PFRMAT TS TARGET T0602 AUTHOR SAM-T06-server METHOD The SAM-T06 server uses methods similar to SAM_T04 in CASP6 and METHOD the SAM-T02 method in CASP5. METHOD METHOD We start with a fully automated method: METHOD METHOD Use the SAM-T2K and SAM-T04 methods for finding homologs of the METHOD target and aligning them. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignments. Different neural nets are used for the METHOD SAM-T2K alignments and the SAM-T04 alignments. METHOD We currently use 8 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 METHOD We make 2-track HMMs with each alphabet (1.0 amino acid + 0.3 local structure) METHOD and use them to score a template library of 6400 (t04) or 9900 (t2k) templates 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 We also made a few 3-track HMMs (AA, str2, CB_burial_14_7 and METHOD AA, str2, near-backbone-11) for finding and aligning more remote METHOD homologs. METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence (for early targets, only METHOD t2k template library was searched this way). METHOD METHOD All the logs of e-values were combined in a weighted average (with METHOD rather arbitrary weights, since we did not have time to METHOD optimize them), and the best templates ranked. Ranking was METHOD separate for predictions from the t2k and t04 multiple alignments. 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. METHOD METHOD Then the "undertaker" program (named because it optimizes burial) METHOD is used to try to combine the alignments and the fragments into METHOD a consistent 3D model. No single alignment or parent template METHOD was used, though in many cases one had much more influence than METHOD the others. The alignment scores were not passed to undertaker, METHOD but were used only to pick the set of alignments and fragments METHOD that undertaker would see. Helix and strand constraints METHOD generated from the secondary-structure predictions are passed to METHOD undertaker to use in the cost function. 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. REMARK 6 REMARK 6 T0602 model 3 Wed Jun 23 20:04:36 2010 MODEL 3 PARENT N/A ATOM 2 N ARG 6 14.649 -0.397 13.053 1.00 0.00 ATOM 3 CA ARG 6 14.145 0.879 12.556 1.00 0.00 ATOM 4 CB ARG 6 15.189 1.981 12.752 1.00 0.00 ATOM 5 CG ARG 6 16.428 1.822 11.884 1.00 0.00 ATOM 6 CD ARG 6 17.474 2.873 12.218 1.00 0.00 ATOM 7 NE ARG 6 18.634 2.793 11.335 1.00 0.00 ATOM 8 CZ ARG 6 19.653 1.960 11.515 1.00 0.00 ATOM 9 NH1 ARG 6 20.666 1.956 10.659 1.00 0.00 ATOM 10 NH2 ARG 6 19.659 1.132 12.550 1.00 0.00 ATOM 11 O ARG 6 13.174 1.338 10.395 1.00 0.00 ATOM 12 C ARG 6 13.822 0.566 11.095 1.00 0.00 ATOM 13 N HIS 7 14.277 -0.600 10.652 1.00 0.00 ATOM 14 CA HIS 7 14.024 -1.071 9.303 1.00 0.00 ATOM 15 CB HIS 7 15.268 -1.758 8.734 1.00 0.00 ATOM 16 CG HIS 7 16.442 -0.845 8.573 1.00 0.00 ATOM 17 CD2 HIS 7 17.670 -0.590 9.313 1.00 0.00 ATOM 18 ND1 HIS 7 16.558 0.043 7.524 1.00 0.00 ATOM 19 CE1 HIS 7 17.712 0.722 7.650 1.00 0.00 ATOM 20 NE2 HIS 7 18.385 0.347 8.721 1.00 0.00 ATOM 21 O HIS 7 12.042 -2.103 8.418 1.00 0.00 ATOM 22 C HIS 7 12.828 -2.014 9.362 1.00 0.00 ATOM 23 N GLN 8 12.697 -2.725 10.477 1.00 0.00 ATOM 24 CA GLN 8 11.579 -3.644 10.665 1.00 0.00 ATOM 25 CB GLN 8 11.855 -4.591 11.835 1.00 0.00 ATOM 26 CG GLN 8 10.787 -5.653 12.037 1.00 0.00 ATOM 27 CD GLN 8 10.701 -6.623 10.876 1.00 0.00 ATOM 28 OE1 GLN 8 11.693 -7.247 10.500 1.00 0.00 ATOM 29 NE2 GLN 8 9.510 -6.754 10.302 1.00 0.00 ATOM 30 O GLN 8 9.273 -3.159 10.263 1.00 0.00 ATOM 31 C GLN 8 10.289 -2.869 10.898 1.00 0.00 ATOM 32 N HIS 9 10.319 -1.891 11.802 1.00 0.00 ATOM 33 CA HIS 9 9.128 -1.092 12.060 1.00 0.00 ATOM 34 CB HIS 9 9.419 -0.022 13.115 1.00 0.00 ATOM 35 CG HIS 9 9.621 -0.572 14.492 1.00 0.00 ATOM 36 CD2 HIS 9 10.725 -0.620 15.440 1.00 0.00 ATOM 37 ND1 HIS 9 8.626 -1.226 15.187 1.00 0.00 ATOM 38 CE1 HIS 9 9.103 -1.601 16.387 1.00 0.00 ATOM 39 NE2 HIS 9 10.363 -1.241 16.544 1.00 0.00 ATOM 40 O HIS 9 7.481 -0.309 10.499 1.00 0.00 ATOM 41 C HIS 9 8.673 -0.469 10.733 1.00 0.00 ATOM 42 N LEU 10 9.620 -0.134 9.859 1.00 0.00 ATOM 43 CA LEU 10 9.272 0.438 8.554 1.00 0.00 ATOM 44 CB LEU 10 10.538 0.797 7.773 1.00 0.00 ATOM 45 CG LEU 10 10.327 1.423 6.392 1.00 0.00 ATOM 46 CD1 LEU 10 9.554 2.728 6.506 1.00 0.00 ATOM 47 CD2 LEU 10 11.660 1.657 5.699 1.00 0.00 ATOM 48 O LEU 10 7.428 -0.123 7.122 1.00 0.00 ATOM 49 C LEU 10 8.410 -0.524 7.734 1.00 0.00 ATOM 50 N LEU 11 8.783 -1.793 7.708 1.00 0.00 ATOM 51 CA LEU 11 8.017 -2.766 6.958 1.00 0.00 ATOM 52 CB LEU 11 8.813 -4.061 6.788 1.00 0.00 ATOM 53 CG LEU 11 8.118 -5.189 6.023 1.00 0.00 ATOM 54 CD1 LEU 11 7.786 -4.752 4.605 1.00 0.00 ATOM 55 CD2 LEU 11 8.985 -6.438 6.004 1.00 0.00 ATOM 56 O LEU 11 5.641 -2.809 7.139 1.00 0.00 ATOM 57 C LEU 11 6.713 -3.005 7.690 1.00 0.00 ATOM 58 N SER 12 6.816 -3.393 8.951 1.00 0.00 ATOM 59 CA SER 12 5.651 -3.686 9.778 1.00 0.00 ATOM 60 CB SER 12 6.060 -3.843 11.244 1.00 0.00 ATOM 61 OG SER 12 6.539 -2.618 11.772 1.00 0.00 ATOM 62 O SER 12 3.362 -2.999 9.848 1.00 0.00 ATOM 63 C SER 12 4.528 -2.652 9.714 1.00 0.00 ATOM 64 N GLU 13 4.865 -1.383 9.523 1.00 0.00 ATOM 65 CA GLU 13 3.823 -0.360 9.458 1.00 0.00 ATOM 66 CB GLU 13 4.442 1.039 9.506 1.00 0.00 ATOM 67 CG GLU 13 5.052 1.402 10.849 1.00 0.00 ATOM 68 CD GLU 13 5.724 2.760 10.834 1.00 0.00 ATOM 69 OE1 GLU 13 5.877 3.337 9.736 1.00 0.00 ATOM 70 OE2 GLU 13 6.101 3.249 11.920 1.00 0.00 ATOM 71 O GLU 13 1.756 -0.615 8.272 1.00 0.00 ATOM 72 C GLU 13 2.982 -0.522 8.199 1.00 0.00 ATOM 73 N TYR 14 3.642 -0.569 7.046 1.00 0.00 ATOM 74 CA TYR 14 2.954 -0.731 5.773 1.00 0.00 ATOM 75 CB TYR 14 3.948 -0.646 4.611 1.00 0.00 ATOM 76 CG TYR 14 4.469 0.751 4.353 1.00 0.00 ATOM 77 CD1 TYR 14 3.964 1.838 5.053 1.00 0.00 ATOM 78 CD2 TYR 14 5.464 0.975 3.410 1.00 0.00 ATOM 79 CE1 TYR 14 4.434 3.118 4.822 1.00 0.00 ATOM 80 CE2 TYR 14 5.946 2.247 3.167 1.00 0.00 ATOM 81 CZ TYR 14 