 1.00 0.00 ATOM 97 CG ASP 12 -1.182 6.454 -11.914 1.00 0.00 ATOM 98 OD1 ASP 12 -1.134 7.666 -12.207 1.00 0.00 ATOM 99 OD2 ASP 12 -2.235 5.782 -11.941 1.00 0.00 ATOM 100 O ASP 12 2.447 4.656 -10.912 1.00 0.00 ATOM 101 C ASP 12 2.474 5.227 -11.998 1.00 0.00 ATOM 102 N MET 13 3.609 5.330 -12.715 1.00 0.00 ATOM 103 CA MET 13 4.888 4.778 -12.237 1.00 0.00 ATOM 104 CB MET 13 6.014 5.111 -13.217 1.00 0.00 ATOM 105 CG MET 13 5.897 4.407 -14.560 1.00 0.00 ATOM 106 SD MET 13 5.924 2.610 -14.408 1.00 0.00 ATOM 107 CE MET 13 4.174 2.237 -14.486 1.00 0.00 ATOM 108 O MET 13 5.963 4.688 -10.063 1.00 0.00 ATOM 109 C MET 13 5.288 5.346 -10.857 1.00 0.00 ATOM 110 N LYS 14 4.864 6.576 -10.579 1.00 0.00 ATOM 111 CA LYS 14 5.200 7.195 -9.306 1.00 0.00 ATOM 112 CB LYS 14 5.288 8.716 -9.457 1.00 0.00 ATOM 113 CG LYS 14 6.411 9.185 -10.366 1.00 0.00 ATOM 114 CD LYS 14 6.439 10.700 -10.472 1.00 0.00 ATOM 115 CE LYS 14 7.528 11.168 -11.424 1.00 0.00 ATOM 116 NZ LYS 14 7.583 12.652 -11.520 1.00 0.00 ATOM 117 O LYS 14 4.345 7.385 -7.072 1.00 0.00 ATOM 118 C LYS 14 4.181 6.921 -8.200 1.00 0.00 ATOM 119 N VAL 15 3.146 6.146 -8.502 1.00 0.00 ATOM 120 CA VAL 15 2.132 5.846 -7.500 1.00 0.00 ATOM 121 CB VAL 15 0.893 5.183 -8.129 1.00 0.00 ATOM 122 CG1 VAL 15 -0.101 4.778 -7.052 1.00 0.00 ATOM 123 CG2 VAL 15 0.202 6.144 -9.084 1.00 0.00 ATOM 124 O VAL 15 3.343 3.901 -6.761 1.00 0.00 ATOM 125 C VAL 15 2.688 4.893 -6.440 1.00 0.00 ATOM 126 N GLY 16 2.452 5.220 -5.178 1.00 0.00 ATOM 127 CA GLY 16 2.916 4.381 -4.075 1.00 0.00 ATOM 128 O GLY 16 1.067 5.261 -2.815 1.00 0.00 ATOM 129 C GLY 16 1.832 4.311 -3.001 1.00 0.00 ATOM 130 N VAL 17 1.757 3.186 -2.303 1.00 0.00 ATOM 131 CA VAL 17 0.766 3.047 -1.245 1.00 0.00 ATOM 132 CB VAL 17 0.293 1.588 -1.101 1.00 0.00 ATOM 133 CG1 VAL 17 -0.700 1.460 0.044 1.00 0.00 ATOM 134 CG2 VAL 17 -0.385 1.119 -2.380 1.00 0.00 ATOM 135 O VAL 17 2.434 2.969 0.514 1.00 0.00 ATOM 136 C VAL 17 1.400 3.500 0.078 1.00 0.00 ATOM 137 N PHE 18 0.793 4.500 0.703 1.00 0.00 ATOM 138 CA PHE 18 1.318 4.984 1.966 1.00 0.00 ATOM 139 CB PHE 18 1.259 6.513 2.020 1.00 0.00 ATOM 140 CG PHE 18 2.185 7.187 1.048 1.00 0.00 ATOM 141 CD1 PHE 18 1.743 7.555 -0.211 1.00 0.00 ATOM 142 CD2 PHE 18 3.497 7.458 1.394 1.00 0.00 ATOM 143 CE1 PHE 18 2.594 8.177 -1.104 1.00 0.00 ATOM 144 CE2 PHE 18 4.349 8.080 0.501 1.00 0.00 ATOM 145 CZ PHE 18 3.903 8.439 -0.744 1.00 0.00 ATOM 146 O PHE 18 -0.732 4.556 3.095 1.00 0.00 ATOM 147 C PHE 18 0.482 4.410 3.083 1.00 0.00 ATOM 148 N ALA 19 1.136 3.751 4.017 1.00 0.00 ATOM 149 CA ALA 19 0.433 3.193 5.151 1.00 0.00 ATOM 150 CB ALA 19 0.861 1.753 5.383 1.00 0.00 ATOM 151 O ALA 19 1.948 4.395 6.577 1.00 0.00 ATOM 152 C ALA 19 0.777 4.040 6.362 1.00 0.00 ATOM 153 N THR 20 -0.250 4.379 7.134 1.00 0.00 ATOM 154 CA THR 20 -0.094 5.147 8.365 1.00 0.00 ATOM 155 CB THR 20 -0.668 6.569 8.220 1.00 0.00 ATOM 156 CG2 THR 20 -0.027 7.284 7.039 1.00 0.00 ATOM 157 OG1 THR 20 -2.082 6.499 8.008 1.00 0.00 ATOM 158 O THR 20 -1.588 3.390 9.083 1.00 0.00 ATOM 159 C THR 20 -0.871 4.346 9.421 1.00 0.00 ATOM 160 N LEU 21 -0.757 4.746 10.683 1.00 0.00 ATOM 161 CA LEU 21 -1.410 4.043 11.786 1.00 0.00 ATOM 162 CB LEU 21 -0.372 3.317 12.646 1.00 0.00 ATOM 163 CG LEU 21 0.418 2.202 11.958 1.00 0.00 ATOM 164 CD1 LEU 21 1.527 1.693 12.865 1.00 0.00 ATOM 165 CD2 LEU 21 -0.491 1.032 11.614 1.00 0.00 ATOM 166 O LEU 21 -1.633 6.027 13.123 1.00 0.00 ATOM 167 C LEU 21 -2.179 5.003 12.692 1.00 0.00 ATOM 168 N ASP 22 -3.435 4.688 12.996 1.00 0.00 ATOM 169 CA ASP 22 -4.193 5.590 13.854 1.00 0.00 ATOM 170 CB ASP 22 -5.696 5.375 13.663 1.00 0.00 ATOM 171 CG ASP 22 -6.158 4.022 14.169 1.00 0.00 ATOM 172 OD1 ASP 22 -5.395 3.372 14.914 1.00 0.00 ATOM 173 OD2 ASP 22 -7.285 3.612 13.820 1.00 0.00 ATOM 174 O ASP 22 -3.049 4.509 15.653 1.00 0.00 ATOM 175 C ASP 22 -3.868 5.362 15.332 1.00 0.00 ATOM 176 N GLU 23 -4.501 6.126 16.222 1.00 0.00 ATOM 177 CA GLU 23 -4.250 6.024 17.669 1.00 0.00 ATOM 178 CB GLU 23 -5.060 7.075 18.429 1.00 0.00 ATOM 179 CG GLU 23 -4.567 8.499 18.234 1.00 0.00 ATOM 180 CD GLU 23 -5.446 9.521 18.928 1.00 0.00 ATOM 181 OE1 GLU 23 -6.488 9.125 19.489 1.00 0.00 ATOM 182 OE2 GLU 23 -5.092 10.719 18.911 1.00 0.00 ATOM 183 O GLU 23 -4.178 4.372 19.407 1.00 0.00 ATOM 184 C GLU 23 -4.614 4.670 18.303 1.00 0.00 ATOM 185 N TYR 24 -5.395 3.846 17.610 1.00 0.00 ATOM 186 CA TYR 24 -5.785 2.550 18.161 1.00 0.00 ATOM 187 CB TYR 24 -7.223 2.210 17.766 1.00 0.00 ATOM 188 CG TYR 24 -8.255 3.156 18.334 1.00 0.00 ATOM 189 CD1 TYR 24 -8.824 4.147 17.542 1.00 0.00 ATOM 190 CD2 TYR 24 -8.658 3.058 19.659 1.00 0.00 ATOM 191 CE1 TYR 24 -9.768 5.017 18.054 1.00 0.00 ATOM 192 CE2 TYR 24 -9.602 3.918 20.187 1.00 0.00 ATOM 193 CZ TYR 24 -10.157 4.903 19.371 1.00 0.00 ATOM 194 OH TYR 24 -11.097 5.769 19.882 1.00 0.00 ATOM 195 O TYR 24 -5.103 0.270 17.958 1.00 0.00 ATOM 196 C TYR 24 -4.875 1.431 17.649 1.00 0.00 ATOM 197 N GLY 25 -3.854 1.778 16.870 1.00 0.00 ATOM 198 CA GLY 25 -2.965 0.761 16.326 1.00 0.00 ATOM 199 O GLY 25 -2.982 -0.867 14.545 1.00 0.00 ATOM 200 C GLY 25 -3.492 0.158 15.021 1.00 0.00 ATOM 201 N ASN 26 -4.512 0.798 14.445 1.00 0.00 ATOM 202 CA ASN 26 -5.116 0.344 13.195 1.00 0.00 ATOM 203 CB ASN 26 -6.590 0.747 13.134 1.00 0.00 ATOM 204 CG ASN 26 -7.298 0.187 11.917 1.00 0.00 ATOM 205 ND2 ASN 26 -8.611 0.021 12.020 1.00 0.00 ATOM 206 OD1 ASN 26 -6.669 -0.094 10.896 1.00 0.00 ATOM 207 O ASN 26 -4.382 2.148 11.786 1.00 0.00 ATOM 208 C ASN 26 -4.414 0.948 11.965 1.00 0.00 ATOM 209 N PRO 27 -3.820 0.114 11.116 1.00 0.00 ATOM 210 CA PRO 27 -3.172 0.731 9.950 1.00 0.00 ATOM 211 CB PRO 27 -2.235 -0.359 9.425 1.00 0.00 ATOM 212 CG PRO 27 -2.907 -1.638 9.795 1.00 0.00 ATOM 213 CD PRO 27 -3.562 -1.395 11.126 1.00 0.00 ATOM 214 O PRO 27 -5.287 0.524 8.850 1.00 0.00 ATOM 215 C PRO 27 -4.214 1.131 8.906 1.00 0.00 ATOM 216 N HIS 28 -3.901 2.153 8.103 1.00 0.00 ATOM 217 CA HIS 28 -4.761 2.642 7.024 1.00 0.00 ATOM 218 CB HIS 28 -5.419 3.965 7.421 1.00 0.00 ATOM 219 CG HIS 28 -6.333 3.855 8.602 1.00 0.00 ATOM 220 CD2 HIS 28 -6.236 4.162 10.021 1.00 0.00 ATOM 221 ND1 HIS 28 -7.616 3.364 8.507 1.00 0.00 ATOM 222 CE1 HIS 28 -8.185 3.387 9.726 1.00 0.00 ATOM 223 NE2 HIS 28 -7.362 3.866 10.639 1.00 0.00 ATOM 224 O HIS 28 -2.695 3.170 5.930 1.00 0.00 ATOM 225 C HIS 28 -3.882 2.846 5.794 1.00 0.00 ATOM 226 N ALA 29 -4.457 2.670 4.603 1.00 0.00 ATOM 227 CA ALA 29 -3.693 2.838 3.366 1.00 0.00 ATOM 228 CB ALA 29 -3.357 1.482 2.763 1.00 0.00 ATOM 229 O ALA 29 -5.659 3.681 2.235 1.00 0.00 ATOM 230 C ALA 29 -4.422 3.628 2.282 1.00 0.00 ATOM 231 N ARG 30 -3.632 4.228 1.399 1.00 0.00 ATOM 232 CA ARG 30 -4.165 4.974 0.274 1.00 0.00 ATOM 233 CB ARG 30 -4.806 6.280 0.750 1.00 0.00 ATOM 