5.421 3.322 3.883 1.00 0.00 ATOM 82 OH TYR 14 5.890 4.594 3.653 1.00 0.00 ATOM 83 O TYR 14 1.183 -2.155 5.012 1.00 0.00 ATOM 84 C TYR 14 2.198 -2.043 5.700 1.00 0.00 ATOM 85 N GLN 15 2.715 -3.041 6.404 1.00 0.00 ATOM 86 CA GLN 15 2.051 -4.320 6.452 1.00 0.00 ATOM 87 CB GLN 15 2.905 -5.341 7.207 1.00 0.00 ATOM 88 CG GLN 15 4.298 -5.530 6.630 1.00 0.00 ATOM 89 CD GLN 15 4.941 -6.828 7.075 1.00 0.00 ATOM 90 OE1 GLN 15 5.182 -7.037 8.264 1.00 0.00 ATOM 91 NE2 GLN 15 5.222 -7.706 6.119 1.00 0.00 ATOM 92 O GLN 15 -0.332 -4.313 6.625 1.00 0.00 ATOM 93 C GLN 15 0.737 -3.971 7.125 1.00 0.00 ATOM 94 N GLN 16 0.830 -3.275 8.263 1.00 0.00 ATOM 95 CA GLN 16 -0.343 -2.870 9.024 1.00 0.00 ATOM 96 CB GLN 16 0.074 -2.109 10.285 1.00 0.00 ATOM 97 CG GLN 16 0.740 -2.976 11.340 1.00 0.00 ATOM 98 CD GLN 16 1.242 -2.171 12.523 1.00 0.00 ATOM 99 OE1 GLN 16 1.591 -0.999 12.384 1.00 0.00 ATOM 100 NE2 GLN 16 1.279 -2.799 13.693 1.00 0.00 ATOM 101 O GLN 16 -2.527 -2.143 8.412 1.00 0.00 ATOM 102 C GLN 16 -1.324 -2.009 8.245 1.00 0.00 ATOM 103 N ILE 17 -0.826 -1.103 7.415 1.00 0.00 ATOM 104 CA ILE 17 -1.729 -0.266 6.632 1.00 0.00 ATOM 105 CB ILE 17 -0.974 0.885 5.943 1.00 0.00 ATOM 106 CG1 ILE 17 -0.786 2.057 6.910 1.00 0.00 ATOM 107 CG2 ILE 17 -1.694 1.310 4.671 1.00 0.00 ATOM 108 CD1 ILE 17 0.052 3.184 6.349 1.00 0.00 ATOM 109 O ILE 17 -3.659 -1.111 5.506 1.00 0.00 ATOM 110 C ILE 17 -2.443 -1.137 5.618 1.00 0.00 ATOM 111 N LEU 18 -1.665 -1.909 4.875 1.00 0.00 ATOM 112 CA LEU 18 -2.217 -2.793 3.878 1.00 0.00 ATOM 113 CB LEU 18 -1.114 -3.643 3.245 1.00 0.00 ATOM 114 CG LEU 18 -1.519 -4.491 2.037 1.00 0.00 ATOM 115 CD1 LEU 18 -0.295 -4.909 1.239 1.00 0.00 ATOM 116 CD2 LEU 18 -2.307 -5.714 2.478 1.00 0.00 ATOM 117 O LEU 18 -4.356 -3.888 4.002 1.00 0.00 ATOM 118 C LEU 18 -3.290 -3.659 4.565 1.00 0.00 ATOM 119 N THR 19 -3.031 -4.096 5.796 1.00 0.00 ATOM 120 CA THR 19 -4.021 -4.889 6.505 1.00 0.00 ATOM 121 CB THR 19 -3.460 -5.437 7.831 1.00 0.00 ATOM 122 CG2 THR 19 -4.522 -6.235 8.571 1.00 0.00 ATOM 123 OG1 THR 19 -2.345 -6.296 7.563 1.00 0.00 ATOM 124 O THR 19 -6.348 -4.430 6.345 1.00 0.00 ATOM 125 C THR 19 -5.269 -4.063 6.779 1.00 0.00 ATOM 126 N LEU 20 -5.144 -2.958 7.507 1.00 0.00 ATOM 127 CA LEU 20 -6.314 -2.131 7.797 1.00 0.00 ATOM 128 CB LEU 20 -5.894 -0.828 8.480 1.00 0.00 ATOM 129 CG LEU 20 -5.448 -0.941 9.940 1.00 0.00 ATOM 130 CD1 LEU 20 -4.961 0.404 10.459 1.00 0.00 ATOM 131 CD2 LEU 20 -6.582 -1.464 10.808 1.00 0.00 ATOM 132 O LEU 20 -8.328 -1.841 6.557 1.00 0.00 ATOM 133 C LEU 20 -7.107 -1.820 6.538 1.00 0.00 ATOM 134 N SER 21 -6.407 -1.547 5.445 1.00 0.00 ATOM 135 CA SER 21 -7.052 -1.217 4.179 1.00 0.00 ATOM 136 CB SER 21 -6.011 -0.783 3.144 1.00 0.00 ATOM 137 OG SER 21 -6.075 -1.593 1.984 1.00 0.00 ATOM 138 O SER 21 -9.009 -2.201 3.147 1.00 0.00 ATOM 139 C SER 21 -7.875 -2.381 3.603 1.00 0.00 ATOM 140 N GLU 22 -7.300 -3.573 3.616 1.00 0.00 ATOM 141 CA GLU 22 -8.031 -4.723 3.135 1.00 0.00 ATOM 142 CB GLU 22 -7.174 -5.987 3.244 1.00 0.00 ATOM 143 CG GLU 22 -7.850 -7.243 2.720 1.00 0.00 ATOM 144 CD GLU 22 -8.096 -7.190 1.224 1.00 0.00 ATOM 145 OE1 GLU 22 -7.437 -6.378 0.542 1.00 0.00 ATOM 146 OE2 GLU 22 -8.949 -7.961 0.736 1.00 0.00 ATOM 147 O GLU 22 -10.383 -5.041 3.493 1.00 0.00 ATOM 148 C GLU 22 -9.287 -4.774 3.988 1.00 0.00 ATOM 149 N GLN 23 -9.121 -4.529 5.282 1.00 0.00 ATOM 150 CA GLN 23 -10.244 -4.543 6.216 1.00 0.00 ATOM 151 CB GLN 23 -9.778 -4.143 7.618 1.00 0.00 ATOM 152 CG GLN 23 -10.864 -4.227 8.679 1.00 0.00 ATOM 153 CD GLN 23 -11.327 -5.649 8.926 1.00 0.00 ATOM 154 OE1 GLN 23 -10.522 -6.535 9.211 1.00 0.00 ATOM 155 NE2 GLN 23 -12.632 -5.872 8.817 1.00 0.00 ATOM 156 O GLN 23 -12.492 -4.076 5.615 1.00 0.00 ATOM 157 C GLN 23 -11.369 -3.638 5.790 1.00 0.00 ATOM 158 N MET 24 -11.053 -2.366 5.634 1.00 0.00 ATOM 159 CA MET 24 -12.045 -1.391 5.265 1.00 0.00 ATOM 160 CB MET 24 -11.416 0.001 5.165 1.00 0.00 ATOM 161 CG MET 24 -12.415 1.116 4.900 1.00 0.00 ATOM 162 SD MET 24 -11.637 2.739 4.808 1.00 0.00 ATOM 163 CE MET 24 -11.144 2.977 6.512 1.00 0.00 ATOM 164 O MET 24 -13.943 -1.525 3.823 1.00 0.00 ATOM 165 C MET 24 -12.735 -1.718 3.956 1.00 0.00 ATOM 166 N LEU 25 -11.971 -2.196 2.981 1.00 0.00 ATOM 167 CA LEU 25 -12.560 -2.576 1.699 1.00 0.00 ATOM 168 CB LEU 25 -11.480 -3.087 0.744 1.00 0.00 ATOM 169 CG LEU 25 -11.973 -3.754 -0.542 1.00 0.00 ATOM 170 CD1 LEU 25 -12.639 -2.735 -1.454 1.00 0.00 ATOM 171 CD2 LEU 25 -10.826 -4.441 -1.265 1.00 0.00 ATOM 172 O LEU 25 -14.780 -3.435 1.640 1.00 0.00 ATOM 173 C LEU 25 -13.622 -3.628 1.954 1.00 0.00 ATOM 174 N VAL 26 -13.211 -4.762 2.507 1.00 0.00 ATOM 175 CA VAL 26 -14.142 -5.844 2.824 1.00 0.00 ATOM 176 CB VAL 26 -13.479 -6.918 3.707 1.00 0.00 ATOM 177 CG1 VAL 26 -14.515 -7.916 4.200 1.00 0.00 ATOM 178 CG2 VAL 26 -12.372 -7.628 2.941 1.00 0.00 ATOM 179 O VAL 26 -16.497 -5.913 3.235 1.00 0.00 ATOM 180 C VAL 26 -15.421 -5.393 3.517 1.00 0.00 ATOM 181 N LEU 27 -15.295 -4.465 4.456 1.00 0.00 ATOM 182 CA LEU 27 -16.446 -3.951 5.165 1.00 0.00 ATOM 183 CB LEU 27 -16.008 -2.978 6.262 1.00 0.00 ATOM 184 CG LEU 27 -15.415 -3.604 7.526 1.00 0.00 ATOM 185 CD1 LEU 27 -14.911 -2.526 8.473 1.00 0.00 ATOM 186 CD2 LEU 27 -16.441 -4.484 8.223 1.00 0.00 ATOM 187 O LEU 27 -18.611 -3.359 4.413 1.00 0.00 ATOM 188 C LEU 27 -17.409 -3.270 4.233 1.00 0.00 ATOM 189 N ALA 28 -16.875 -2.575 3.238 1.00 0.00 ATOM 190 CA ALA 28 -17.707 -1.875 2.267 1.00 0.00 ATOM 191 CB ALA 28 -16.878 -0.867 1.487 1.00 0.00 ATOM 192 O ALA 28 -19.532 -2.837 1.056 1.00 0.00 ATOM 193 C ALA 28 -18.339 -2.924 1.352 1.00 0.00 ATOM 194 N THR 29 -17.577 -3.912 0.900 1.00 0.00 ATOM 195 CA THR 29 -18.217 -4.858 0.048 1.00 0.00 ATOM 196 CB THR 29 -17.277 -6.025 -0.306 1.00 0.00 ATOM 197 CG2 THR 29 -17.991 -7.037 -1.189 1.00 0.00 ATOM 198 OG1 THR 29 -16.134 -5.525 -1.014 1.00 0.00 ATOM 199 O THR 29 -20.505 -5.587 0.153 1.00 0.00 ATOM 200 C THR 29 -19.468 -5.357 0.762 1.00 0.00 ATOM 201 N GLU 30 -19.365 -5.532 2.072 1.00 0.00 ATOM 202 CA GLU 30 -20.510 -5.993 2.862 1.00 0.00 ATOM 203 CB GLU 30 -20.052 -6.476 4.240 1.00 0.00 ATOM 204 CG GLU 30 -19.229 -7.753 4.208 1.00 0.00 ATOM 205 CD GLU 30 -18.775 -8.188 5.587 1.00 0.00 ATOM 206 OE1 GLU 30 -18.957 -7.409 6.546 1.00 0.00 ATOM 207 OE2 GLU 30 -18.238 -9.310 5.710 1.00 0.00 ATOM 208 O GLU 30 -22.672 -5.099 3.147 1.00 0.00 ATOM 209 C GLU 30 -21.496 -4.867 2.974 1.00 0.00 ATOM 210 N GLY 31 -21.017 -3.639 2.868 1.00 0.00 ATOM 211 CA GLY 31 -21.918 -2.514 3.004 1.00 0.00 ATOM 212 O GLY 31 -22.945 -1.322 4.819 1.00 0.00 ATOM 213 C GLY 31 -22.025 -2.052 4.442 1.00 0.00 ATOM 214 N ASN 32 -21.095 -2.504 5.269 1.00 0.00 ATOM 215 CA ASN 32 -21.082 -2.100 6.668 1.00 0.00 ATOM 216 CB ASN 32 -20.338 -3.132 7.517 1.00 0.00 ATOM 217 CG ASN 32 -20.532 -2.912 9.005 1.00 0.00 ATOM 218 ND2 ASN 32 -19.519 -3.259 9.791 1.00 0.00 ATOM 219 OD1 ASN 32 -21.582 -2.437 9.440 1.00 0.00 ATOM 220 O ASN 32 -19.404 -0.552 7.377 1.00 0.00 ATOM 221 C ASN 32 -20.447 -0.711 6.759 1.00 0.00 ATOM 222 N TRP 33 -21.074 0.285 6.142 1.00 0.00 ATOM 223 CA TRP 33 -20.538 1.647 6.140 1.00 0.00 ATOM 224 CB TRP 33 -21.349 2.541 5.199 1.00 0.00 ATOM 225 CG TRP 33 -21.686 1.888 3.894 1.00 0.00 ATOM 226 CD1 TRP 33 -22.823 1.194 3.595 1.00 0.00 ATOM 227 CD2 TRP 33 -20.878 1.866 2.712 1.00 0.00 ATOM 228 CE2 TRP 33 -21.589 1.144 1.736 1.00 0.00 ATOM 229 CE3 TRP 33 -19.624 2.388 2.383 1.00 0.00 ATOM 230 NE1 TRP 33 -22.775 0.742 2.298 1.00 0.00 ATOM 231 CZ2 TRP 33 -21.087 0.929 0.453 1.00 0.00 ATOM 232 CZ3 TRP 33 -19.130 2.172 1.111 1.00 0.00 ATOM 233 CH2 TRP 33 -19.858 1.449 0.159 1.00 0.00 ATOM 234 O TRP 33 -19.682 3.212 7.738 1.00 0.00 ATOM 235 C TRP 33 -20.493 2.320 7.501 1.00 0.00 ATOM 236 N ASP 34 -21.378 1.920 8.399 1.00 0.00 ATOM 237 CA ASP 34 -21.376 2.526 9.718 1.00 0.00 ATOM 238 CB ASP 34 -22.531 1.977 10.560 1.00 0.00 ATOM 239 CG ASP 34 -23.880 2.504 10.113 1.00 0.00 ATOM 240 OD1 ASP 34 -24.101 3.730 10.210 1.00 0.00 ATOM 241 OD2 ASP 34 -24.716 1.692 9.664 1.00 0.00 ATOM 242 O ASP 34 -19.570 3.119 11.186 1.00 0.00 ATOM 243 C ASP 34 -20.047 2.280 10.416 1.00 0.00 ATOM 244 N ALA 35 -19.453 1.117 10.169 1.00 0.00 ATOM 245 CA ALA 35 -18.160 0.809 10.776 1.00 0.00 ATOM 246 CB ALA 35 -17.919 -0.693 10.776 1.00 0.00 ATOM 247 O ALA 35 -16.095 1.971 10.636 1.00 0.00 ATOM 248 C ALA 35 -17.056 1.532 10.028 1.00 0.00 ATOM 249 N LEU 36 -17.208 1.690 8.718 1.00 0.00 ATOM 250 CA LEU 36 -16.193 2.394 7.959 1.00 0.00 ATOM 251 CB LEU 36 -16.560 2.427 6.474 1.00 0.00 ATOM 252 CG LEU 36 -15.724 1.540 5.551 1.00 0.00 ATOM 253 CD1 LEU 36 -16.169 0.089 5.650 1.00 0.00 ATOM 254 CD2 LEU 36 -15.819 2.024 4.111 1.00 0.00 ATOM 255 O LEU 36 -14.915 4.231 8.767 1.00 0.00 ATOM 256 C LEU 36 -16.029 3.796 8.503 1.00 0.00 ATOM 257 N VAL 37 -17.136 4.513 8.657 1.00 0.00 ATOM 258 CA VAL 37 -17.086 5.876 9.182 1.00 0.00 ATOM 259 CB VAL 37 -18.500 6.456 9.381 1.00 0.00 ATOM 260 CG1 VAL 37 -18.431 7.780 10.126 1.00 0.00 ATOM 261 CG2 VAL 37 -19.198 6.630 8.042 1.00 0.00 ATOM 262 O VAL 37 -15.442 6.722 10.728 1.00 0.00 ATOM 263 C VAL 37 -16.306 5.868 10.495 1.00 0.00 ATOM 264 N ASP 38 -16.600 4.893 11.348 1.00 0.00 ATOM 265 CA ASP 38 -15.907 4.774 12.620 1.00 0.00 ATOM 266 CB ASP 38 -16.464 3.598 13.425 1.00 0.00 ATOM 267 CG ASP 38 -17.856 3.867 13.961 1.00 0.00 ATOM 268 OD1 ASP 38 -18.281 5.041 13.948 1.00 0.00 ATOM 269 OD2 ASP 38 -18.521 2.903 14.395 1.00 0.00 ATOM 270 O ASP 38 -13.624 5.466 12.862 1.00 0.00 ATOM 271 C ASP 38 -14.401 4.601 12.454 1.00 0.00 ATOM 272 N LEU 39 -13.984 3.492 11.857 1.00 0.00 ATOM 273 CA LEU 39 -12.563 3.217 11.646 1.00 0.00 ATOM 274 CB LEU 39 -12.371 1.837 11.015 1.00 0.00 ATOM 275 CG LEU 39 -12.729 0.635 11.891 1.00 0.00 ATOM 276 CD1 LEU 39 -12.641 -0.657 11.094 1.00 0.00 ATOM 277 CD2 LEU 39 -11.821 0.569 13.110 1.00 0.00 ATOM 278 O LEU 39 -10.577 4.330 10.845 1.00 0.00 ATOM 279 C LEU 39 -11.810 4.233 10.776 1.00 0.00 ATOM 280 N GLU 40 -12.536 4.973 9.946 1.00 0.00 ATOM 281 CA GLU 40 -11.904 5.945 9.061 1.00 0.00 ATOM 282 CB GLU 40 -12.956 6.850 8.420 1.00 0.00 ATOM 283 CG GLU 40 -12.392 7.849 7.423 1.00 0.00 ATOM 284 CD GLU 40 -13.265 9.079 7.272 1.00 0.00 ATOM 285 OE1 GLU 40 -14.468 8.998 7.601 1.00 0.00 ATOM 286 OE2 GLU 40 -12.748 10.124 6.824 1.00 0.00 ATOM 287 O GLU 40 -9.673 6.772 9.361 1.00 0.00 ATOM 288 C GLU 40 -10.856 6.845 9.707 1.00 0.00 ATOM 289 N MET 41 -11.280 7.713 10.623 1.00 0.00 ATOM 290 CA MET 41 -10.324 8.625 11.245 1.00 0.00 ATOM 291 CB MET 41 -10.956 9.325 12.450 1.00 0.00 ATOM 292 CG MET 41 -10.025 10.286 13.170 1.00 0.00 ATOM 293 SD MET 41 -10.776 11.014 14.638 1.00 0.00 ATOM 294 CE MET 41 -10.796 9.605 15.742 1.00 0.00 ATOM 295 O MET 41 -7.933 8.330 11.363 1.00 0.00 ATOM 296 C MET 41 -9.046 7.894 11.680 1.00 0.00 ATOM 297 N THR 42 -9.209 6.777 12.382 1.00 0.00 ATOM 298 CA THR 42 -8.082 5.977 12.852 1.00 0.00 ATOM 299 CB THR 42 -8.555 4.746 13.647 1.00 0.00 ATOM 300 CG2 THR 42 -7.366 3.910 14.092 1.00 0.00 ATOM 301 OG1 THR 42 -9.277 5.175 14.810 1.00 0.00 ATOM 302 O THR 42 -5.946 5.412 11.843 1.00 0.00 ATOM 303 C THR 42 -7.171 5.492 11.706 1.00 0.00 ATOM 304 N TYR 43 -7.785 5.186 10.571 1.00 0.00 ATOM 305 CA TYR 43 -7.060 4.709 9.399 1.00 0.00 ATOM 306 CB TYR 43 -8.030 4.119 8.372 1.00 0.00 ATOM 307 CG TYR 43 -7.374 3.725 7.068 1.00 0.00 ATOM 308 CD1 TYR 43 -6.394 2.742 7.033 1.00 0.00 ATOM 309 CD2 TYR 43 -7.740 4.337 5.875 1.00 0.00 ATOM 310 CE1 TYR 43 -5.792 2.375 5.845 1.00 0.00 ATOM 311 CE2 TYR 43 -7.147 3.982 4.679 1.00 0.00 ATOM 312 CZ TYR 43 -6.165 2.992 4.671 1.00 0.00 ATOM 313 OH TYR 43 -5.566 2.629 3.487 1.00 0.00 ATOM 314 O TYR 43 -5.037 5.718 8.569 1.00 0.00 ATOM 315 C TYR 43 -6.241 5.835 8.763 1.00 0.00 ATOM 316 N LEU 44 -6.921 6.926 8.435 1.00 0.00 ATOM 317 CA LEU 44 -6.296 8.107 7.843 1.00 0.00 ATOM 318 CB LEU 44 -7.348 9.171 7.530 1.00 0.00 ATOM 319 CG LEU 44 -8.277 8.879 6.351 1.00 0.00 ATOM 320 CD1 LEU 44 -9.580 9.651 