234 CG ARG 30 -3.828 7.255 1.386 1.00 0.00 ATOM 235 CD ARG 30 -4.530 8.523 1.842 1.00 0.00 ATOM 236 NE ARG 30 -3.648 9.387 2.621 1.00 0.00 ATOM 237 CZ ARG 30 -2.801 10.265 2.091 1.00 0.00 ATOM 238 NH1 ARG 30 -2.038 11.009 2.878 1.00 0.00 ATOM 239 NH2 ARG 30 -2.723 10.396 0.774 1.00 0.00 ATOM 240 O ARG 30 -1.853 5.352 -0.179 1.00 0.00 ATOM 241 C ARG 30 -2.993 5.257 -0.634 1.00 0.00 ATOM 242 N HIS 31 -3.267 5.386 -1.919 1.00 0.00 ATOM 243 CA HIS 31 -2.226 5.693 -2.879 1.00 0.00 ATOM 244 CB HIS 31 -2.609 5.178 -4.268 1.00 0.00 ATOM 245 CG HIS 31 -2.623 3.685 -4.377 1.00 0.00 ATOM 246 CD2 HIS 31 -1.737 2.678 -4.942 1.00 0.00 ATOM 247 ND1 HIS 31 -3.646 2.912 -3.876 1.00 0.00 ATOM 248 CE1 HIS 31 -3.379 1.617 -4.123 1.00 0.00 ATOM 249 NE2 HIS 31 -2.234 1.469 -4.763 1.00 0.00 ATOM 250 O HIS 31 -2.900 7.996 -2.968 1.00 0.00 ATOM 251 C HIS 31 -1.968 7.200 -3.002 1.00 0.00 ATOM 252 N ALA 32 -0.697 7.587 -3.105 1.00 0.00 ATOM 253 CA ALA 32 -0.354 8.990 -3.346 1.00 0.00 ATOM 254 CB ALA 32 0.102 9.653 -2.055 1.00 0.00 ATOM 255 O ALA 32 1.397 7.935 -4.616 1.00 0.00 ATOM 256 C ALA 32 0.779 8.977 -4.381 1.00 0.00 ATOM 257 N HIS 33 1.065 10.121 -4.994 1.00 0.00 ATOM 258 CA HIS 33 2.134 10.162 -5.995 1.00 0.00 ATOM 259 CB HIS 33 1.745 11.080 -7.155 1.00 0.00 ATOM 260 CG HIS 33 0.542 10.617 -7.916 1.00 0.00 ATOM 261 CD2 HIS 33 -0.871 10.966 -7.935 1.00 0.00 ATOM 262 ND1 HIS 33 0.602 9.626 -8.871 1.00 0.00 ATOM 263 CE1 HIS 33 -0.631 9.432 -9.376 1.00 0.00 ATOM 264 NE2 HIS 33 -1.518 10.232 -8.820 1.00 0.00 ATOM 265 O HIS 33 3.476 11.700 -4.731 1.00 0.00 ATOM 266 C HIS 33 3.442 10.678 -5.424 1.00 0.00 ATOM 267 N ILE 34 4.521 9.959 -5.719 1.00 0.00 ATOM 268 CA ILE 34 5.850 10.374 -5.299 1.00 0.00 ATOM 269 CB ILE 34 6.884 9.252 -5.506 1.00 0.00 ATOM 270 CG1 ILE 34 6.547 8.048 -4.624 1.00 0.00 ATOM 271 CG2 ILE 34 8.278 9.739 -5.144 1.00 0.00 ATOM 272 CD1 ILE 34 7.367 6.815 -4.935 1.00 0.00 ATOM 273 O ILE 34 5.996 11.503 -7.414 1.00 0.00 ATOM 274 C ILE 34 6.150 11.585 -6.193 1.00 0.00 ATOM 275 N THR 35 6.567 12.702 -5.605 1.00 0.00 ATOM 276 CA THR 35 6.830 13.892 -6.409 1.00 0.00 ATOM 277 CB THR 35 6.057 15.114 -5.878 1.00 0.00 ATOM 278 CG2 THR 35 4.560 14.842 -5.889 1.00 0.00 ATOM 279 OG1 THR 35 6.468 15.397 -4.535 1.00 0.00 ATOM 280 O THR 35 8.686 15.052 -7.289 1.00 0.00 ATOM 281 C THR 35 8.278 14.284 -6.431 1.00 0.00 ATOM 282 N ALA 36 9.054 13.755 -5.494 1.00 0.00 ATOM 283 CA ALA 36 10.479 14.054 -5.421 1.00 0.00 ATOM 284 CB ALA 36 10.695 15.483 -4.944 1.00 0.00 ATOM 285 O ALA 36 10.535 12.599 -3.506 1.00 0.00 ATOM 286 C ALA 36 11.161 13.107 -4.446 1.00 0.00 ATOM 287 N ALA 37 12.444 12.855 -4.663 1.00 0.00 ATOM 288 CA ALA 37 13.177 11.996 -3.747 1.00 0.00 ATOM 289 CB ALA 37 12.935 10.533 -4.085 1.00 0.00 ATOM 290 O ALA 37 15.186 12.662 -4.874 1.00 0.00 ATOM 291 C ALA 37 14.670 12.264 -3.830 1.00 0.00 ATOM 292 N ASN 38 15.340 12.090 -2.700 1.00 0.00 ATOM 293 CA ASN 38 16.784 12.233 -2.612 1.00 0.00 ATOM 294 CB ASN 38 17.180 13.710 -2.649 1.00 0.00 ATOM 295 CG ASN 38 16.511 14.520 -1.558 1.00 0.00 ATOM 296 ND2 ASN 38 15.814 15.580 -1.950 1.00 0.00 ATOM 297 OD1 ASN 38 16.620 14.195 -0.375 1.00 0.00 ATOM 298 O ASN 38 16.301 11.030 -0.580 1.00 0.00 ATOM 299 C ASN 38 17.169 11.589 -1.272 1.00 0.00 ATOM 300 N GLU 39 18.444 11.637 -0.903 1.00 0.00 ATOM 301 CA GLU 39 18.852 10.976 0.329 1.00 0.00 ATOM 302 CB GLU 39 20.316 11.288 0.646 1.00 0.00 ATOM 303 CG GLU 39 20.873 10.516 1.829 1.00 0.00 ATOM 304 CD GLU 39 22.350 10.779 2.053 1.00 0.00 ATOM 305 OE1 GLU 39 22.930 11.590 1.300 1.00 0.00 ATOM 306 OE2 GLU 39 22.927 10.172 2.980 1.00 0.00 ATOM 307 O GLU 39 17.949 10.609 2.513 1.00 0.00 ATOM 308 C GLU 39 18.048 11.386 1.569 1.00 0.00 ATOM 309 N GLU 40 17.460 12.582 1.563 1.00 0.00 ATOM 310 CA GLU 40 16.681 13.029 2.712 1.00 0.00 ATOM 311 CB GLU 40 16.446 14.540 2.644 1.00 0.00 ATOM 312 CG GLU 40 17.709 15.372 2.785 1.00 0.00 ATOM 313 CD GLU 40 17.440 16.861 2.692 1.00 0.00 ATOM 314 OE1 GLU 40 16.257 17.244 2.565 1.00 0.00 ATOM 315 OE2 GLU 40 18.410 17.645 2.744 1.00 0.00 ATOM 316 O GLU 40 14.644 12.394 3.798 1.00 0.00 ATOM 317 C GLU 40 15.311 12.345 2.773 1.00 0.00 ATOM 318 N GLY 41 14.886 11.714 1.679 1.00 0.00 ATOM 319 CA GLY 41 13.617 11.002 1.717 1.00 0.00 ATOM 320 O GLY 41 13.067 11.724 -0.502 1.00 0.00 ATOM 321 C GLY 41 12.703 11.138 0.516 1.00 0.00 ATOM 322 N ILE 42 11.498 10.589 0.646 1.00 0.00 ATOM 323 CA ILE 42 10.516 10.642 -0.429 1.00 0.00 ATOM 324 CB ILE 42 9.915 9.253 -0.715 1.00 0.00 ATOM 325 CG1 ILE 42 11.009 8.278 -1.155 1.00 0.00 ATOM 326 CG2 ILE 42 8.872 9.340 -1.819 1.00 0.00 ATOM 327 CD1 ILE 42 10.550 6.840 -1.236 1.00 0.00 ATOM 328 O ILE 42 8.762 11.486 0.988 1.00 0.00 ATOM 329 C ILE 42 9.359 11.570 -0.094 1.00 0.00 ATOM 330 N PHE 43 9.016 12.412 -1.065 1.00 0.00 ATOM 331 CA PHE 43 7.999 13.441 -0.900 1.00 0.00 ATOM 332 CB PHE 43 8.525 14.795 -1.377 1.00 0.00 ATOM 333 CG PHE 43 9.642 15.343 -0.533 1.00 0.00 ATOM 334 CD1 PHE 43 10.963 15.084 -0.856 1.00 0.00 ATOM 335 CD2 PHE 43 9.371 16.114 0.582 1.00 0.00 ATOM 336 CE1 PHE 43 11.991 15.587 -0.081 1.00 0.00 ATOM 337 CE2 PHE 43 10.399 16.617 1.358 1.00 0.00 ATOM 338 CZ PHE 43 11.703 16.356 1.031 1.00 0.00 ATOM 339 O PHE 43 6.654 12.850 -2.800 1.00 0.00 ATOM 340 C PHE 43 6.681 13.263 -1.640 1.00 0.00 ATOM 341 N PHE 44 5.595 13.599 -0.951 1.00 0.00 ATOM 342 CA PHE 44 4.264 13.564 -1.531 1.00 0.00 ATOM 343 CB PHE 44 3.584 12.226 -1.233 1.00 0.00 ATOM 344 CG PHE 44 3.346 11.979 0.229 1.00 0.00 ATOM 345 CD1 PHE 44 2.144 12.334 0.820 1.00 0.00 ATOM 346 CD2 PHE 44 4.322 11.393 1.016 1.00 0.00 ATOM 347 CE1 PHE 44 1.926 12.107 2.164 1.00 0.00 ATOM 348 CE2 PHE 44 4.104 11.167 2.361 1.00 0.00 ATOM 349 CZ PHE 44 2.911 11.520 2.936 1.00 0.00 ATOM 350 O PHE 44 3.826 15.178 0.214 1.00 0.00 ATOM 351 C PHE 44 3.482 14.722 -0.887 1.00 0.00 ATOM 352 N MET 45 2.458 15.212 -1.580 1.00 0.00 ATOM 353 CA MET 45 1.636 16.306 -1.080 1.00 0.00 ATOM 354 CB MET 45 1.533 17.421 -2.125 1.00 0.00 ATOM 355 CG MET 45 2.864 18.061 -2.481 1.00 0.00 ATOM 356 SD MET 45 2.697 19.382 -3.696 1.00 0.00 ATOM 357 CE MET 45 2.347 18.438 -5.177 1.00 0.00 ATOM 358 O MET 45 -0.283 14.853 -1.332 1.00 0.00 ATOM 359 C MET 45 0.217 15.828 -0.753 1.00 0.00 ATOM 360 N THR 46 -0.441 16.521 0.164 1.00 0.00 ATOM 361 CA THR 46 -1.776 16.110 0.560 1.00 0.00 ATOM 362 CB THR 46 -1.737 14.859 1.457 1.00 0.00 ATOM 363 CG2 THR 46 -1.119 15.189 2.806 1.00 0.00 ATOM 364 OG1 THR 46 -3.071 14.375 1.665 1.00 0.00 ATOM 365 O THR 46 -1.823 18.244 1.660 1.00 0.00 ATOM 366 C THR 46 -2.461 17.240 1.341 1.00 0.00 ATOM 367 N SER 47 -3.741 17.046 1.652 1.00 0.00 ATOM 368 CA SER 47 -4.531 18.020 2.395 1.00 0.00 ATOM 369 CB SER 47 -6.026 17.788 2.162 1.00 0.00 ATOM 370 OG SER 47 -6.807 18.657 2.962 1.00 0.00 ATOM 371 O SER 47 -4.231 16.704 4.384 1.00 0.00 ATOM 372 C SER 47 -4.180 17.821 3.875 1.00 0.00 ATOM 373 N PRO 48 -3.828 18.903 4.551 1.00 0.00 ATOM 374 CA PRO 48 -3.430 18.829 5.954 1.00 0.00 ATOM 375 CB PRO 48 -2.879 20.223 6.257 1.00 0.00 ATOM 376 CG PRO 48 -2.546 20.792 4.918 1.00 0.00 ATOM 377 CD PRO 48 -3.544 20.206 3.957 1.00 0.00 ATOM 378 O PRO 48 -4.301 18.290 8.124 1.00 0.00 ATOM 379 C PRO 48 -4.557 18.498 6.939 1.00 0.00 ATOM 380 N GLU 49 -5.798 18.469 6.462 1.00 0.00 ATOM 381 CA GLU 49 -6.915 18.133 7.339 1.00 0.00 ATOM 382 CB GLU 49 -8.109 19.050 7.061 1.00 0.00 ATOM 383 CG GLU 49 -7.856 20.512 7.387 1.00 0.00 ATOM 384 CD GLU 49 -9.060 21.388 7.100 1.00 0.00 ATOM 385 OE1 GLU 49 -10.096 20.849 6.658 1.00 0.00 ATOM 386 OE2 GLU 49 -8.966 22.615 7.316 1.00 0.00 ATOM 387 O GLU 49 -8.276 16.223 7.814 1.00 0.00 ATOM 388 C GLU 49 -7.368 16.693 7.131 1.00 0.00 ATOM 389 N THR 50 -6.707 15.997 6.198 1.00 0.00 ATOM 390 CA THR 50 -7.018 14.601 5.846 1.00 0.00 ATOM 391 CB THR 50 -6.196 14.130 4.633 1.00 0.00 ATOM 392 CG2 THR 50 -6.449 15.032 3.434 1.00 0.00 ATOM 393 OG1 THR 50 -4.800 14.166 4.953 1.00 0.00 ATOM 394 O THR 50 -6.053 13.943 7.944 1.00 0.00 ATOM 395 C THR 50 -6.730 13.613 6.965 1.00 0.00 ATOM 396 N HIS 51 -7.251 12.399 6.814 1.00 0.00 ATOM 397 CA HIS 51 -7.024 11.368 7.808 1.00 0.00 ATOM 398 CB HIS 51 -7.820 10.108 7.465 1.00 0.00 ATOM 399 CG HIS 51 -9.300 10.263 7.637 1.00 0.00 ATOM 400 CD2 HIS 51 -10.174 11.229 8.285 1.00 0.00 ATOM 401 ND1 HIS 51 -10.207 9.362 7.122 1.00 0.00 ATOM 402 CE1 HIS 51 -11.451 9.765 7.437 1.00 0.00 ATOM 403 NE2 HIS 51 -11.439 10.885 8.135 1.00 0.00 ATOM 404 O HIS 51 -4.999 10.798 8.952 1.00 0.00 ATOM 405 C HIS 51 -5.539 10.998 7.873 1.00 0.00 ATOM 406 N PHE 52 -4.874 10.913 6.726 1.00 0.00 ATOM 407 CA PHE 52 -3.469 10.510 6.765 1.00 0.00 ATOM 408 CB PHE 52 -2.906 10.395 5.347 1.00 0.00 ATOM 409 CG PHE 52 -1.459 9.991 5.302 1.00 0.00 ATOM 410 CD1 PHE 52 -1.090 8.668 5.477 1.00 0.00 ATOM 411 CD2 PHE 52 -0.469 10.932 5.085 1.00 0.00 ATOM 412 CE1 PHE 52 0.241 8.296 5.434 1.00 0.00 ATOM 413 CE2 PHE 52 0.861 10.560 5.042 1.00 0.00 ATOM 414 CZ PHE 52 1.219 9.249 5.215 1.00 0.00 ATOM 415 O PHE 52 -1.741 11.173 8.260 1.00 0.00 ATOM 416 C PHE 52 -2.653 11.538 7.529 1.00 0.00 ATOM 417 N TYR 53 -3.012 12.813 7.377 1.00 0.00 ATOM 418 CA TYR 53 -2.310 13.903 8.061 1.00 0.00 ATOM 419 CB TYR 53 -2.837 15.259 7.586 1.00 0.00 ATOM 420 CG TYR 53 -2.178 16.440 8.262 1.00 0.00 ATOM 421 CD1 TYR 53 -0.918 16.873 7.873 1.00 0.00 ATOM 422 CD2 TYR 53 -2.823 17.121 9.289 1.00 0.00 ATOM 423 CE1 TYR 53 -0.310 17.952 8.486 1.00 0.00 ATOM 424 CE2 TYR 53 -2.230 18.203 9.913 1.00 0.00 ATOM 425 CZ TYR 53 -0.962 18.615 9.503 1.00 0.00 ATOM 426 OH TYR 53 -0.360 19.689 10.114 1.00 0.00 ATOM 427 O TYR 53 -1.576 13.899 10.367 1.00 0.00 ATOM 428 C TYR 53 -2.526 13.796 9.585 1.00 0.00 ATOM 429 N ASP 54 -3.777 13.590 10.003 1.00 0.00 ATOM 430 CA ASP 54 -4.069 13.451 11.438 1.00 0.00 ATOM 431 CB ASP 54 -5.566 13.233 11.660 1.00 0.00 ATOM 432 CG ASP 54 -6.380 14.491 11.426 1.00 0.00 ATOM 433 OD1 ASP 54 -5.775 15.579 11.325 1.00 0.00 ATOM 434 OD2 ASP 54 -7.622 14.388 11.344 1.00 0.00 ATOM 435 O ASP 54 -2.743 12.318 13.106 1.00 0.00 ATOM 436 C ASP 54 -3.307 12.255 12.009 1.00 0.00 ATOM 437 N GLN 55 -3.283 11.160 11.255 1.00 0.00 ATOM 438 CA GLN 55 -2.610 9.964 11.729 1.00 0.00 ATOM 439 CB GLN 55 -2.855 8.796 10.770 1.00 0.00 ATOM 440 CG GLN 55 -4.287 8.285 10.768 1.00 0.00 ATOM 441 CD GLN 55 -4.490 7.127 9.811 1.00 0.00 ATOM 442 OE1 GLN 55 -4.503 7.311 8.594 1.00 0.00 ATOM 443 NE2 GLN 55 -4.650 5.929 10.359 1.00 0.00 ATOM 444 O GLN 55 -0.488 9.766 12.819 1.00 0.00 ATOM 445 C GLN 55 -1.106 10.167 11.837 1.00 0.00 ATOM 446 N LEU 56 -0.523 10.832 10.855 1.00 0.00 ATOM 447 CA LEU 56 0.909 11.091 10.888 1.00 0.00 ATOM 448 CB LEU 56 1.357 11.801 9.609 1.00 0.00 ATOM 449 CG LEU 56 1.318 10.971 8.324 1.00 0.00 ATOM 450 CD1 LEU 56 1.609 11.843 7.111 1.00 0.00 ATOM 451 CD2 LEU 56 2.355 9.859 8.370 1.00 0.00 ATOM 452 O LEU 56 2.311 11.828 12.727 1.00 0.00 ATOM 453 C LEU 56 1.262 11.991 12.104 1.00 0.00 ATOM 454 N MET 57 0.378 12.933 12.434 1.00 0.00 ATOM 455 CA MET 57 0.644 13.829 13.559 1.00 0.00 ATOM 456 CB MET 57 -0.447 14.897 13.663 1.00 0.00 ATOM 457 CG MET 57 -0.447 15.897 12.518 1.00 0.00 ATOM 458 SD MET 57 1.110 16.796 12.381 1.00 0.00 ATOM 459 CE MET 57 1.071 17.775 13.878 1.00 0.00 ATOM 460 O MET 57 1.401 13.444 15.807 1.00 0.00 ATOM 461 C MET 57 0.683 13.061 14.887 1.00 0.00 ATOM 462 N GLY 58 -0.080 11.976 14.980 1.00 0.00 ATOM 463 CA GLY 58 -0.072 11.161 16.200 1.00 0.00 ATOM 464 O GLY 58 1.523 9.658 17.210 1.00 0.00 ATOM 465 C GLY 58 1.028 10.082 16.161 1.00 0.00 ATOM 466 N ASP 59 1.408 9.644 14.962 1.00 0.00 ATOM 467 CA ASP 59 2.440 8.611 14.795 1.00 0.00 ATOM 468 CB ASP 59 1.812 7.217 14.833 1.00 0.00 ATOM 469 CG ASP 59 2.846 6.109 14.774 1.00 0.00 ATOM 470 OD1 ASP 59 4.034 6.420 14.542 1.00 0.00 ATOM 471 OD2 ASP 59 2.470 4.934 14.960 1.00 0.00 ATOM 472 O ASP 59 2.545 8.528 12.399 1.00 0.00 ATOM 473 C ASP 59 3.100 8.856 13.440 1.00 0.00 ATOM 474 N GLN 60 4.309 9.440 13.444 1.00 0.00 ATOM 475 CA GLN 60 5.059 9.756 12.223 1.00 0.00 ATOM 476 CB GLN 60 6.265 10.638 12.550 1.00 0.00 ATOM 477 CG GLN 60 5.904 12.040 13.011 1.00 0.00 ATOM 478 CD GLN 60 7.124 12.874 13.352 1.00 0.00 ATOM 479 OE1 GLN 60 8.255 12.395 13.281 1.00 0.00 ATOM 480 NE2 GLN 60 6.894 14.128 13.727 1.00 0.00 ATOM 481 O GLN 60 6.154 8.795 10.321 1.00 0.00 ATOM 482 C GLN 60 5.637 8.592 11.427 1.00 0.00 ATOM 483 N ARG 61 5.527 7.382 11.972 1.00 0.00 ATOM 484 CA ARG 61 6.088 6.200 11.316 1.00 0.00 ATOM 485 CB ARG 61 6.171 5.031 12.299 1.00 0.00 ATOM 486 CG ARG 61 6.828 3.784 11.727 1.00 0.00 ATOM 487 CD ARG 61 6.898 2.673 12.762 1.00 0.00 ATOM 488 NE ARG 61 7.540 1.473 12.232 1.00 0.00 ATOM 489 CZ ARG 61 7.592 0.309 12.872 1.00 0.00 ATOM 490 NH1 ARG 61 8.198 -0.729 12.312 1.00 0.00 ATOM 491 NH2 ARG 61 7.038 0.186 14.071 1.00 0.00 ATOM 492 O ARG 61 4.060 5.435 10.312 1.00 0.00 ATOM 493 C ARG 61 5.230 5.767 10.144 1.00 0.00 ATOM 494 N VAL 62 5.796 5.781 8.951 1.00 0.00 ATOM 495 CA VAL 62 5.011 5.370 7.812 1.00 0.00 ATOM 496 CB VAL 62 4.675 6.563 6.899 1.00 0.00 ATOM 497 CG1 VAL 62 3.845 7.592 7.649 1.00 0.00 ATOM 498 CG2 VAL 62 5.948 7.235 6.410 1.00 0.00 ATOM 499 O VAL 62 6.952 4.105 7.163 1.00 0.00 ATOM 500 C VAL 62 5.754 4.342 6.968 1.00 0.00 ATOM 501 N ALA 63 5.023 3.750 6.027 1.00 0.00 ATOM 502 CA ALA 63 5.566 2.768 5.095 1.00 0.00 ATOM 503 CB ALA 63 5.085 1.370 5.456 1.00 0.00 ATOM 504 O ALA 63 3.935 3.647 3.558 1.00 0.00 ATOM 505 C ALA 63 5.065 3.162 3.705 1.00 0.00 ATOM 506 N MET 64 