6.489 1.00 0.00 ATOM 321 CD2 LEU 44 -7.597 9.220 5.033 1.00 0.00 ATOM 322 O LEU 44 -4.239 9.201 8.433 1.00 0.00 ATOM 323 C LEU 44 -5.250 8.619 8.816 1.00 0.00 ATOM 324 N LYS 45 -5.534 8.391 10.090 1.00 0.00 ATOM 325 CA LYS 45 -4.667 8.788 11.182 1.00 0.00 ATOM 326 CB LYS 45 -5.335 8.499 12.528 1.00 0.00 ATOM 327 CG LYS 45 -4.508 8.916 13.733 1.00 0.00 ATOM 328 CD LYS 45 -5.256 8.660 15.031 1.00 0.00 ATOM 329 CE LYS 45 -4.419 9.053 16.239 1.00 0.00 ATOM 330 NZ LYS 45 -5.139 8.807 17.518 1.00 0.00 ATOM 331 O LYS 45 -2.303 8.614 10.805 1.00 0.00 ATOM 332 C LYS 45 -3.359 8.020 11.002 1.00 0.00 ATOM 333 N ALA 46 -3.442 6.694 11.029 1.00 0.00 ATOM 334 CA ALA 46 -2.268 5.839 10.882 1.00 0.00 ATOM 335 CB ALA 46 -2.657 4.375 11.021 1.00 0.00 ATOM 336 O ALA 46 -0.340 6.236 9.530 1.00 0.00 ATOM 337 C ALA 46 -1.551 6.044 9.556 1.00 0.00 ATOM 338 N VAL 47 -2.294 5.999 8.453 1.00 0.00 ATOM 339 CA VAL 47 -1.683 6.148 7.144 1.00 0.00 ATOM 340 CB VAL 47 -2.728 6.024 6.018 1.00 0.00 ATOM 341 CG1 VAL 47 -2.107 6.379 4.676 1.00 0.00 ATOM 342 CG2 VAL 47 -3.312 4.620 5.985 1.00 0.00 ATOM 343 O VAL 47 -0.012 7.586 6.200 1.00 0.00 ATOM 344 C VAL 47 -0.942 7.473 6.990 1.00 0.00 ATOM 345 N GLU 48 -1.359 8.486 7.729 1.00 0.00 ATOM 346 CA GLU 48 -0.678 9.754 7.643 1.00 0.00 ATOM 347 CB GLU 48 -1.609 10.891 8.069 1.00 0.00 ATOM 348 CG GLU 48 -2.297 11.597 6.912 1.00 0.00 ATOM 349 CD GLU 48 -1.402 12.615 6.235 1.00 0.00 ATOM 350 OE1 GLU 48 -1.879 13.735 5.956 1.00 0.00 ATOM 351 OE2 GLU 48 -0.220 12.294 5.984 1.00 0.00 ATOM 352 O GLU 48 1.647 10.045 8.110 1.00 0.00 ATOM 353 C GLU 48 0.557 9.673 8.522 1.00 0.00 ATOM 354 N SER 49 0.367 9.178 9.738 1.00 0.00 ATOM 355 CA SER 49 1.433 9.026 10.715 1.00 0.00 ATOM 356 CB SER 49 0.906 8.353 11.983 1.00 0.00 ATOM 357 OG SER 49 0.519 7.014 11.728 1.00 0.00 ATOM 358 O SER 49 3.703 8.291 10.632 1.00 0.00 ATOM 359 C SER 49 2.585 8.222 10.131 1.00 0.00 ATOM 360 N THR 50 2.332 7.508 9.045 1.00 0.00 ATOM 361 CA THR 50 3.358 6.693 8.446 1.00 0.00 ATOM 362 CB THR 50 2.765 5.431 7.791 1.00 0.00 ATOM 363 CG2 THR 50 2.019 4.596 8.820 1.00 0.00 ATOM 364 OG1 THR 50 1.846 5.812 6.759 1.00 0.00 ATOM 365 O THR 50 5.349 7.115 7.219 1.00 0.00 ATOM 366 C THR 50 4.173 7.417 7.409 1.00 0.00 ATOM 367 N ALA 51 3.547 8.344 6.701 1.00 0.00 ATOM 368 CA ALA 51 4.265 9.093 5.690 1.00 0.00 ATOM 369 CB ALA 51 3.299 9.643 4.652 1.00 0.00 ATOM 370 O ALA 51 6.090 10.634 5.841 1.00 0.00 ATOM 371 C ALA 51 5.048 10.207 6.339 1.00 0.00 ATOM 372 N ASN 52 4.548 10.655 7.480 1.00 0.00 ATOM 373 CA ASN 52 5.238 11.679 8.240 1.00 0.00 ATOM 374 CB ASN 52 4.411 12.092 9.459 1.00 0.00 ATOM 375 CG ASN 52 3.208 12.939 9.088 1.00 0.00 ATOM 376 ND2 ASN 52 2.233 13.004 9.986 1.00 0.00 ATOM 377 OD1 ASN 52 3.161 13.526 8.006 1.00 0.00 ATOM 378 O ASN 52 7.610 11.674 8.712 1.00 0.00 ATOM 379 C ASN 52 6.591 11.009 8.565 1.00 0.00 ATOM 380 N ILE 53 6.544 9.677 8.664 1.00 0.00 ATOM 381 CA ILE 53 7.688 8.841 8.978 1.00 0.00 ATOM 382 CB ILE 53 7.310 7.349 8.989 1.00 0.00 ATOM 383 CG1 ILE 53 6.236 7.078 10.044 1.00 0.00 ATOM 384 CG2 ILE 53 8.545 6.486 9.203 1.00 0.00 ATOM 385 CD1 ILE 53 6.669 7.414 11.455 1.00 0.00 ATOM 386 O ILE 53 8.783 9.360 6.881 1.00 0.00 ATOM 387 C ILE 53 8.892 8.998 8.052 1.00 0.00 ATOM 388 N THR 54 10.063 8.749 8.623 1.00 0.00 ATOM 389 CA THR 54 11.356 8.864 7.944 1.00 0.00 ATOM 390 CB THR 54 12.451 9.373 8.897 1.00 0.00 ATOM 391 CG2 THR 54 13.789 9.457 8.177 1.00 0.00 ATOM 392 OG1 THR 54 12.106 10.680 9.373 1.00 0.00 ATOM 393 O THR 54 11.586 6.486 7.954 1.00 0.00 ATOM 394 C THR 54 11.797 7.535 7.343 1.00 0.00 ATOM 395 N ILE 55 12.413 7.585 6.165 1.00 0.00 ATOM 396 CA ILE 55 12.921 6.378 5.510 1.00 0.00 ATOM 397 CB ILE 55 12.890 6.513 3.975 1.00 0.00 ATOM 398 CG1 ILE 55 11.454 6.716 3.487 1.00 0.00 ATOM 399 CG2 ILE 55 13.547 5.309 3.322 1.00 0.00 ATOM 400 CD1 ILE 55 11.353 7.094 2.026 1.00 0.00 ATOM 401 O ILE 55 15.267 6.876 5.874 1.00 0.00 ATOM 402 C ILE 55 14.356 6.038 5.967 1.00 0.00 ATOM 403 N SER 56 14.566 4.809 6.481 1.00 0.00 ATOM 404 CA SER 56 15.810 4.217 7.006 1.00 0.00 ATOM 405 CB SER 56 15.607 2.734 7.318 1.00 0.00 ATOM 406 OG SER 56 15.408 1.985 6.132 1.00 0.00 ATOM 407 O SER 56 16.965 4.570 4.970 1.00 0.00 ATOM 408 C SER 56 17.054 4.302 6.154 1.00 0.00 ATOM 409 N SER 57 18.228 4.063 6.767 1.00 0.00 ATOM 410 CA SER 57 19.513 4.098 6.066 1.00 0.00 ATOM 411 CB SER 57 20.663 4.231 7.064 1.00 0.00 ATOM 412 OG SER 57 20.618 5.480 7.732 1.00 0.00 ATOM 413 O SER 57 20.244 3.046 4.037 1.00 0.00 ATOM 414 C SER 57 19.802 2.886 5.174 1.00 0.00 ATOM 415 N CYS 58 19.548 1.694 5.702 1.00 0.00 ATOM 416 CA CYS 58 19.845 0.493 4.956 1.00 0.00 ATOM 417 CB CYS 58 20.478 -0.561 5.867 1.00 0.00 ATOM 418 SG CYS 58 22.058 -0.067 6.594 1.00 0.00 ATOM 419 O CYS 58 18.462 -1.384 4.502 1.00 0.00 ATOM 420 C CYS 58 18.726 -0.212 4.234 1.00 0.00 ATOM 421 N SER 59 18.046 0.479 3.328 1.00 0.00 ATOM 422 CA SER 59 16.980 -0.187 2.604 1.00 0.00 ATOM 423 CB SER 59 15.976 0.836 2.070 1.00 0.00 ATOM 424 OG SER 59 14.981 0.208 1.278 1.00 0.00 ATOM 425 O SER 59 18.657 -0.463 0.946 1.00 0.00 ATOM 426 C SER 59 17.697 -0.953 1.528 1.00 0.00 ATOM 427 N SER 60 17.253 -2.170 1.285 1.00 0.00 ATOM 428 CA SER 60 17.847 -2.957 0.241 1.00 0.00 ATOM 429 CB SER 60 18.317 -4.307 0.788 1.00 0.00 ATOM 430 OG SER 60 17.220 -5.083 1.239 1.00 0.00 ATOM 431 O SER 60 15.573 -2.749 -0.447 1.00 0.00 ATOM 432 C SER 60 16.728 -3.036 -0.765 1.00 0.00 ATOM 433 N LEU 61 17.064 -3.389 -1.991 1.00 0.00 ATOM 434 CA LEU 61 16.050 -3.494 -3.015 1.00 0.00 ATOM 435 CB LEU 61 16.667 -3.968 -4.333 1.00 0.00 ATOM 436 CG LEU 61 17.619 -2.990 -5.026 1.00 0.00 ATOM 437 CD1 LEU 61 18.274 -3.643 -6.233 1.00 0.00 ATOM 438 CD2 LEU 61 16.884 -1.727 -5.443 1.00 0.00 ATOM 439 O LEU 61 13.808 -4.350 -3.061 1.00 0.00 ATOM 440 C LEU 61 14.936 -4.444 -2.580 1.00 0.00 ATOM 441 N MET 62 15.261 -5.357 -1.665 1.00 0.00 ATOM 442 CA MET 62 14.309 -6.349 -1.129 1.00 0.00 