5.903 2.964 2.699 1.00 0.00 ATOM 507 CA MET 64 5.574 3.267 1.315 1.00 0.00 ATOM 508 CB MET 64 6.449 4.410 0.795 1.00 0.00 ATOM 509 CG MET 64 6.239 5.731 1.516 1.00 0.00 ATOM 510 SD MET 64 7.374 7.016 0.961 1.00 0.00 ATOM 511 CE MET 64 8.893 6.490 1.752 1.00 0.00 ATOM 512 O MET 64 6.838 1.333 0.690 1.00 0.00 ATOM 513 C MET 64 5.823 2.015 0.504 1.00 0.00 ATOM 514 N THR 65 4.907 1.695 -0.395 1.00 0.00 ATOM 515 CA THR 65 5.130 0.522 -1.217 1.00 0.00 ATOM 516 CB THR 65 4.257 -0.663 -0.760 1.00 0.00 ATOM 517 CG2 THR 65 4.535 -1.891 -1.614 1.00 0.00 ATOM 518 OG1 THR 65 4.550 -0.974 0.608 1.00 0.00 ATOM 519 O THR 65 3.715 1.441 -2.916 1.00 0.00 ATOM 520 C THR 65 4.780 0.871 -2.646 1.00 0.00 ATOM 521 N ALA 66 5.718 0.579 -3.545 1.00 0.00 ATOM 522 CA ALA 66 5.540 0.812 -4.973 1.00 0.00 ATOM 523 CB ALA 66 6.851 1.257 -5.605 1.00 0.00 ATOM 524 O ALA 66 5.841 -1.499 -5.594 1.00 0.00 ATOM 525 C ALA 66 5.080 -0.541 -5.536 1.00 0.00 ATOM 526 N ILE 67 3.802 -0.629 -5.926 1.00 0.00 ATOM 527 CA ILE 67 3.202 -1.850 -6.476 1.00 0.00 ATOM 528 CB ILE 67 1.666 -1.819 -6.373 1.00 0.00 ATOM 529 CG1 ILE 67 1.233 -1.614 -4.920 1.00 0.00 ATOM 530 CG2 ILE 67 1.073 -3.128 -6.872 1.00 0.00 ATOM 531 CD1 ILE 67 -0.251 -1.367 -4.755 1.00 0.00 ATOM 532 O ILE 67 2.719 -1.812 -8.827 1.00 0.00 ATOM 533 C ILE 67 3.544 -2.049 -7.941 1.00 0.00 ATOM 534 N SER 68 4.773 -2.479 -8.193 1.00 0.00 ATOM 535 CA SER 68 5.256 -2.701 -9.549 1.00 0.00 ATOM 536 CB SER 68 6.693 -2.193 -9.695 1.00 0.00 ATOM 537 OG SER 68 6.762 -0.794 -9.485 1.00 0.00 ATOM 538 O SER 68 6.112 -4.656 -10.659 1.00 0.00 ATOM 539 C SER 68 5.245 -4.186 -9.916 1.00 0.00 ATOM 540 N GLU 69 4.276 -4.926 -9.388 1.00 0.00 ATOM 541 CA GLU 69 4.203 -6.356 -9.659 1.00 0.00 ATOM 542 CB GLU 69 3.025 -6.983 -8.910 1.00 0.00 ATOM 543 CG GLU 69 3.222 -7.066 -7.405 1.00 0.00 ATOM 544 CD GLU 69 2.003 -7.611 -6.687 1.00 0.00 ATOM 545 OE1 GLU 69 0.973 -7.840 -7.357 1.00 0.00 ATOM 546 OE2 GLU 69 2.076 -7.807 -5.457 1.00 0.00 ATOM 547 O GLU 69 4.265 -7.822 -11.527 1.00 0.00 ATOM 548 C GLU 69 4.011 -6.697 -11.135 1.00 0.00 ATOM 552 N ILE 74 7.073 -7.640 -11.976 1.00 0.00 ATOM 553 CA ILE 74 7.554 -8.574 -10.957 1.00 0.00 ATOM 554 CB ILE 74 8.358 -9.729 -11.585 1.00 0.00 ATOM 555 CG1 ILE 74 9.560 -9.183 -12.356 1.00 0.00 ATOM 556 CG2 ILE 74 7.487 -10.522 -12.547 1.00 0.00 ATOM 557 CD1 ILE 74 10.526 -10.253 -12.816 1.00 0.00 ATOM 558 O ILE 74 9.490 -8.494 -9.490 1.00 0.00 ATOM 559 C ILE 74 8.480 -7.916 -9.913 1.00 0.00 ATOM 560 N GLN 75 8.127 -6.698 -9.509 1.00 0.00 ATOM 561 CA GLN 75 8.921 -5.978 -8.527 1.00 0.00 ATOM 562 CB GLN 75 9.780 -4.912 -9.210 1.00 0.00 ATOM 563 CG GLN 75 10.811 -5.471 -10.176 1.00 0.00 ATOM 564 CD GLN 75 11.933 -6.206 -9.470 1.00 0.00 ATOM 565 OE1 GLN 75 12.321 -5.847 -8.357 1.00 0.00 ATOM 566 NE2 GLN 75 12.460 -7.241 -10.113 1.00 0.00 ATOM 567 O GLN 75 6.930 -4.930 -7.685 1.00 0.00 ATOM 568 C GLN 75 8.095 -5.258 -7.470 1.00 0.00 ATOM 569 N VAL 76 8.712 -5.036 -6.315 1.00 0.00 ATOM 570 CA VAL 76 8.096 -4.260 -5.235 1.00 0.00 ATOM 571 CB VAL 76 7.407 -5.174 -4.205 1.00 0.00 ATOM 572 CG1 VAL 76 6.265 -5.939 -4.855 1.00 0.00 ATOM 573 CG2 VAL 76 8.398 -6.179 -3.636 1.00 0.00 ATOM 574 O VAL 76 10.354 -4.004 -4.543 1.00 0.00 ATOM 575 C VAL 76 9.238 -3.499 -4.595 1.00 0.00 ATOM 576 N VAL 77 8.959 -2.292 -4.117 1.00 0.00 ATOM 577 CA VAL 77 9.944 -1.504 -3.376 1.00 0.00 ATOM 578 CB VAL 77 10.464 -0.319 -4.211 1.00 0.00 ATOM 579 CG1 VAL 77 11.458 0.503 -3.407 1.00 0.00 ATOM 580 CG2 VAL 77 11.157 -0.818 -5.470 1.00 0.00 ATOM 581 O VAL 77 8.032 -0.549 -2.306 1.00 0.00 ATOM 582 C VAL 77 9.152 -1.040 -2.158 1.00 0.00 ATOM 583 N ARG 78 9.719 -1.204 -0.969 1.00 0.00 ATOM 584 CA ARG 78 9.052 -0.802 0.263 1.00 0.00 ATOM 585 CB ARG 78 8.697 -2.030 1.104 1.00 0.00 ATOM 586 CG ARG 78 7.992 -1.706 2.411 1.00 0.00 ATOM 587 CD ARG 78 7.625 -2.970 3.170 1.00 0.00 ATOM 588 NE ARG 78 6.962 -2.675 4.437 1.00 0.00 ATOM 589 CZ ARG 78 6.484 -3.599 5.264 1.00 0.00 ATOM 590 NH1 ARG 78 5.896 -3.236 6.396 1.00 0.00 ATOM 591 NH2 ARG 78 6.593 -4.885 4.956 1.00 0.00 ATOM 592 O ARG 78 11.221 -0.231 1.118 1.00 0.00 ATOM 593 C ARG 78 10.025 0.086 1.010 1.00 0.00 ATOM 594 N VAL 79 9.518 1.207 1.510 1.00 0.00 ATOM 595 CA VAL 79 10.321 2.161 2.253 1.00 0.00 ATOM 596 CB VAL 79 10.358 3.532 1.555 1.00 0.00 ATOM 597 CG1 VAL 79 11.157 4.529 2.381 1.00 0.00 ATOM 598 CG2 VAL 79 11.005 3.416 0.184 1.00 0.00 ATOM 599 O VAL 79 8.512 2.473 3.782 1.00 0.00 ATOM 600 C VAL 79 9.728 2.336 3.636 1.00 0.00 ATOM 601 N GLU 80 10.590 2.333 4.646 1.00 0.00 ATOM 602 CA GLU 80 10.179 2.541 6.027 1.00 0.00 ATOM 603 CB GLU 80 10.586 1.346 6.893 1.00 0.00 ATOM 604 CG GLU 80 10.191 1.475 8.355 1.00 0.00 ATOM 605 CD GLU 80 10.577 0.258 9.172 1.00 0.00 ATOM 606 OE1 GLU 80 11.209 -0.660 8.609 1.00 0.00 ATOM 607 OE2 GLU 80 10.249 0.224 10.378 1.00 0.00 ATOM 608 O GLU 80 12.086 3.961 6.272 1.00 0.00 ATOM 609 C GLU 80 10.885 3.808 6.496 1.00 0.00 ATOM 610 N GLY 81 10.134 4.710 7.128 1.00 0.00 ATOM 611 CA GLY 81 10.702 5.952 7.632 1.00 0.00 ATOM 612 O GLY 81 8.566 6.400 8.626 1.00 0.00 ATOM 613 C GLY 81 9.709 6.814 8.402 1.00 0.00 ATOM 614 N THR 82 10.149 8.007 8.813 1.00 0.00 ATOM 615 CA THR 82 9.322 8.964 9.558 1.00 0.00 ATOM 616 CB THR 82 10.100 9.588 10.732 1.00 0.00 ATOM 617 CG2 THR 82 9.232 10.599 11.467 1.00 0.00 ATOM 618 OG1 THR 82 10.492 8.558 11.648 1.00 0.00 ATOM 619 O THR 82 9.699 10.545 7.802 1.00 0.00 ATOM 620 C THR 82 8.895 10.066 8.602 1.00 0.00 ATOM 621 N ALA 83 7.636 10.482 8.696 1.00 0.00 ATOM 622 CA ALA 83 7.115 11.522 7.831 1.00 0.00 ATOM 623 CB ALA 83 5.641 11.283 7.545 1.00 0.00 ATOM 624 O ALA 83 6.840 13.008 9.653 1.00 0.00 ATOM 625 C ALA 83 7.281 12.854 8.519 1.00 0.00 ATOM 626 N ARG 84 7.907 13.811 7.839 1.00 0.00 ATOM 627 CA ARG 84 8.106 15.146 8.409 1.00 0.00 ATOM 628 CB ARG 84 9.598 15.460 8.535 1.00 0.00 ATOM 629 CG ARG 84 10.332 14.590 9.542 1.00 0.00 ATOM 630 CD ARG 84 11.803 14.965 9.627 1.00 0.00 ATOM 631 NE ARG 84 12.523 14.140 10.593 1.00 0.00 ATOM 632 CZ ARG 84 13.831 14.221 10.817 1.00 0.00 ATOM 633 NH1 ARG 84 14.400 13.430 11.715 1.00 0.00 ATOM 634 NH2 ARG 84 14.566 15.095 10.143 1.00 0.00 ATOM 635 O ARG 84 7.469 15.982 6.256 1.00 0.00 ATOM 636 C ARG 84 7.442 16.155 7.479 1.00 0.00 ATOM 637 N PRO 85 6.840 17.194 8.045 1.00 0.00 ATOM 638 CA PRO 85 6.192 18.207 7.226 1.00 0.00 ATOM 639 CB PRO 85 5.512 19.127 8.244 1.00 0.00 ATOM 640 CG PRO 85 6.332 18.984 9.482 1.00 0.00 ATOM 641 CD PRO 85 6.797 17.555 9.512 1.00 0.00 ATOM 642 O PRO 85 8.326 19.228 6.770 1.00 0.00 ATOM 643 C PRO 85 7.188 18.984 6.368 1.00 0.00 ATOM 644 N VAL 86 6.753 19.360 5.176 1.00 0.00 ATOM 645 CA VAL 86 7.575 20.188 4.292 1.00 0.00 ATOM 646 CB VAL 86 7.175 20.009 2.816 1.00 0.00 ATOM 647 CG1 VAL 86 7.339 18.559 2.391 1.00 0.00 ATOM 648 CG2 VAL 86 5.722 20.411 2.607 1.00 0.00 ATOM 649 O VAL 86 6.342 21.992 5.340 1.00 0.00 ATOM 650 C VAL 86 7.356 21.659 4.722 1.00 0.00 ATOM 651 N GLU 87 8.282 22.545 4.376 1.00 0.00 ATOM 652 CA GLU 87 8.134 23.962 4.723 1.00 0.00 ATOM 653 CB GLU 87 9.489 24.670 4.683 1.00 0.00 ATOM 654 CG GLU 87 10.494 24.144 5.694 1.00 0.00 ATOM 655 CD GLU 87 11.818 24.880 5.638 1.00 0.00 ATOM 656 OE1 GLU 87 11.984 25.735 4.742 1.00 0.00 ATOM 657 OE2 GLU 87 12.689 24.603 6.489 1.00 0.00 ATOM 658 O GLU 87 6.840 24.102 2.677 1.00 0.00 ATOM 659 C GLU 87 7.188 24.656 3.726 1.00 0.00 ATOM 660 N ASN 88 6.780 25.874 4.060 1.00 0.00 ATOM 661 CA ASN 88 5.914 26.656 3.182 1.00 0.00 ATOM 662 CB ASN 88 5.585 28.008 3.819 1.00 0.00 ATOM 663 CG ASN 88 4.609 27.886 4.973 1.00 0.00 ATOM 664 ND2 ASN 88 4.579 28.901 5.829 1.00 0.00 ATOM 665 OD1 ASN 88 3.895 26.891 5.091 1.00 0.00 ATOM 666 O ASN 88 5.935 26.860 0.776 1.00 0.00 ATOM 667 C ASN 88 6.582 26.926 1.820 1.00 0.00 ATOM 668 N ASP 89 7.873 27.232 1.839 1.00 0.00 ATOM 669 CA ASP 89 8.612 27.534 0.613 1.00 0.00 ATOM 670 CB ASP 89 10.087 27.788 0.927 1.00 0.00 ATOM 671 CG ASP 89 10.316 29.117 1.620 1.00 0.00 ATOM 672 OD1 ASP 89 9.377 29.943 1.645 1.00 0.00 ATOM 673 OD2 ASP 89 11.432 29.334 2.138 1.00 0.00 ATOM 674 O ASP 89 8.196 26.530 -1.531 1.00 0.00 ATOM 675 C ASP 89 8.512 26.357 -0.357 1.00 0.00 ATOM 676 N TYR 90 8.779 25.157 0.141 1.00 0.00 ATOM 677 CA TYR 90 8.703 23.982 -0.711 1.00 0.00 ATOM 678 CB TYR 90 9.091 22.726 0.074 1.00 0.00 ATOM 679 CG TYR 90 8.999 21.450 -0.731 1.00 0.00 ATOM 680 CD1 TYR 90 10.005 21.094 -1.620 1.00 0.00 ATOM 681 CD2 TYR 90 7.906 20.603 -0.598 1.00 0.00 ATOM 682 CE1 TYR 90 9.930 19.929 -2.359 1.00 0.00 ATOM 683 CE2 TYR 90 7.812 19.434 -1.330 1.00 0.00 ATOM 684 CZ TYR 90 8.837 19.102 -2.215 1.00 0.00 ATOM 685 OH TYR 90 8.759 17.942 -2.949 1.00 0.00 ATOM 686 O TYR 90 7.104 23.577 -2.459 1.00 0.00 ATOM 687 C TYR 90 7.287 23.777 -1.257 1.00 0.00 ATOM 688 N LEU 91 6.291 23.832 -0.377 1.00 0.00 ATOM 689 CA LEU 91 4.906 23.628 -0.792 1.00 0.00 ATOM 690 CB LEU 91 3.963 23.755 0.406 1.00 0.00 ATOM 691 CG LEU 91 2.474 23.549 0.123 1.00 0.00 ATOM 692 CD1 LEU 91 2.218 22.146 -0.409 1.00 0.00 ATOM 693 CD2 LEU 91 1.654 23.734 1.390 1.00 0.00 ATOM 694 O LEU 91 3.788 24.289 -2.825 1.00 0.00 ATOM 695 C LEU 91 4.446 24.642 -1.839 1.00 0.00 ATOM 696 N LYS 92 4.788 25.906 -1.622 1.00 0.00 ATOM 697 CA LYS 92 4.393 26.945 -2.564 1.00 0.00 ATOM 698 CB LYS 92 4.874 28.315 -2.082 1.00 0.00 ATOM 699 CG LYS 92 4.471 29.469 -2.987 1.00 0.00 ATOM 700 CD LYS 92 4.918 30.803 -2.414 1.00 0.00 ATOM 701 CE LYS 92 4.557 31.951 -3.341 1.00 0.00 ATOM 702 NZ LYS 92 5.013 33.263 -2.805 1.00 0.00 ATOM 703 O LYS 92 4.327 26.740 -4.942 1.00 0.00 ATOM 704 C LYS 92 5.000 26.664 -3.920 1.00 0.00 ATOM 705 N THR 93 6.289 26.358 -3.914 1.00 0.00 ATOM 706 CA THR 93 7.007 26.058 -5.141 1.00 0.00 ATOM 707 CB THR 93 8.435 25.558 -4.853 1.00 0.00 ATOM 708 CG2 THR 93 9.156 25.230 -6.150 1.00 0.00 ATOM 709 OG1 THR 93 9.167 26.574 -4.158 1.00 0.00 ATOM 710 O THR 93 6.030 25.138 -7.120 1.00 0.00 ATOM 711 C THR 93 6.280 24.973 -5.932 1.00 0.00 ATOM 712 N VAL 94 5.926 23.873 -5.273 1.00 0.00 ATOM 713 CA VAL 94 5.238 22.802 -5.982 1.00 0.00 ATOM 714 CB VAL 94 5.170 21.517 -5.135 1.00 0.00 ATOM 715 CG1 VAL 94 4.290 20.479 -5.814 1.00 0.00 ATOM 716 CG2 VAL 94 6.559 20.926 -4.952 1.00 0.00 ATOM 717 O VAL 94 3.391 22.866 -7.489 1.00 0.00 ATOM 718 C VAL 94 3.803 23.123 -6.364 1.00 0.00 ATOM 719 N PHE 95 3.042 23.662 -5.417 1.00 0.00 ATOM 720 CA PHE 95 1.641 23.993 -5.649 1.00 0.00 ATOM 721 CB PHE 95 1.088 24.825 -4.489 1.00 0.00 ATOM 722 CG PHE 95 -0.341 25.248 -4.675 1.00 0.00 ATOM 723 CD1 PHE 95 -1.377 24.359 -4.450 1.00 0.00 ATOM 724 CD2 PHE 95 -0.650 26.537 -5.077 1.00 0.00 ATOM 725 CE1 PHE 95 -2.693 24.750 -4.620 1.00 0.00 ATOM 726 CE2 PHE 95 -1.965 26.927 -5.247 1.00 0.00 ATOM 727 CZ PHE 95 -2.983 26.039 -5.022 1.00 0.00 ATOM 728 O PHE 95 0.653 24.390 -7.815 1.00 0.00 ATOM 729 C PHE 95 1.399 24.805 -6.926 1.00 0.00 ATOM 730 N ALA 96 2.028 25.965 -7.016 1.00 0.00 ATOM 731 CA ALA 96 1.830 26.806 -8.180 1.00 0.00 ATOM 732 CB ALA 96 2.524 28.145 -7.991 1.00 0.00 ATOM 733 O ALA 96 2.237 26.632 -10.539 1.00 0.00 ATOM 734 C ALA 96 2.397 26.145 -9.424 1.00 0.00 ATOM 735 N ASP 97 3.025 24.999 -9.217 1.00 0.00 ATOM 736 CA ASP 97 3.619 24.243 -10.300 1.00 0.00 ATOM 737 CB ASP 97 5.010 23.744 -9.905 1.00 0.00 ATOM 738 CG ASP 97 5.787 23.191 -11.084 1.00 0.00 ATOM 739 OD1 ASP 97 5.320 23.351 -12.231 1.00 0.00 ATOM 740 OD2 ASP 97 6.862 22.597 -10.861 1.00 0.00 ATOM 741 O ASP 97 3.176 21.902 -10.461 1.00 0.00 ATOM 742 C ASP 97 2.757 23.041 -10.646 1.00 0.00 ATOM 743 N ASN 98 1.545 23.300 -11.116 1.00 0.00 ATOM 744 CA ASN 98 0.630 22.237 -11.498 1.00 0.00 ATOM 745 CB ASN 98 0.261 21.384 -10.284 1.00 0.00 ATOM 746 CG ASN 98 1.366 20.423 -9.889 1.00 0.00 ATOM 747 ND2 ASN 98 1.381 20.030 -8.621 1.00 0.00 ATOM 748 OD1 ASN 98 2.194 20.041 -10.716 1.00 0.00 ATOM 749 O ASN 98 -1.046 23.919 -11.843 1.00 0.00 ATOM 750 C ASN 98 -0.667 22.776 -12.090 1.00 0.00 ATOM 751 N PRO 99 -1.371 21.945 -12.881 1.00 0.00 ATOM 752 CA PRO 99 -2.632 22.342 -13.525 1.00 0.00 ATOM 753 CB PRO 99 -3.376 21.019 -13.729 1.00 0.00 ATOM 754 CG PRO 99 -2.293 20.002 -13.872 1.00 0.00 ATOM 755 CD PRO 99 -1.197 20.424 -12.935 1.00 0.00 ATOM 756 O PRO 99 -3.809 23.023 -11.534 1.00 0.00 ATOM 757 C PRO 99 -3.488 23.299 -12.699 1.00 0.00 ATOM 758 N TYR 100 -3.868 24.416 -13.312 1.00 0.00 ATOM 759 CA TYR 100 -4.681 25.416 -12.638 1.00 0.00 ATOM 760 CB TYR 100 -5.110 26.510 -13.618 1.00 0.00 ATOM 761 CG TYR 100 -6.016 27.556 -13.012 1.00 0.00 ATOM 762 CD1 TYR 100 -5.497 28.582 -12.231 1.00 0.00 ATOM 763 CD2 TYR 100 -7.390 27.516 -13.220 1.00 0.00 ATOM 764 CE1 TYR 100 -6.318 29.543 -11.673 1.00 0.00 ATOM 765 CE2 TYR 100 -8.226 28.468 -12.670 1.00 0.00 ATOM 766 CZ TYR 100 -7.678 29.487 -11.890 1.00 0.00 ATOM 767 OH TYR 100 -8.498 30.443 -11.336 1.00 0.00 ATOM 768 O TYR 100 -6.323 25.118 -10.910 1.00 0.00 ATOM 769 C TYR 100 -5.947 24.804 -12.039 1.00 0.00 ATOM 770 N TYR 101 -6.610 23.931 -12.790 1.00 0.00 ATOM 771 CA TYR 101 -7.825 23.304 -12.283 1.00 0.00 ATOM 772 CB TYR 101 -8.442 22.396 -13.349 1.00 0.00 ATOM 773 CG TYR 101 -9.012 23.141 -14.535 1.00 0.00 ATOM 774 CD1 TYR 101 -9.241 24.510 -14.472 1.00 0.00 ATOM 775 CD2 TYR 101 -9.316 22.474 -15.715 1.00 0.00 ATOM 776 CE1 TYR 101 -9.761 25.198 -15.551 1.00 0.00 ATOM 777 CE2 TYR 101 -9.835 23.146 -16.804 1.00 0.00 ATOM 778 CZ TYR 101 -10.057 24.520 -16.714 1.00 0.00 ATOM 779 OH TYR 101 -10.575 25.205 -17.789 1.00 0.00 ATOM 780 O TYR 101 -8.392 