ATOM 443 CB MET 62 15.051 -7.446 -0.363 1.00 0.00 ATOM 444 CG MET 62 15.888 -8.360 -1.243 1.00 0.00 ATOM 445 SD MET 62 16.873 -9.532 -0.290 1.00 0.00 ATOM 446 CE MET 62 15.592 -10.607 0.351 1.00 0.00 ATOM 447 O MET 62 12.097 -5.828 -0.406 1.00 0.00 ATOM 448 C MET 62 13.307 -5.651 -0.242 1.00 0.00 ATOM 449 N LEU 63 13.816 -4.863 0.700 1.00 0.00 ATOM 450 CA LEU 63 12.950 -4.125 1.595 1.00 0.00 ATOM 451 CB LEU 63 13.772 -3.412 2.671 1.00 0.00 ATOM 452 CG LEU 63 14.450 -4.309 3.709 1.00 0.00 ATOM 453 CD1 LEU 63 15.373 -3.494 4.601 1.00 0.00 ATOM 454 CD2 LEU 63 13.413 -5.040 4.548 1.00 0.00 ATOM 455 O LEU 63 10.988 -2.939 0.870 1.00 0.00 ATOM 456 C LEU 63 12.181 -3.172 0.699 1.00 0.00 ATOM 457 N GLN 64 12.890 -2.613 -0.268 1.00 0.00 ATOM 458 CA GLN 64 12.265 -1.699 -1.202 1.00 0.00 ATOM 459 CB GLN 64 13.276 -1.225 -2.246 1.00 0.00 ATOM 460 CG GLN 64 12.672 -0.387 -3.359 1.00 0.00 ATOM 461 CD GLN 64 13.708 0.084 -4.363 1.00 0.00 ATOM 462 OE1 GLN 64 14.455 -0.719 -4.921 1.00 0.00 ATOM 463 NE2 GLN 64 13.754 1.390 -4.595 1.00 0.00 ATOM 464 O GLN 64 9.957 -2.116 -1.518 1.00 0.00 ATOM 465 C GLN 64 11.098 -2.416 -1.833 1.00 0.00 ATOM 466 N ASP 65 11.388 -3.379 -2.704 1.00 0.00 ATOM 467 CA ASP 65 10.342 -4.139 -3.379 1.00 0.00 ATOM 468 CB ASP 65 10.934 -5.370 -4.069 1.00 0.00 ATOM 469 CG ASP 65 11.686 -5.021 -5.337 1.00 0.00 ATOM 470 OD1 ASP 65 12.165 -5.952 -6.020 1.00 0.00 ATOM 471 OD2 ASP 65 11.799 -3.818 -5.649 1.00 0.00 ATOM 472 O ASP 65 8.062 -4.516 -2.891 1.00 0.00 ATOM 473 C ASP 65 9.213 -4.606 -2.507 1.00 0.00 ATOM 474 N LEU 66 9.574 -5.107 -1.338 1.00 0.00 ATOM 475 CA LEU 66 8.609 -5.623 -0.393 1.00 0.00 ATOM 476 CB LEU 66 9.315 -6.153 0.857 1.00 0.00 ATOM 477 CG LEU 66 10.155 -7.418 0.676 1.00 0.00 ATOM 478 CD1 LEU 66 10.941 -7.728 1.940 1.00 0.00 ATOM 479 CD2 LEU 66 9.275 -8.601 0.298 1.00 0.00 ATOM 480 O LEU 66 6.378 -4.765 -0.165 1.00 0.00 ATOM 481 C LEU 66 7.584 -4.582 0.009 1.00 0.00 ATOM 482 N LEU 67 8.073 -3.500 0.603 1.00 0.00 ATOM 483 CA LEU 67 7.230 -2.397 1.054 1.00 0.00 ATOM 484 CB LEU 67 8.081 -1.302 1.700 1.00 0.00 ATOM 485 CG LEU 67 8.729 -1.650 3.042 1.00 0.00 ATOM 486 CD1 LEU 67 9.685 -0.551 3.479 1.00 0.00 ATOM 487 CD2 LEU 67 7.668 -1.881 4.106 1.00 0.00 ATOM 488 O LEU 67 5.276 -1.493 0.115 1.00 0.00 ATOM 489 C LEU 67 6.421 -1.813 -0.080 1.00 0.00 ATOM 490 N ARG 68 7.029 -1.672 -1.253 1.00 0.00 ATOM 491 CA ARG 68 6.335 -1.146 -2.418 1.00 0.00 ATOM 492 CB ARG 68 7.272 -1.104 -3.627 1.00 0.00 ATOM 493 CG ARG 68 8.361 -0.049 -3.532 1.00 0.00 ATOM 494 CD ARG 68 9.233 -0.043 -4.777 1.00 0.00 ATOM 495 NE ARG 68 10.328 0.919 -4.672 1.00 0.00 ATOM 496 CZ ARG 68 10.218 2.212 -4.961 1.00 0.00 ATOM 497 NH1 ARG 68 11.268 3.011 -4.835 1.00 0.00 ATOM 498 NH2 ARG 68 9.057 2.702 -5.372 1.00 0.00 ATOM 499 O ARG 68 4.018 -1.588 -2.896 1.00 0.00 ATOM 500 C ARG 68 5.146 -2.052 -2.624 1.00 0.00 ATOM 501 N GLU 69 5.399 -3.349 -2.467 1.00 0.00 ATOM 502 CA GLU 69 4.345 -4.330 -2.649 1.00 0.00 ATOM 503 CB GLU 69 4.873 -5.740 -2.374 1.00 0.00 ATOM 504 CG GLU 69 3.849 -6.841 -2.596 1.00 0.00 ATOM 505 CD GLU 69 4.428 -8.226 -2.391 1.00 0.00 ATOM 506 OE1 GLU 69 4.903 -8.510 -1.271 1.00 0.00 ATOM 507 OE2 GLU 69 4.408 -9.026 -3.349 1.00 0.00 ATOM 508 O GLU 69 2.022 -4.278 -2.161 1.00 0.00 ATOM 509 C GLU 69 3.158 -4.049 -1.759 1.00 0.00 ATOM 510 N LYS 70 3.410 -3.586 -0.540 1.00 0.00 ATOM 511 CA LYS 70 2.321 -3.237 0.344 1.00 0.00 ATOM 512 CB LYS 70 2.812 -3.157 1.792 1.00 0.00 ATOM 513 CG LYS 70 2.921 -4.504 2.486 1.00 0.00 ATOM 514 CD LYS 70 3.836 -5.446 1.721 1.00 0.00 ATOM 515 CE LYS 70 3.976 -6.781 2.433 1.00 0.00 ATOM 516 NZ LYS 70 4.945 -7.680 1.748 1.00 0.00 ATOM 517 O LYS 70 0.453 -1.839 -0.099 1.00 0.00 ATOM 518 C LYS 70 1.669 -1.936 -0.034 1.00 0.00 ATOM 519 N LEU 71 2.486 -0.930 -0.275 1.00 0.00 ATOM 520 CA LEU 71 1.938 0.359 -0.637 1.00 0.00 ATOM 521 CB LEU 71 3.063 1.365 -0.895 1.00 0.00 ATOM 522 CG LEU 71 3.872 1.804 0.327 1.00 0.00 ATOM 523 CD1 LEU 71 5.061 2.654 -0.092 1.00 0.00 ATOM 524 CD2 LEU 71 2.996 2.567 1.308 1.00 0.00 ATOM 525 O LEU 71 0.002 0.897 -1.922 1.00 0.00 ATOM 526 C LEU 71 1.047 0.256 -1.857 1.00 0.00 ATOM 527 N ARG 72 1.460 -0.543 -2.830 1.00 0.00 ATOM 528 CA ARG 72 0.648 -0.686 -4.019 1.00 0.00 ATOM 529 CB ARG 72 1.473 -1.281 -5.161 1.00 0.00 ATOM 530 CG ARG 72 2.578 -0.369 -5.668 1.00 0.00 ATOM 531 CD ARG 72 3.418 -1.057 -6.734 1.00 0.00 ATOM 532 NE ARG 72 4.144 -2.206 -6.199 1.00 0.00 ATOM 533 CZ ARG 72 4.844 -3.058 -6.941 1.00 0.00 ATOM 534 NH1 ARG 72 5.473 -4.076 -6.369 1.00 0.00 ATOM 535 NH2 ARG 72 4.913 -2.891 -8.255 1.00 0.00 ATOM 536 O ARG 72 -1.547 -1.538 -4.438 1.00 0.00 ATOM 537 C ARG 72 -0.553 -1.553 -3.717 1.00 0.00 ATOM 538 N ALA 73 -0.458 -2.311 -2.635 1.00 0.00 ATOM 539 CA ALA 73 -1.545 -3.193 -2.239 1.00 0.00 ATOM 540 CB ALA 73 -1.026 -4.300 -1.334 1.00 0.00 ATOM 541 O ALA 73 -3.832 -2.590 -1.785 1.00 0.00 ATOM 542 C ALA 73 -2.644 -2.390 -1.538 1.00 0.00 ATOM 543 N ILE 74 -2.242 -1.472 -0.669 1.00 0.00 ATOM 544 CA ILE 74 -3.205 -0.641 0.037 1.00 0.00 ATOM 545 CB ILE 74 -2.574 0.028 1.271 1.00 0.00 ATOM 546 CG1 ILE 74 -3.663 0.555 2.208 1.00 0.00 ATOM 547 CG2 ILE 74 -1.611 1.126 0.849 1.00 0.00 ATOM 548 CD1 ILE 74 -3.152 0.966 3.571 1.00 0.00 ATOM 549 O ILE 74 -4.921 0.894 -0.748 1.00 0.00 ATOM 550 C ILE 74 -3.784 0.423 -0.914 1.00 0.00 ATOM 551 N LEU 75 -2.991 0.772 -1.923 1.00 0.00 ATOM 552 CA LEU 75 -3.350 1.776 -2.916 1.00 0.00 ATOM 553 CB LEU 75 -2.129 2.162 -3.752 1.00 0.00 ATOM 554 CG LEU 75 -2.263 3.425 -4.604 1.00 0.00 ATOM 555 CD1 LEU 75 -2.682 4.610 -3.746 1.00 0.00 ATOM 556 CD2 LEU 75 -0.959 3.728 -5.326 1.00 0.00 ATOM 557 O LEU 75 -5.304 2.064 -4.286 1.00 0.00 ATOM 558 C LEU 75 -4.470 1.281 -3.827 1.00 0.00 ATOM 559 N ASP 76 -4.491 -0.021 -4.087 1.00 0.00 ATOM 560 CA ASP 76 -5.522 -0.594 -4.935 1.00 0.00 ATOM 561 CB ASP 76 -4.980 -1.807 -5.694 1.00 0.00 ATOM 562 CG ASP 76 -3.769 -1.471 -6.540 1.00 0.00 ATOM 563 OD1 