22.285 -10.191 1.00 0.00 ATOM 781 C TYR 101 -7.528 22.460 -11.052 1.00 0.00 ATOM 782 N GLN 102 -6.311 21.931 -10.965 1.00 0.00 ATOM 783 CA GLN 102 -5.950 21.134 -9.800 1.00 0.00 ATOM 784 CB GLN 102 -4.649 20.370 -10.056 1.00 0.00 ATOM 785 CG GLN 102 -4.259 19.416 -8.938 1.00 0.00 ATOM 786 CD GLN 102 -5.278 18.314 -8.731 1.00 0.00 ATOM 787 OE1 GLN 102 -5.749 17.703 -9.690 1.00 0.00 ATOM 788 NE2 GLN 102 -5.621 18.056 -7.474 1.00 0.00 ATOM 789 O GLN 102 -6.140 21.712 -7.468 1.00 0.00 ATOM 790 C GLN 102 -5.755 22.055 -8.590 1.00 0.00 ATOM 791 N HIS 103 -5.167 23.226 -8.811 1.00 0.00 ATOM 792 CA HIS 103 -4.973 24.173 -7.715 1.00 0.00 ATOM 793 CB HIS 103 -4.287 25.444 -8.220 1.00 0.00 ATOM 794 CG HIS 103 -2.856 25.243 -8.612 1.00 0.00 ATOM 795 CD2 HIS 103 -1.869 24.187 -8.435 1.00 0.00 ATOM 796 ND1 HIS 103 -2.138 26.184 -9.318 1.00 0.00 ATOM 797 CE1 HIS 103 -0.891 25.722 -9.519 1.00 0.00 ATOM 798 NE2 HIS 103 -0.723 24.525 -8.992 1.00 0.00 ATOM 799 O HIS 103 -6.548 24.547 -5.913 1.00 0.00 ATOM 800 C HIS 103 -6.349 24.533 -7.131 1.00 0.00 ATOM 801 N ILE 104 -7.309 24.807 -8.008 1.00 0.00 ATOM 802 CA ILE 104 -8.654 25.155 -7.576 1.00 0.00 ATOM 803 CB ILE 104 -9.548 25.539 -8.769 1.00 0.00 ATOM 804 CG1 ILE 104 -9.073 26.853 -9.390 1.00 0.00 ATOM 805 CG2 ILE 104 -10.991 25.713 -8.318 1.00 0.00 ATOM 806 CD1 ILE 104 -9.721 27.170 -10.721 1.00 0.00 ATOM 807 O ILE 104 -10.012 24.151 -5.855 1.00 0.00 ATOM 808 C ILE 104 -9.317 23.976 -6.857 1.00 0.00 ATOM 809 N TYR 105 -9.100 22.774 -7.384 1.00 0.00 ATOM 810 CA TYR 105 -9.677 21.593 -6.770 1.00 0.00 ATOM 811 CB TYR 105 -9.316 20.342 -7.573 1.00 0.00 ATOM 812 CG TYR 105 -9.914 19.068 -7.022 1.00 0.00 ATOM 813 CD1 TYR 105 -11.260 18.775 -7.205 1.00 0.00 ATOM 814 CD2 TYR 105 -9.131 18.159 -6.320 1.00 0.00 ATOM 815 CE1 TYR 105 -11.815 17.613 -6.704 1.00 0.00 ATOM 816 CE2 TYR 105 -9.668 16.992 -5.813 1.00 0.00 ATOM 817 CZ TYR 105 -11.022 16.725 -6.011 1.00 0.00 ATOM 818 OH TYR 105 -11.573 15.566 -5.513 1.00 0.00 ATOM 819 O TYR 105 -9.905 20.871 -4.494 1.00 0.00 ATOM 820 C TYR 105 -9.181 21.386 -5.349 1.00 0.00 ATOM 821 N LYS 106 -7.935 21.781 -5.100 1.00 0.00 ATOM 822 CA LYS 106 -7.348 21.647 -3.770 1.00 0.00 ATOM 823 CB LYS 106 -5.911 22.171 -3.762 1.00 0.00 ATOM 824 CG LYS 106 -4.928 21.301 -4.528 1.00 0.00 ATOM 825 CD LYS 106 -3.525 21.884 -4.487 1.00 0.00 ATOM 826 CE LYS 106 -2.543 21.016 -5.257 1.00 0.00 ATOM 827 NZ LYS 106 -1.171 21.591 -5.251 1.00 0.00 ATOM 828 O LYS 106 -8.298 22.036 -1.597 1.00 0.00 ATOM 829 C LYS 106 -8.162 22.443 -2.751 1.00 0.00 ATOM 830 N ASP 107 -8.708 23.575 -3.193 1.00 0.00 ATOM 831 CA ASP 107 -9.513 24.437 -2.333 1.00 0.00 ATOM 832 CB ASP 107 -9.755 25.789 -3.007 1.00 0.00 ATOM 833 CG ASP 107 -8.516 26.662 -3.023 1.00 0.00 ATOM 834 OD1 ASP 107 -7.547 26.333 -2.308 1.00 0.00 ATOM 835 OD2 ASP 107 -8.514 27.677 -3.753 1.00 0.00 ATOM 836 O ASP 107 -11.424 24.042 -0.936 1.00 0.00 ATOM 837 C ASP 107 -10.871 23.836 -2.018 1.00 0.00 ATOM 838 N GLU 108 -11.396 23.100 -2.988 1.00 0.00 ATOM 839 CA GLU 108 -12.724 22.506 -2.913 1.00 0.00 ATOM 840 CB GLU 108 -13.116 21.899 -4.262 1.00 0.00 ATOM 841 CG GLU 108 -14.527 21.338 -4.303 1.00 0.00 ATOM 842 CD GLU 108 -14.887 20.763 -5.659 1.00 0.00 ATOM 843 OE1 GLU 108 -14.837 21.515 -6.655 1.00 0.00 ATOM 844 OE2 GLU 108 -15.221 19.561 -5.726 1.00 0.00 ATOM 845 O GLU 108 -13.929 21.402 -1.164 1.00 0.00 ATOM 846 C GLU 108 -12.956 21.389 -1.922 1.00 0.00 ATOM 847 N SER 109 -12.051 20.420 -1.919 1.00 0.00 ATOM 848 CA SER 109 -12.235 19.241 -1.103 1.00 0.00 ATOM 849 CB SER 109 -11.635 18.014 -1.791 1.00 0.00 ATOM 850 OG SER 109 -11.699 16.874 -0.950 1.00 0.00 ATOM 851 O SER 109 -10.436 19.206 0.452 1.00 0.00 ATOM 852 C SER 109 -11.647 19.184 0.283 1.00 0.00 ATOM 853 N SER 110 -12.527 19.082 1.272 1.00 0.00 ATOM 854 CA SER 110 -12.120 18.954 2.664 1.00 0.00 ATOM 855 CB SER 110 -13.244 19.411 3.596 1.00 0.00 ATOM 856 OG SER 110 -13.558 20.776 3.386 1.00 0.00 ATOM 857 O SER 110 -12.493 16.730 3.578 1.00 0.00 ATOM 858 C SER 110 -11.811 17.455 2.854 1.00 0.00 ATOM 859 N ASP 111 -10.753 17.030 2.172 1.00 0.00 ATOM 860 CA ASP 111 -10.278 15.645 2.149 1.00 0.00 ATOM 861 CB ASP 111 -8.762 15.602 1.948 1.00 0.00 ATOM 862 CG ASP 111 -8.228 14.188 1.842 1.00 0.00 ATOM 863 OD1 ASP 111 -9.040 13.241 1.897 1.00 0.00 ATOM 864 OD2 ASP 111 -6.998 14.026 1.702 1.00 0.00 ATOM 865 O ASP 111 -10.101 15.107 4.493 1.00 0.00 ATOM 866 C ASP 111 -10.516 14.767 3.381 1.00 0.00 ATOM 867 N THR 112 -11.179 13.634 3.139 1.00 0.00 ATOM 868 CA THR 112 -11.491 12.631 4.154 1.00 0.00 ATOM 869 CB THR 112 -10.350 12.492 5.179 1.00 0.00 ATOM 870 CG2 THR 112 -9.040 12.169 4.478 1.00 0.00 ATOM 871 OG1 THR 112 -10.198 13.721 5.900 1.00 0.00 ATOM 872 O THR 112 -13.196 11.962 5.655 1.00 0.00 ATOM 873 C THR 112 -12.728 12.879 4.990 1.00 0.00 ATOM 874 N MET 113 -13.256 14.099 4.998 1.00 0.00 ATOM 875 CA MET 113 -14.443 14.332 5.815 1.00 0.00 ATOM 876 CB MET 113 -14.615 15.827 6.094 1.00 0.00 ATOM 877 CG MET 113 -13.477 16.445 6.891 1.00 0.00 ATOM 878 SD MET 113 -13.310 15.726 8.537 1.00 0.00 ATOM 879 CE MET 113 -14.798 16.336 9.324 1.00 0.00 ATOM 880 O MET 113 -15.733 13.802 3.871 1.00 0.00 ATOM 881 C MET 113 -15.684 13.829 5.095 1.00 0.00 ATOM 882 N GLN 114 -16.673 13.398 5.864 1.00 0.00 ATOM 883 CA GLN 114 -17.922 12.934 5.279 1.00 0.00 ATOM 884 CB GLN 114 -18.813 12.303 6.350 1.00 0.00 ATOM 885 CG GLN 114 -20.124 11.748 5.818 1.00 0.00 ATOM 886 CD GLN 114 -20.898 10.974 6.867 1.00 0.00 ATOM 887 OE1 GLN 114 -20.443 10.820 8.001 1.00 0.00 ATOM 888 NE2 GLN 114 -22.074 10.484 6.493 1.00 0.00 ATOM 889 O GLN 114 -18.767 15.164 5.271 1.00 0.00 ATOM 890 C GLN 114 -18.658 14.121 4.652 1.00 0.00 ATOM 891 N VAL 115 -19.114 13.973 3.410 1.00 0.00 ATOM 892 CA VAL 115 -19.884 15.024 2.754 1.00 0.00 ATOM 893 CB VAL 115 -19.149 15.572 1.516 1.00 0.00 ATOM 894 CG1 VAL 115 -17.831 16.215 1.919 1.00 0.00 ATOM 895 CG2 VAL 115 -18.856 14.450 0.532 1.00 0.00 ATOM 896 O VAL 115 -21.245 13.144 2.132 1.00 0.00 ATOM 897 C VAL 115 -21.195 14.355 2.357 1.00 0.00 ATOM 898 N PHE 116 -22.259 15.139 2.294 1.00 0.00 ATOM 899 CA PHE 116 -23.565 14.581 2.006 1.00 0.00 ATOM 900 CB PHE 116 -24.667 15.507 2.524 1.00 0.00 ATOM 901 CG PHE 116 -24.790 15.528 4.021 1.00 0.00 ATOM 902 CD1 PHE 116 -24.215 16.545 4.762 1.00 0.00 ATOM 903 CD2 PHE 116 -25.478 14.529 4.688 1.00 0.00 ATOM 904 CE1 PHE 116 -24.326 16.563 6.140 1.00 0.00 ATOM 905 CE2 PHE 116 -25.590 14.547 6.065 1.00 0.00 ATOM 906 CZ PHE 116 -25.017 15.559 6.790 1.00 0.00 ATOM 907 O PHE 116 -24.826 13.591 0.265 1.00 0.00 ATOM 908 C PHE 116 -23.905 14.344 0.557 1.00 0.00 ATOM 909 N GLN 117 -23.167 14.971 -0.353 1.00 0.00 ATOM 910 CA GLN 117 -23.446 14.826 -1.773 1.00 0.00 ATOM 911 CB GLN 117 -24.660 15.668 -2.170 1.00 0.00 ATOM 912 CG GLN 117 -24.466 17.163 -1.986 1.00 0.00 ATOM 913 CD GLN 117 -25.716 17.957 -2.311 1.00 0.00 ATOM 914 OE1 GLN 117 -26.748 17.390 -2.664 1.00 0.00 ATOM 915 NE2 GLN 117 -25.625 19.276 -2.191 1.00 0.00 ATOM 916 O GLN 117 -21.531 16.185 -2.251 1.00 0.00 ATOM 917 C GLN 117 -22.274 15.275 -2.630 1.00 0.00 ATOM 918 N ILE 118 -22.122 14.647 -3.791 1.00 0.00 ATOM 919 CA ILE 118 -21.044 15.013 -4.696 1.00 0.00 ATOM 920 CB ILE 118 -21.015 14.102 -5.937 1.00 0.00 ATOM 921 CG1 ILE 118 -20.608 12.680 -5.545 1.00 0.00 ATOM 922 CG2 ILE 118 -20.016 14.625 -6.957 1.00 0.00 ATOM 923 CD1 ILE 118 -20.803 11.664 -6.648 1.00 0.00 ATOM 924 O ILE 118 -20.259 17.162 -5.429 1.00 0.00 ATOM 925 C ILE 118 -21.234 16.457 -5.161 1.00 0.00 ATOM 926 N TYR 119 -22.500 16.881 -5.236 1.00 0.00 ATOM 927 CA TYR 119 -22.854 18.223 -5.680 1.00 0.00 ATOM 928 CB TYR 119 -24.344 18.485 -5.463 1.00 0.00 ATOM 929 CG TYR 119 -24.799 19.855 -5.915 1.00 0.00 ATOM 930 CD1 TYR 119 -25.012 20.124 -7.261 1.00 0.00 ATOM 931 CD2 TYR 119 -25.013 20.872 -4.994 1.00 0.00 ATOM 932 CE1 TYR 119 -25.427 21.374 -7.683 1.00 0.00 ATOM 933 CE2 TYR 119 -25.428 22.128 -5.398 1.00 0.00 ATOM 934 CZ TYR 119 -25.635 22.372 -6.756 1.00 0.00 ATOM 935 OH TYR 119 -26.048 23.615 -7.174 1.00 0.00 ATOM 936 O TYR 119 -21.850 20.400 -5.577 1.00 0.00 ATOM 937 C TYR 119 -22.130 19.357 -4.978 1.00 0.00 ATOM 938 N ALA 120 -21.844 19.160 -3.697 1.00 0.00 ATOM 939 CA ALA 120 -21.135 20.144 -2.898 1.00 0.00 ATOM 940 CB ALA 120 -20.909 19.620 -1.490 1.00 0.00 ATOM 941 O ALA 120 -19.366 21.606 -3.629 1.00 0.00 ATOM 942 C ALA 120 -19.774 20.447 -3.540 1.00 0.00 ATOM 943 N GLY 121 -19.089 19.399 -4.001 1.00 0.00 ATOM 944 CA GLY 121 -17.779 19.544 -4.634 1.00 0.00 ATOM 945 O GLY 121 -17.177 21.315 -6.133 1.00 0.00 ATOM 946 C GLY 121 -17.885 20.331 -5.928 1.00 0.00 ATOM 947 N HIS 122 -18.778 19.895 -6.806 1.00 0.00 ATOM 948 CA HIS 122 -18.950 20.566 -8.091 1.00 0.00 ATOM 949 CB HIS 122 -20.023 19.861 -8.923 1.00 0.00 ATOM 950 CG HIS 122 -20.258 20.489 -10.262 1.00 0.00 ATOM 951 CD2 HIS 122 -21.319 21.283 -10.864 1.00 0.00 ATOM 952 ND1 HIS 122 -19.355 20.392 -11.298 1.00 0.00 ATOM 953 CE1 HIS 122 -19.840 21.052 -12.364 1.00 0.00 ATOM 954 NE2 HIS 122 -21.018 21.589 -12.112 1.00 0.00 ATOM 955 O HIS 122 -18.912 22.871 -8.739 1.00 0.00 ATOM 956 C HIS 122 -19.377 22.034 -7.975 1.00 0.00 ATOM 957 N GLY 123 -20.254 22.340 -7.021 1.00 0.00 ATOM 958 CA GLY 123 -20.724 23.711 -6.820 1.00 0.00 ATOM 959 O GLY 123 -19.370 25.683 -7.019 1.00 0.00 ATOM 960 C GLY 123 -19.560 24.616 -6.438 1.00 0.00 ATOM 961 N PHE 124 -18.797 24.177 -5.440 1.00 0.00 ATOM 962 CA PHE 124 -17.659 24.936 -4.955 1.00 0.00 ATOM 963 CB PHE 124 -16.991 24.210 -3.785 1.00 0.00 ATOM 964 CG PHE 124 -17.821 24.185 -2.534 1.00 0.00 ATOM 965 CD1 PHE 124 -18.905 25.031 -2.388 1.00 0.00 ATOM 966 CD2 PHE 124 -17.515 23.314 -1.502 1.00 0.00 ATOM 967 CE1 PHE 124 -19.668 25.009 -1.236 1.00 0.00 ATOM 968 CE2 PHE 124 -18.278 23.292 -0.349 1.00 0.00 ATOM 969 CZ PHE 124 -19.351 24.135 -0.214 1.00 0.00 ATOM 970 O PHE 124 -16.070 26.213 -6.184 1.00 0.00 ATOM 971 C PHE 124 -16.624 25.123 -6.047 1.00 0.00 ATOM 972 N TYR 125 -16.367 24.075 -6.830 1.00 0.00 ATOM 973 CA TYR 125 -15.380 24.171 -7.902 1.00 0.00 ATOM 974 CB TYR 125 -15.323 22.864 -8.697 1.00 0.00 ATOM 975 CG TYR 125 -14.352 22.894 -9.854 1.00 0.00 ATOM 976 CD1 TYR 125 -12.990 22.718 -9.644 1.00 0.00 ATOM 977 CD2 TYR 125 -14.798 23.097 -11.154 1.00 0.00 ATOM 978 CE1 TYR 125 -12.094 22.741 -10.696 1.00 0.00 ATOM 979 CE2 TYR 125 -13.916 23.124 -12.217 1.00 0.00 ATOM 980 CZ TYR 125 -12.555 22.946 -11.978 1.00 0.00 ATOM 981 OH TYR 125 -11.665 22.970 -13.027 1.00 0.00 ATOM 982 O TYR 125 -14.897 26.118 -9.201 1.00 0.00 ATOM 983 C TYR 125 -15.744 25.299 -8.850 1.00 0.00 ATOM 984 N HIS 126 -17.007 25.345 -9.257 1.00 0.00 ATOM 985 CA HIS 126 -17.474 26.384 -10.170 1.00 0.00 ATOM 986 CB HIS 126 -18.942 26.157 -10.536 1.00 0.00 ATOM 987 CG HIS 126 -19.514 27.217 -11.426 1.00 0.00 ATOM 988 CD2 HIS 126 -20.432 28.333 -11.254 1.00 0.00 ATOM 989 ND1 HIS 126 -19.206 27.308 -12.766 1.00 0.00 ATOM 990 CE1 HIS 126 -19.868 28.352 -13.297 1.00 0.00 ATOM 991 NE2 HIS 126 -20.606 28.971 -12.394 1.00 0.00 ATOM 992 O HIS 126 -16.839 28.703 -10.104 1.00 0.00 ATOM 993 C HIS 126 -17.341 27.752 -9.508 1.00 0.00 ATOM 994 N SER 127 -17.801 27.838 -8.267 1.00 0.00 ATOM 995 CA SER 127 -17.760 29.078 -7.513 1.00 0.00 ATOM 996 CB SER 127 -18.286 28.859 -6.092 1.00 0.00 ATOM 997 OG SER 127 -19.663 28.528 -6.104 1.00 0.00 ATOM 998 O SER 127 -16.129 30.842 -7.568 1.00 0.00 ATOM 999 C SER 127 -16.346 29.643 -7.394 1.00 0.00 ATOM 1000 N LEU 128 -15.381 28.782 -7.095 1.00 0.00 ATOM 1001 CA LEU 128 -14.003 29.233 -6.962 1.00 0.00 ATOM 1002 CB LEU 128 -13.174 28.202 -6.193 1.00 0.00 ATOM 1003 CG LEU 128 -13.560 27.974 -4.731 1.00 0.00 ATOM 1004 CD1 LEU 128 -12.728 26.856 -4.123 1.00 0.00 ATOM 1005 CD2 LEU 128 -13.335 29.235 -3.913 1.00 0.00 ATOM 1006 O LEU 128 -12.543 30.335 -8.507 1.00 0.00 ATOM 1007 C LEU 128 -13.360 29.435 -8.328 1.00 0.00 ATOM 1008 N THR 129 -13.758 28.604 -9.288 1.00 0.00 ATOM 1009 CA THR 129 -13.231 28.655 -10.648 1.00 0.00 ATOM 1010 CB THR 129 -13.999 27.706 -11.586 1.00 0.00 ATOM 1011 CG2 THR 129 -13.522 27.874 -13.021 1.00 0.00 ATOM 1012 OG1 THR 129 -13.781 26.348 -11.180 1.00 0.00 ATOM 1013 O THR 129 -12.580 30.353 -12.201 1.00 0.00 ATOM 1014 C THR 129 -13.317 30.041 -11.267 1.00 0.00 ATOM 1015 N GLN 130 -14.219 30.872 -10.759 1.00 0.00 ATOM 1016 CA GLN 130 -14.354 32.218 -11.290 1.00 0.00 ATOM 1017 CB GLN 130 -15.780 32.456 -11.790 1.00 0.00 ATOM 1018 CG GLN 130 -16.177 31.586 -12.972 1.00 0.00 ATOM 1019 CD GLN 130 -17.613 31.810 -13.405 1.00 0.00 ATOM 1020 OE1 GLN 130 -18.247 32.786 -13.002 1.00 0.00 ATOM 1021 NE2 GLN 130 -18.128 30.907 -14.231 1.00 0.00 ATOM 1022 O GLN 130 -13.980 34.481 -10.547 1.00 0.00 ATOM 1023 C GLN 130 -14.050 33.292 -10.238 1.00 0.00 ATOM 1024 N GLY 131 -13.863 32.863 -8.995 1.00 0.00 ATOM 1025 CA GLY 131 -13.515 33.782 -7.917 1.00 0.00 ATOM 1026 O GLY 131 -11.598 35.231 -7.773 1.00 0.00 ATOM 1027 C GLY 131 -12.023 34.111 -8.055 1.00 0.00 ATOM 1028 N HIS 132 -11.245 33.124 -8.501 1.00 0.00 ATOM 1029 CA HIS 132 -9.797 33.256 -8.703 1.00 0.00 ATOM 1030 CB HIS 132 -9.088 31.945 -8.361 1.00 0.00 ATOM 1031 CG HIS 132 -9.188 31.561 -6.918 1.00 0.00 ATOM 1032 CD2 HIS 132 -9.884 30.529 -6.164 1.00 0.00 ATOM 1033 ND1 HIS 132 -8.527 32.243 -5.919 1.00 0.00 ATOM 1034 CE1 HIS 132 -8.811 31.668 -4.736 1.00 0.00 ATOM 1035 NE2 HIS 132 -9.624 30.640 -4.876 1.00 0.00 ATOM 1036 O HIS 132 -8.418 34.029 -10.513 1.00 0.00 ATOM 