ASP 76 -3.292 -2.362 -7.276 1.00 0.00 ATOM 564 OD2 ASP 76 -3.294 -0.318 -6.467 1.00 0.00 ATOM 565 O ASP 76 -7.841 -0.945 -4.565 1.00 0.00 ATOM 566 C ASP 76 -6.717 -0.975 -4.088 1.00 0.00 ATOM 567 N ASN 77 -6.475 -1.330 -2.831 1.00 0.00 ATOM 568 CA ASN 77 -7.569 -1.677 -1.937 1.00 0.00 ATOM 569 CB ASN 77 -7.028 -2.129 -0.579 1.00 0.00 ATOM 570 CG ASN 77 -6.869 -3.633 -0.484 1.00 0.00 ATOM 571 ND2 ASN 77 -6.419 -4.108 0.670 1.00 0.00 ATOM 572 OD1 ASN 77 -7.149 -4.356 -1.441 1.00 0.00 ATOM 573 O ASN 77 -9.692 -0.558 -1.917 1.00 0.00 ATOM 574 C ASN 77 -8.469 -0.452 -1.837 1.00 0.00 ATOM 575 N GLU 78 -7.861 0.719 -1.675 1.00 0.00 ATOM 576 CA GLU 78 -8.630 1.959 -1.594 1.00 0.00 ATOM 577 CB GLU 78 -7.728 3.124 -1.181 1.00 0.00 ATOM 578 CG GLU 78 -7.297 3.088 0.275 1.00 0.00 ATOM 579 CD GLU 78 -6.674 4.393 0.731 1.00 0.00 ATOM 580 OE1 GLU 78 -7.133 5.461 0.276 1.00 0.00 ATOM 581 OE2 GLU 78 -5.724 4.347 1.542 1.00 0.00 ATOM 582 O GLU 78 -10.459 2.656 -2.951 1.00 0.00 ATOM 583 C GLU 78 -9.302 2.257 -2.918 1.00 0.00 ATOM 584 N ILE 79 -8.577 2.063 -4.012 1.00 0.00 ATOM 585 CA ILE 79 -9.134 2.297 -5.344 1.00 0.00 ATOM 586 CB ILE 79 -8.161 1.847 -6.450 1.00 0.00 ATOM 587 CG1 ILE 79 -6.928 2.751 -6.474 1.00 0.00 ATOM 588 CG2 ILE 79 -8.865 1.814 -7.797 1.00 0.00 ATOM 589 CD1 ILE 79 -5.797 2.219 -7.326 1.00 0.00 ATOM 590 O ILE 79 -11.427 2.108 -6.082 1.00 0.00 ATOM 591 C ILE 79 -10.472 1.581 -5.500 1.00 0.00 ATOM 592 N GLU 80 -10.513 0.368 -4.969 1.00 0.00 ATOM 593 CA GLU 80 -11.687 -0.470 -5.025 1.00 0.00 ATOM 594 CB GLU 80 -11.330 -1.917 -4.685 1.00 0.00 ATOM 595 CG GLU 80 -10.477 -2.610 -5.737 1.00 0.00 ATOM 596 CD GLU 80 -11.185 -2.733 -7.072 1.00 0.00 ATOM 597 OE1 GLU 80 -12.329 -3.231 -7.094 1.00 0.00 ATOM 598 OE2 GLU 80 -10.595 -2.330 -8.096 1.00 0.00 ATOM 599 O GLU 80 -13.934 0.030 -4.388 1.00 0.00 ATOM 600 C GLU 80 -12.742 0.052 -4.083 1.00 0.00 ATOM 601 N ILE 81 -12.299 0.501 -2.918 1.00 0.00 ATOM 602 CA ILE 81 -13.223 1.031 -1.934 1.00 0.00 ATOM 603 CB ILE 81 -12.512 1.345 -0.604 1.00 0.00 ATOM 604 CG1 ILE 81 -12.055 0.052 0.076 1.00 0.00 ATOM 605 CG2 ILE 81 -13.414 2.171 0.299 1.00 0.00 ATOM 606 CD1 ILE 81 -11.109 0.273 1.234 1.00 0.00 ATOM 607 O ILE 81 -15.101 2.444 -2.341 1.00 0.00 ATOM 608 C ILE 81 -13.899 2.272 -2.486 1.00 0.00 ATOM 609 N LYS 82 -13.118 3.134 -3.123 1.00 0.00 ATOM 610 CA LYS 82 -13.657 4.356 -3.702 1.00 0.00 ATOM 611 CB LYS 82 -12.546 5.166 -4.374 1.00 0.00 ATOM 612 CG LYS 82 -11.500 5.703 -3.410 1.00 0.00 ATOM 613 CD LYS 82 -12.145 6.466 -2.264 1.00 0.00 ATOM 614 CE LYS 82 -11.149 6.732 -1.148 1.00 0.00 ATOM 615 NZ LYS 82 -11.621 6.197 0.159 1.00 0.00 ATOM 616 O LYS 82 -15.785 4.699 -4.744 1.00 0.00 ATOM 617 C LYS 82 -14.755 4.033 -4.702 1.00 0.00 ATOM 618 N ARG 83 -14.534 3.004 -5.501 1.00 0.00 ATOM 619 CA ARG 83 -15.526 2.624 -6.487 1.00 0.00 ATOM 620 CB ARG 83 -14.968 1.549 -7.422 1.00 0.00 ATOM 621 CG ARG 83 -13.883 2.047 -8.363 1.00 0.00 ATOM 622 CD ARG 83 -13.401 0.941 -9.286 1.00 0.00 ATOM 623 NE ARG 83 -12.669 -0.095 -8.561 1.00 0.00 ATOM 624 CZ ARG 83 -12.405 -1.303 -9.049 1.00 0.00 ATOM 625 NH1 ARG 83 -11.734 -2.181 -8.317 1.00 0.00 ATOM 626 NH2 ARG 83 -12.815 -1.631 -10.267 1.00 0.00 ATOM 627 O ARG 83 -17.881 2.386 -6.508 1.00 0.00 ATOM 628 C ARG 83 -16.836 2.112 -5.928 1.00 0.00 ATOM 629 N LEU 84 -16.788 1.356 -4.834 1.00 0.00 ATOM 630 CA LEU 84 -18.003 0.838 -4.231 1.00 0.00 ATOM 631 CB LEU 84 -17.668 -0.179 -3.139 1.00 0.00 ATOM 632 CG LEU 84 -17.007 -1.478 -3.603 1.00 0.00 ATOM 633 CD1 LEU 84 -16.741 -2.398 -2.421 1.00 0.00 ATOM 634 CD2 LEU 84 -17.870 -2.183 -4.638 1.00 0.00 ATOM 635 O LEU 84 -19.908 2.299 -4.061 1.00 0.00 ATOM 636 C LEU 84 -18.756 2.046 -3.698 1.00 0.00 ATOM 637 N LEU 85 -18.082 2.791 -2.832 1.00 0.00 ATOM 638 CA LEU 85 -18.622 4.002 -2.215 1.00 0.00 ATOM 639 CB LEU 85 -17.553 4.696 -1.370 1.00 0.00 ATOM 640 CG LEU 85 -18.035 5.830 -0.462 1.00 0.00 ATOM 641 CD1 LEU 85 -18.960 5.293 0.620 1.00 0.00 ATOM 642 CD2 LEU 85 -16.855 6.557 0.164 1.00 0.00 ATOM 643 O LEU 85 -20.196 5.622 -2.996 1.00 0.00 ATOM 644 C LEU 85 -19.176 4.995 -3.243 1.00 0.00 ATOM 645 N GLN 86 -18.529 5.138 -4.396 1.00 0.00 ATOM 646 CA GLN 86 -19.032 6.070 -5.405 1.00 0.00 ATOM 647 CB GLN 86 -17.976 6.310 -6.486 1.00 0.00 ATOM 648 CG GLN 86 -18.428 7.239 -7.602 1.00 0.00 ATOM 649 CD GLN 86 -18.795 8.620 -7.098 1.00 0.00 ATOM 650 OE1 GLN 86 -18.006 9.268 -6.409 1.00 0.00 ATOM 651 NE2 GLN 86 -19.994 9.074 -7.439 1.00 0.00 ATOM 652 O GLN 86 -21.169 6.273 -6.463 1.00 0.00 ATOM 653 C GLN 86 -20.306 5.524 -6.006 1.00 0.00 ATOM 654 N LEU 87 -20.417 4.205 -6.011 1.00 0.00 ATOM 655 CA LEU 87 -21.588 3.584 -6.560 1.00 0.00 ATOM 656 CB LEU 87 -21.329 2.100 -6.833 1.00 0.00 ATOM 657 CG LEU 87 -20.332 1.781 -7.948 1.00 0.00 ATOM 658 CD1 LEU 87 -20.057 0.286 -8.009 1.00 0.00 ATOM 659 CD2 LEU 87 -20.846 2.278 -9.289 1.00 0.00 ATOM 660 O LEU 87 -23.898 3.797 -6.083 1.00 0.00 ATOM 661 C LEU 87 -22.761 3.749 -5.635 1.00 0.00 ATOM 662 N ARG 88 -22.496 3.799 -4.332 1.00 0.00 ATOM 663 CA ARG 88 -23.559 3.983 -3.337 1.00 0.00 ATOM 664 CB ARG 88 -23.007 3.795 -1.923 1.00 0.00 ATOM 665 CG ARG 88 -23.886 2.944 -1.021 1.00 0.00 ATOM 666 CD ARG 88 -25.348 3.343 -1.140 1.00 0.00 ATOM 667 NE ARG 88 -26.176 2.248 -1.642 1.00 0.00 ATOM 668 CZ ARG 88 -26.701 1.298 -0.876 1.00 0.00 ATOM 669 NH1 ARG 88 -27.441 0.342 -1.421 1.00 0.00 ATOM 670 NH2 ARG 88 -26.486 1.306 0.433 1.00 0.00 ATOM 671 O ARG 88 -25.305 5.570 -3.747 1.00 0.00 ATOM 672 C ARG 88 -24.108 5.379 -3.580 1.00 0.00 ATOM 673 N LEU 89 -23.204 6.348 -3.620 1.00 0.00 ATOM 674 CA LEU 89 -23.571 7.732 -3.854 1.00 0.00 ATOM 675 CB LEU 89 -22.321 8.609 -3.950 1.00 0.00 ATOM 676 CG LEU 89 -21.321 8.493 -2.796 1.00 0.00 ATOM 677 CD1 LEU 89 -20.098 9.360 -3.057 1.00 0.00 ATOM 678 CD2 LEU 89 -21.973 8.881 -1.479 1.00 0.00 ATOM 679 O LEU 89 -25.423 8.488 -5.152 1.00 0.00 ATOM 680 C LEU 89 -24.399 7.822 -5.121 1.00 0.00 ATOM 681 N