1037 C HIS 132 -9.516 33.605 -10.159 1.00 0.00 ATOM 1038 N LYS 133 -10.530 33.392 -10.985 1.00 0.00 ATOM 1039 CA LYS 133 -10.504 33.618 -12.428 1.00 0.00 ATOM 1040 CB LYS 133 -11.808 34.272 -12.891 1.00 0.00 ATOM 1041 CG LYS 133 -11.911 34.453 -14.396 1.00 0.00 ATOM 1042 CD LYS 133 -12.088 33.118 -15.103 1.00 0.00 ATOM 1043 CE LYS 133 -12.303 33.308 -16.596 1.00 0.00 ATOM 1044 NZ LYS 133 -12.440 32.007 -17.307 1.00 0.00 ATOM 1045 O LYS 133 -8.770 34.123 -14.010 1.00 0.00 ATOM 1046 C LYS 133 -9.424 34.511 -13.041 1.00 0.00 ATOM 1047 N TYR 134 -9.232 35.700 -12.482 1.00 0.00 ATOM 1048 CA TYR 134 -8.272 36.652 -13.040 1.00 0.00 ATOM 1049 CB TYR 134 -8.927 38.021 -13.236 1.00 0.00 ATOM 1050 CG TYR 134 -10.117 38.003 -14.169 1.00 0.00 ATOM 1051 CD1 TYR 134 -11.413 38.053 -13.672 1.00 0.00 ATOM 1052 CD2 TYR 134 -9.941 37.936 -15.545 1.00 0.00 ATOM 1053 CE1 TYR 134 -12.505 38.037 -14.516 1.00 0.00 ATOM 1054 CE2 TYR 134 -11.021 37.918 -16.405 1.00 0.00 ATOM 1055 CZ TYR 134 -12.312 37.969 -15.879 1.00 0.00 ATOM 1056 OH TYR 134 -13.398 37.953 -16.722 1.00 0.00 ATOM 1057 O TYR 134 -6.802 38.090 -11.804 1.00 0.00 ATOM 1058 C TYR 134 -7.003 36.953 -12.240 1.00 0.00 ATOM 1059 N ILE 135 -6.137 35.957 -12.069 1.00 0.00 ATOM 1060 CA ILE 135 -4.904 36.189 -11.335 1.00 0.00 ATOM 1061 CB ILE 135 -5.184 36.639 -9.889 1.00 0.00 ATOM 1062 CG1 ILE 135 -3.903 37.161 -9.236 1.00 0.00 ATOM 1063 CG2 ILE 135 -5.707 35.474 -9.062 1.00 0.00 ATOM 1064 CD1 ILE 135 -3.383 38.441 -9.850 1.00 0.00 ATOM 1065 O ILE 135 -3.186 34.680 -12.105 1.00 0.00 ATOM 1066 C ILE 135 -4.007 34.969 -11.228 1.00 0.00 ATOM 1067 N PHE 136 -4.166 34.260 -10.122 1.00 0.00 ATOM 1068 CA PHE 136 -3.409 33.053 -9.830 1.00 0.00 ATOM 1069 CB PHE 136 -1.933 33.389 -9.605 1.00 0.00 ATOM 1070 CG PHE 136 -1.696 34.351 -8.476 1.00 0.00 ATOM 1071 CD1 PHE 136 -1.450 33.888 -7.195 1.00 0.00 ATOM 1072 CD2 PHE 136 -1.715 35.716 -8.695 1.00 0.00 ATOM 1073 CE1 PHE 136 -1.231 34.772 -6.156 1.00 0.00 ATOM 1074 CE2 PHE 136 -1.496 36.601 -7.656 1.00 0.00 ATOM 1075 CZ PHE 136 -1.254 36.135 -6.391 1.00 0.00 ATOM 1076 O PHE 136 -4.326 33.224 -7.630 1.00 0.00 ATOM 1077 C PHE 136 -4.037 32.481 -8.572 1.00 0.00 ATOM 1078 N SER 137 -4.255 31.173 -8.561 1.00 0.00 ATOM 1079 CA SER 137 -4.878 30.530 -7.417 1.00 0.00 ATOM 1080 CB SER 137 -5.183 29.063 -7.726 1.00 0.00 ATOM 1081 OG SER 137 -5.736 28.408 -6.598 1.00 0.00 ATOM 1082 O SER 137 -2.821 30.157 -6.229 1.00 0.00 ATOM 1083 C SER 137 -3.981 30.565 -6.183 1.00 0.00 ATOM 1084 N ILE 138 -4.507 31.080 -5.065 1.00 0.00 ATOM 1085 CA ILE 138 -3.758 31.173 -3.807 1.00 0.00 ATOM 1086 CB ILE 138 -4.527 31.989 -2.752 1.00 0.00 ATOM 1087 CG1 ILE 138 -5.857 31.310 -2.419 1.00 0.00 ATOM 1088 CG2 ILE 138 -4.815 33.390 -3.267 1.00 0.00 ATOM 1089 CD1 ILE 138 -6.583 31.933 -1.247 1.00 0.00 ATOM 1090 O ILE 138 -4.291 28.866 -3.414 1.00 0.00 ATOM 1091 C ILE 138 -3.494 29.787 -3.217 1.00 0.00 ATOM 1092 N GLY 139 -2.383 29.646 -2.499 1.00 0.00 ATOM 1093 CA GLY 139 -2.065 28.383 -1.839 1.00 0.00 ATOM 1094 O GLY 139 -2.965 29.173 0.245 1.00 0.00 ATOM 1095 C GLY 139 -2.966 28.282 -0.607 1.00 0.00 ATOM 1096 N GLN 140 -3.774 27.215 -0.520 1.00 0.00 ATOM 1097 CA GLN 140 -4.659 27.044 0.633 1.00 0.00 ATOM 1098 CB GLN 140 -5.595 25.853 0.418 1.00 0.00 ATOM 1099 CG GLN 140 -6.573 25.617 1.558 1.00 0.00 ATOM 1100 CD GLN 140 -7.569 24.516 1.254 1.00 0.00 ATOM 1101 OE1 GLN 140 -7.579 23.961 0.156 1.00 0.00 ATOM 1102 NE2 GLN 140 -8.412 24.196 2.228 1.00 0.00 ATOM 1103 O GLN 140 -2.782 26.083 1.776 1.00 0.00 ATOM 1104 C GLN 140 -3.783 26.798 1.859 1.00 0.00 ATOM 1105 N GLY 141 -4.148 27.392 2.985 1.00 0.00 ATOM 1106 CA GLY 141 -3.396 27.194 4.214 1.00 0.00 ATOM 1107 O GLY 141 -2.560 25.192 5.267 1.00 0.00 ATOM 1108 C GLY 141 -3.466 25.707 4.623 1.00 0.00 ATOM 1109 N GLU 142 -4.541 25.017 4.241 1.00 0.00 ATOM 1110 CA GLU 142 -4.687 23.601 4.600 1.00 0.00 ATOM 1111 CB GLU 142 -6.167 23.222 4.693 1.00 0.00 ATOM 1112 CG GLU 142 -6.934 23.978 5.765 1.00 0.00 ATOM 1113 CD GLU 142 -6.415 23.697 7.162 1.00 0.00 ATOM 1114 OE1 GLU 142 -6.232 22.509 7.500 1.00 0.00 ATOM 1115 OE2 GLU 142 -6.191 24.666 7.918 1.00 0.00 ATOM 1116 O GLU 142 -4.399 21.432 3.596 1.00 0.00 ATOM 1117 C GLU 142 -4.058 22.615 3.609 1.00 0.00 ATOM 1118 N HIS 143 -3.143 23.089 2.778 1.00 0.00 ATOM 1119 CA HIS 143 -2.519 22.189 1.822 1.00 0.00 ATOM 1120 CB HIS 143 -2.715 22.704 0.394 1.00 0.00 ATOM 1121 CG HIS 143 -2.142 21.805 -0.656 1.00 0.00 ATOM 1122 CD2 HIS 143 -2.639 20.694 -1.456 1.00 0.00 ATOM 1123 ND1 HIS 143 -0.842 21.911 -1.096 1.00 0.00 ATOM 1124 CE1 HIS 143 -0.620 20.974 -2.036 1.00 0.00 ATOM 1125 NE2 HIS 143 -1.695 20.241 -2.257 1.00 0.00 ATOM 1126 O HIS 143 -0.423 23.137 2.438 1.00 0.00 ATOM 1127 C HIS 143 -1.034 22.118 2.139 1.00 0.00 ATOM 1128 N SER 144 -0.461 20.917 2.099 1.00 0.00 ATOM 1129 CA SER 144 0.953 20.758 2.396 1.00 0.00 ATOM 1130 CB SER 144 1.188 20.772 3.908 1.00 0.00 ATOM 1131 OG SER 144 2.573 20.815 4.209 1.00 0.00 ATOM 1132 O SER 144 1.103 18.866 0.894 1.00 0.00 ATOM 1133 C SER 144 1.565 19.461 1.879 1.00 0.00 ATOM 1134 N GLU 145 2.624 19.022 2.542 1.00 0.00 ATOM 1135 CA GLU 145 3.279 17.803 2.128 1.00 0.00 ATOM 1136 CB GLU 145 4.162 18.060 0.904 1.00 0.00 ATOM 1137 CG GLU 145 5.349 18.969 1.175 1.00 0.00 ATOM 1138 CD GLU 145 4.979 20.438 1.129 1.00 0.00 ATOM 1139 OE1 GLU 145 3.821 20.749 0.775 1.00 0.00 ATOM 1140 OE2 GLU 145 5.845 21.281 1.445 1.00 0.00 ATOM 1141 O GLU 145 4.396 17.829 4.251 1.00 0.00 ATOM 1142 C GLU 145 4.167 17.215 3.201 1.00 0.00 ATOM 1143 N VAL 146 4.665 16.014 2.928 1.00 0.00 ATOM 1144 CA VAL 146 5.527 15.312 3.851 1.00 0.00 ATOM 1145 CB VAL 146 4.772 14.184 4.581 1.00 0.00 ATOM 1146 CG1 VAL 146 3.650 14.759 5.432 1.00 0.00 ATOM 1147 CG2 VAL 146 4.166 13.213 3.579 1.00 0.00 ATOM 1148 O VAL 146 6.622 14.331 1.938 1.00 0.00 ATOM 1149 C VAL 146 6.700 14.686 3.126 1.00 0.00 ATOM 1150 N ARG 147 7.798 14.557 3.853 1.00 0.00 ATOM 1151 CA ARG 147 8.989 13.921 3.335 1.00 0.00 ATOM 1152 CB ARG 147 10.173 14.888 3.376 1.00 0.00 ATOM 1153 CG ARG 147 11.436 14.350 2.723 1.00 0.00 ATOM 1154 CD ARG 147 12.540 15.396 2.710 1.00 0.00 ATOM 1155 NE ARG 147 13.109 15.606 4.041 1.00 0.00 ATOM 1156 CZ ARG 147 13.933 16.600 4.351 1.00 0.00 ATOM 1157 NH1 ARG 147 14.401 16.713 5.587 1.00 0.00 ATOM 1158 NH2 ARG 147 14.292 17.479 3.425 1.00 0.00 ATOM 1159 O ARG 147 9.302 12.888 5.482 1.00 0.00 ATOM 1160 C ARG 147 9.201 12.733 4.260 1.00 0.00 ATOM 1161 N ALA 148 9.241 11.545 3.685 1.00 0.00 ATOM 1162 CA ALA 148 9.442 10.329 4.456 1.00 0.00 ATOM 1163 CB ALA 148 8.628 9.186 3.868 1.00 0.00 ATOM 1164 O ALA 148 11.489 9.716 3.366 1.00 0.00 ATOM 1165 C ALA 148 10.923 9.952 4.429 1.00 0.00 TER END