ASP 90 -23.946 7.142 -6.165 1.00 0.00 ATOM 682 CA ASP 90 -24.632 7.129 -7.456 1.00 0.00 ATOM 683 CB ASP 90 -23.939 6.166 -8.421 1.00 0.00 ATOM 684 CG ASP 90 -22.861 6.844 -9.247 1.00 0.00 ATOM 685 OD1 ASP 90 -22.399 7.932 -8.841 1.00 0.00 ATOM 686 OD2 ASP 90 -22.481 6.289 -10.298 1.00 0.00 ATOM 687 O ASP 90 -26.983 7.526 -7.739 1.00 0.00 ATOM 688 C ASP 90 -26.106 6.750 -7.360 1.00 0.00 ATOM 689 N ARG 91 -26.371 5.545 -6.867 1.00 0.00 ATOM 690 CA ARG 91 -27.737 5.049 -6.748 1.00 0.00 ATOM 691 CB ARG 91 -27.736 3.562 -6.387 1.00 0.00 ATOM 692 CG ARG 91 -27.261 2.652 -7.508 1.00 0.00 ATOM 693 CD ARG 91 -27.236 1.198 -7.065 1.00 0.00 ATOM 694 NE ARG 91 -26.800 0.307 -8.138 1.00 0.00 ATOM 695 CZ ARG 91 -26.578 -0.994 -7.984 1.00 0.00 ATOM 696 NH1 ARG 91 -26.183 -1.726 -9.017 1.00 0.00 ATOM 697 NH2 ARG 91 -26.750 -1.560 -6.798 1.00 0.00 ATOM 698 O ARG 91 -29.753 5.906 -5.778 1.00 0.00 ATOM 699 C ARG 91 -28.524 5.831 -5.712 1.00 0.00 ATOM 700 N LEU 92 -27.807 6.400 -4.752 1.00 0.00 ATOM 701 CA LEU 92 -28.423 7.169 -3.684 1.00 0.00 ATOM 702 CB LEU 92 -27.421 7.422 -2.557 1.00 0.00 ATOM 703 CG LEU 92 -27.891 7.083 -1.142 1.00 0.00 ATOM 704 CD1 LEU 92 -26.716 7.055 -0.177 1.00 0.00 ATOM 705 CD2 LEU 92 -28.939 8.078 -0.671 1.00 0.00 ATOM 706 O LEU 92 -30.025 8.948 -3.811 1.00 0.00 ATOM 707 C LEU 92 -28.962 8.485 -4.221 1.00 0.00 ATOM 708 N SER 93 -28.221 9.081 -5.145 1.00 0.00 ATOM 709 CA SER 93 -28.635 10.334 -5.756 1.00 0.00 ATOM 710 CB SER 93 -27.472 10.966 -6.524 1.00 0.00 ATOM 711 OG SER 93 -26.458 11.410 -5.640 1.00 0.00 ATOM 712 O SER 93 -30.831 10.711 -6.617 1.00 0.00 ATOM 713 C SER 93 -29.808 10.026 -6.652 1.00 0.00 ATOM 714 N ASP 94 -29.642 8.984 -7.455 1.00 0.00 ATOM 715 CA ASP 94 -30.683 8.528 -8.363 1.00 0.00 ATOM 716 CB ASP 94 -30.420 7.084 -8.797 1.00 0.00 ATOM 717 CG ASP 94 -29.242 6.968 -9.746 1.00 0.00 ATOM 718 OD1 ASP 94 -28.802 8.009 -10.277 1.00 0.00 ATOM 719 OD2 ASP 94 -28.761 5.834 -9.959 1.00 0.00 ATOM 720 O ASP 94 -33.048 9.026 -8.358 1.00 0.00 ATOM 721 C ASP 94 -32.070 8.640 -7.706 1.00 0.00 ATOM 722 N LEU 95 -32.137 8.315 -6.413 1.00 0.00 ATOM 723 CA LEU 95 -33.373 8.374 -5.627 1.00 0.00 ATOM 724 CB LEU 95 -33.212 7.598 -4.318 1.00 0.00 ATOM 725 CG LEU 95 -33.350 6.077 -4.410 1.00 0.00 ATOM 726 CD1 LEU 95 -33.021 5.427 -3.075 1.00 0.00 ATOM 727 CD2 LEU 95 -34.751 5.689 -4.855 1.00 0.00 ATOM 728 O LEU 95 -34.939 10.204 -5.608 1.00 0.00 ATOM 729 C LEU 95 -33.815 9.801 -5.308 1.00 0.00 ATOM 730 N VAL 96 -32.923 10.552 -4.677 1.00 0.00 ATOM 731 CA VAL 96 -33.210 11.917 -4.286 1.00 0.00 ATOM 732 CB VAL 96 -31.985 12.587 -3.635 1.00 0.00 ATOM 733 CG1 VAL 96 -32.235 14.073 -3.432 1.00 0.00 ATOM 734 CG2 VAL 96 -31.648 11.914 -2.314 1.00 0.00 ATOM 735 O VAL 96 -34.552 13.608 -5.303 1.00 0.00 ATOM 736 C VAL 96 -33.677 12.761 -5.456 1.00 0.00 ATOM 737 N GLY 97 -33.100 12.528 -6.630 1.00 0.00 ATOM 738 CA GLY 97 -33.482 13.301 -7.800 1.00 0.00 ATOM 739 O GLY 97 -31.786 14.872 -7.162 1.00 0.00 ATOM 740 C GLY 97 -32.511 14.434 -8.058 1.00 0.00 ATOM 741 N GLN 98 -32.491 14.922 -9.290 1.00 0.00 ATOM 742 CA GLN 98 -31.584 16.008 -9.649 1.00 0.00 ATOM 743 CB GLN 98 -31.044 15.808 -11.067 1.00 0.00 ATOM 744 CG GLN 98 -30.528 14.405 -11.342 1.00 0.00 ATOM 745 CD GLN 98 -29.423 14.383 -12.380 1.00 0.00 ATOM 746 OE1 GLN 98 -28.269 14.690 -12.078 1.00 0.00 ATOM 747 NE2 GLN 98 -29.773 14.021 -13.608 1.00 0.00 ATOM 748 O GLN 98 -33.462 17.483 -9.728 1.00 0.00 ATOM 749 C GLN 98 -32.256 17.368 -9.546 1.00 0.00 ATOM 750 N SER 99 -31.463 18.394 -9.263 1.00 0.00 ATOM 751 CA SER 99 -31.990 19.739 -9.177 1.00 0.00 ATOM 752 CB SER 99 -31.098 20.607 -8.288 1.00 0.00 ATOM 753 OG SER 99 -30.030 21.169 -9.030 1.00 0.00 ATOM 754 O SER 99 -31.641 19.507 -11.535 1.00 0.00 ATOM 755 C SER 99 -32.058 20.214 -10.618 1.00 0.00 ATOM 756 N THR 100 -32.599 21.407 -10.815 1.00 0.00 ATOM 757 CA THR 100 -32.753 21.982 -12.150 1.00 0.00 ATOM 758 CB THR 100 -33.539 23.305 -12.108 1.00 0.00 ATOM 759 CG2 THR 100 -34.457 23.419 -13.315 1.00 0.00 ATOM 760 OG1 THR 100 -34.338 23.352 -10.919 1.00 0.00 ATOM 761 O THR 100 -31.174 21.940 -13.970 1.00 0.00 ATOM 762 C THR 100 -31.389 22.211 -12.783 1.00 0.00 ATOM 763 N LYS 101 -30.487 22.745 -11.964 1.00 0.00 ATOM 764 CA LYS 101 -29.121 23.033 -12.360 1.00 0.00 ATOM 765 CB LYS 101 -28.376 23.746 -11.229 1.00 0.00 ATOM 766 CG LYS 101 -26.942 24.119 -11.569 1.00 0.00 ATOM 767 CD LYS 101 -26.283 24.879 -10.430 1.00 0.00 ATOM 768 CE LYS 101 -24.841 25.228 -10.759 1.00 0.00 ATOM 769 NZ LYS 101 -24.183 25.973 -9.651 1.00 0.00 ATOM 770 O LYS 101 -28.123 21.482 -13.882 1.00 0.00 ATOM 771 C LYS 101 -28.476 21.705 -12.728 1.00 0.00 ATOM 772 N GLN 102 -28.351 20.830 -11.732 1.00 0.00 ATOM 773 CA GLN 102 -27.781 19.485 -11.849 1.00 0.00 ATOM 774 CB GLN 102 -28.329 18.574 -10.748 1.00 0.00 ATOM 775 CG GLN 102 -27.315 17.580 -10.204 1.00 0.00 ATOM 776 CD GLN 102 -27.352 17.481 -8.691 1.00 0.00 ATOM 777 OE1 GLN 102 -28.418 17.562 -8.080 1.00 0.00 ATOM 778 NE2 GLN 102 -26.186 17.304 -8.081 1.00 0.00 ATOM 779 O GLN 102 -27.171 18.143 -13.733 1.00 0.00 ATOM 780 C GLN 102 -28.037 18.824 -13.200 1.00 0.00 ATOM 781 N GLN 103 -29.233 19.022 -13.741 1.00 0.00 ATOM 782 CA GLN 103 -29.600 18.447 -15.023 1.00 0.00 ATOM 783 CB GLN 103 -31.124 18.373 -15.161 1.00 0.00 ATOM 784 CG GLN 103 -31.782 17.364 -14.235 1.00 0.00 ATOM 785 CD GLN 103 -33.294 17.377 -14.342 1.00 0.00 ATOM 786 OE1 GLN 103 -33.891 18.387 -14.715 1.00 0.00 ATOM 787 NE2 GLN 103 -33.918 16.251 -14.016 1.00 0.00 ATOM 788 O GLN 103 -28.399 18.702 -17.063 1.00 0.00 ATOM 789 C GLN 103 -29.009 19.252 -16.153 1.00 0.00 ATOM 790 N ALA 104 -29.192 20.563 -16.094 1.00 0.00 ATOM 791 CA ALA 104 -28.662 21.444 -17.122 1.00 0.00 ATOM 792 CB ALA 104 -29.073 22.884 -16.851 1.00 0.00 ATOM 793 O ALA 104 -26.571 21.668 -18.256 1.00 0.00 ATOM 794 C ALA 104 -27.144 21.352 -17.221 1.00 0.00 ATOM 795 N VAL 105 -26.504 20.916 -16.138 1.00 0.00 ATOM 796 CA VAL 105 -25.053 20.794 -16.082 1.00 0.00 ATOM 797 CB VAL 105 -24.513 21.119 -14.676 1.00 0.00 ATOM 798 CG1 VAL 105 -23.019 20.850 -14.605 1.00 0.00 ATOM 799 CG2 VAL 105 -24.818 22.562 -14.310 1.00 0.00 ATOM 800 O VAL 105 -23.574 19.296 -17.197 1.00 0.00 ATOM 801 C VAL 105 -24.566 19.431 -16.485 1.00 0.00 ATOM 802 N ASN 106 -25.248 18.403 -16.011 1.00 0.00 ATOM 803 CA ASN 106 -24.849 17.057 -16.359 1.00 0.00 ATOM 804 CB ASN 106 -25.695 16.034 -15.597 1.00 0.00 ATOM 805 CG ASN 106 -24.968 15.453 -14.400 1.00 0.00 ATOM 806 ND2 ASN 106 -25.636 15.443 -13.252 1.00 0.00 ATOM 807 OD1 ASN 106 -23.821 15.020 -14.509 1.00 0.00 ATOM 808 O ASN 106 -24.062 16.392 -18.495 1.00 0.00 ATOM 809 C ASN 106 -24.972 16.895 -17.846 1.00 0.00 ATOM 810 N ASN 107 -26.095 17.344 -18.389 1.00 0.00 ATOM 811 CA ASN 107 -26.326 17.225 -19.816 1.00 0.00 ATOM 812 CB ASN 107 -27.673 17.846 -20.194 1.00 0.00 ATOM 813 CG ASN 107 -28.413 17.038 -21.242 1.00 0.00 ATOM 814 ND2 ASN 107 -29.042 15.951 -20.815 1.00 0.00 ATOM 815 OD1 ASN 107 -28.416 17.390 -22.422 1.00 0.00 ATOM 816 O ASN 107 -24.748 17.351 -21.619 1.00 0.00 ATOM 817 C ASN 107 -25.194 17.871 -20.598 1.00 0.00 ATOM 818 N THR 108 -24.715 19.005 -20.103 1.00 0.00 ATOM 819 CA THR 108 -23.625 19.709 -20.754 1.00 0.00 ATOM 820 CB THR 108 -23.308 21.039 -20.047 1.00 0.00 ATOM 821 CG2 THR 108 -22.135 21.735 -20.719 1.00 0.00 ATOM 822 OG1 THR 108 -24.451 21.902 -20.111 1.00 0.00 ATOM 823 O THR 108 -21.716 18.719 -21.810 1.00 0.00 ATOM 824 C THR 108 -22.379 18.825 -20.787 1.00 0.00 ATOM 825 N TYR 109 -22.072 18.186 -19.665 1.00 0.00 ATOM 826 CA TYR 109 -20.894 17.334 -19.567 1.00 0.00 ATOM 827 CB TYR 109 -20.751 16.778 -18.149 1.00 0.00 ATOM 828 CG TYR 109 -19.527 15.912 -17.951 1.00 0.00 ATOM 829 CD1 TYR 109 -18.323 16.467 -17.536 1.00 0.00 ATOM 830 CD2 TYR 109 -19.580 14.544 -18.179 1.00 0.00 ATOM 831 CE1 TYR 109 -17.199 15.684 -17.351 1.00 0.00 ATOM 832 CE2 TYR 109 -18.466 13.744 -18.001 1.00 0.00 ATOM 833 CZ TYR 109 -17.270 14.327 -17.583 1.00 0.00 ATOM 834 OH TYR 109 -16.153 13.546 -17.401 1.00 0.00 ATOM 835 O TYR 109 -19.890 15.898 -21.199 1.00 0.00 ATOM 836 C TYR 109 -20.897 16.177 -20.543 1.00 0.00 ATOM 837 N GLY 110 -22.018 15.471 -20.598 1.00 0.00 ATOM 838 CA GLY 110 -22.130 14.350 -21.507 1.00 0.00 ATOM 839 O GLY 110 -21.282 14.196 -23.727 1.00 0.00 ATOM 840 C GLY 110 -21.971 14.820 -22.930 1.00 0.00 ATOM 841 N GLN 111 -22.622 15.928 -23.249 1.00 0.00 ATOM 842 CA GLN 111 -22.564 16.500 -24.581 1.00 0.00 ATOM 843 CB GLN 111 -23.428 17.760 -24.660 1.00 0.00 ATOM 844 CG GLN 111 -24.922 17.496 -24.565 1.00 0.00 ATOM 845 CD GLN 111 -25.742 18.771 -24.608 1.00 0.00 ATOM 846 OE1 GLN 111 -25.327 19.767 -25.199 1.00 0.00 ATOM 847 NE2 GLN 111 -26.913 18.741 -23.981 1.00 0.00 ATOM 848 O GLN 111 -20.805 16.952 -26.187 1.00 0.00 ATOM 849 C GLN 111 -21.125 16.827 -24.989 1.00 0.00 ATOM 850 N PHE 112 -20.252 16.970 -24.000 1.00 0.00 ATOM 851 CA PHE 112 -18.848 17.278 -24.259 1.00 0.00 ATOM 852 CB PHE 112 -18.277 18.153 -23.141 1.00 0.00 ATOM 853 CG PHE 112 -16.837 18.529 -23.344 1.00 0.00 ATOM 854 CD1 PHE 112 -16.482 19.493 -24.273 1.00 0.00 ATOM 855 CD2 PHE 112 -15.836 17.924 -22.604 1.00 0.00 ATOM 856 CE1 PHE 112 -15.158 19.841 -24.458 1.00 0.00 ATOM 857 CE2 PHE 112 -14.512 18.271 -22.791 1.00 0.00 ATOM 858 CZ PHE 112 -14.172 19.224 -23.713 1.00 0.00 ATOM 859 O PHE 112 -17.300 15.855 -25.384 1.00 0.00 ATOM 860 C PHE 112 -18.019 16.005 -24.400 1.00 0.00 ATOM 861 N PRO 113 -18.129 15.094 -23.434 1.00 0.00 ATOM 862 CA PRO 113 -17.383 13.859 -23.512 1.00 0.00 ATOM 863 CB PRO 113 -17.716 13.142 -22.202 1.00 0.00 ATOM 864 CG PRO 113 -18.013 14.241 -21.240 1.00 0.00 ATOM 865 CD PRO 113 -18.760 15.287 -22.018 1.00 0.00 ATOM 866 O PRO 113 -17.034 12.611 -25.547 1.00 0.00 ATOM 867 C PRO 113 -17.848 13.078 -24.741 1.00 0.00 ATOM 868 N ASP 114 -19.167 12.960 -24.887 1.00 0.00 ATOM 869 CA ASP 114 -19.760 12.249 -26.009 1.00 0.00 ATOM 870 CB ASP 114 -21.233 11.943 -25.731 1.00 0.00 ATOM 871 CG ASP 114 -21.417 10.908 -24.641 1.00 0.00 ATOM 872 OD1 ASP 114 -20.436 10.208 -24.314 1.00 0.00 ATOM 873 OD2 ASP 114 -22.544 10.795 -24.113 1.00 0.00 ATOM 874 O ASP 114 -20.440 12.955 -28.202 1.00 0.00 ATOM 875 C ASP 114 -19.621 13.050 -27.288 1.00 0.00 ATOM 876 N HIS 115 -18.537 13.809 -27.362 1.00 0.00 ATOM 877 CA HIS 115 -18.233 14.618 -28.525 1.00 0.00 ATOM 878 CB HIS 115 -17.998 16.075 -28.120 1.00 0.00 ATOM 879 CG HIS 115 -17.712 16.985 -29.273 1.00 0.00 ATOM 880 CD2 HIS 115 -16.533 17.662 -29.793 1.00 0.00 ATOM 881 ND1 HIS 115 -18.685 17.388 -30.162 1.00 0.00 ATOM 882 CE1 HIS 115 -18.129 18.198 -31.081 1.00 0.00 ATOM 883 NE2 HIS 115 -16.839 18.366 -30.867 1.00 0.00 ATOM 884 O HIS 115 -15.950 13.820 -28.688 1.00 0.00 ATOM 885 C HIS 115 -17.011 14.084 -29.276 1.00 0.00 ATOM 886 N ALA 116 -17.166 13.902 -30.581 1.00 0.00 ATOM 887 CA ALA 116 -16.078 13.403 -31.416 1.00 0.00 ATOM 888 CB ALA 116 -16.618 12.467 -32.486 1.00 0.00 ATOM 889 O ALA 116 -15.978 15.454 -32.672 1.00 0.00 ATOM 890 C ALA 116 -15.360 14.608 -32.027 1.00 0.00 ATOM 891 N LEU 117 -14.052 14.680 -31.802 1.00 0.00 ATOM 892 CA LEU 117 -13.229 15.778 -32.317 1.00 0.00 ATOM 893 CB LEU 117 -12.101 16.106 -31.337 1.00 0.00 ATOM 894 CG LEU 117 -12.487 16.180 -29.858 1.00 0.00 ATOM 895 CD1 LEU 117 -12.068 14.913 -29.129 1.00 0.00 ATOM 896 CD2 LEU 117 -11.862 17.401 -29.200 1.00 0.00 ATOM 897 O LEU 117 -12.432 14.302 -34.058 1.00 0.00 ATOM 898 C LEU 117 -12.622 15.471 -33.710 1.00 0.00 ATOM 899 N LEU 118 -12.311 16.518 -34.494 1.00 0.00 ATOM 900 CA LEU 118 -11.746 16.380 -35.868 1.00 0.00 ATOM 901 CB LEU 118 -12.733 15.654 -36.784 1.00 0.00 ATOM 902 CG LEU 118 -12.287 15.445 -38.232 1.00 0.00 ATOM 903 CD1 LEU 118 -11.064 14.541 -38.293 1.00 0.00 ATOM 904 CD2 LEU 118 -13.418 14.859 -39.063 1.00 0.00 ATOM 905 O LEU 118 -12.205 18.421 -37.153 1.00 0.00 ATOM 906 C LEU 118 -11.373 17.763 -36.496 1.00 0.00 TER END