PFRMAT TS TARGET T0617 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 T0617 model 3 Fri Jul 2 23:31:08 2010 MODEL 3 PARENT N/A ATOM 2 N ASN 8 -2.185 -11.799 31.341 1.00 0.00 ATOM 3 CA ASN 8 -0.846 -11.308 31.030 1.00 0.00 ATOM 4 CB ASN 8 0.186 -12.424 31.193 1.00 0.00 ATOM 5 CG ASN 8 1.611 -11.924 31.064 1.00 0.00 ATOM 6 ND2 ASN 8 2.381 -12.052 32.138 1.00 0.00 ATOM 7 OD1 ASN 8 2.013 -11.431 30.012 1.00 0.00 ATOM 8 O ASN 8 -1.521 -11.288 28.710 1.00 0.00 ATOM 9 C ASN 8 -0.859 -10.739 29.611 1.00 0.00 ATOM 10 N ILE 9 -0.125 -9.646 29.417 1.00 0.00 ATOM 11 CA ILE 9 -0.135 -8.926 28.147 1.00 0.00 ATOM 12 CB ILE 9 0.693 -7.631 28.225 1.00 0.00 ATOM 13 CG1 ILE 9 0.014 -6.619 29.151 1.00 0.00 ATOM 14 CG2 ILE 9 0.923 -7.060 26.835 1.00 0.00 ATOM 15 CD1 ILE 9 0.887 -5.437 29.508 1.00 0.00 ATOM 16 O ILE 9 -0.199 -9.705 25.874 1.00 0.00 ATOM 17 C ILE 9 0.379 -9.762 26.969 1.00 0.00 ATOM 18 N ASP 10 1.427 -10.556 27.216 1.00 0.00 ATOM 19 CA ASP 10 2.135 -11.307 26.158 1.00 0.00 ATOM 20 CB ASP 10 3.478 -11.824 26.676 1.00 0.00 ATOM 21 CG ASP 10 4.296 -10.742 27.354 1.00 0.00 ATOM 22 OD1 ASP 10 5.148 -10.130 26.677 1.00 0.00 ATOM 23 OD2 ASP 10 4.086 -10.508 28.563 1.00 0.00 ATOM 24 O ASP 10 1.784 -13.098 24.600 1.00 0.00 ATOM 25 C ASP 10 1.362 -12.495 25.584 1.00 0.00 ATOM 26 N ARG 11 0.245 -12.833 26.218 1.00 0.00 ATOM 27 CA ARG 11 -0.696 -13.822 25.689 1.00 0.00 ATOM 28 CB ARG 11 -1.343 -14.610 26.831 1.00 0.00 ATOM 29 CG ARG 11 -0.372 -15.480 27.611 1.00 0.00 ATOM 30 CD ARG 11 -1.052 -16.134 28.803 1.00 0.00 ATOM 31 NE ARG 11 -1.484 -15.153 29.795 1.00 0.00 ATOM 32 CZ ARG 11 -2.273 -15.431 30.826 1.00 0.00 ATOM 33 NH1 ARG 11 -2.613 -14.472 31.678 1.00 0.00 ATOM 34 NH2 ARG 11 -2.722 -16.665 31.004 1.00 0.00 ATOM 35 O ARG 11 -2.482 -13.862 24.083 1.00 0.00 ATOM 36 C ARG 11 -1.783 -13.177 24.833 1.00 0.00 ATOM 37 N HIS 12 -1.937 -11.864 24.947 1.00 0.00 ATOM 38 CA HIS 12 -2.992 -11.177 24.213 1.00 0.00 ATOM 39 CB HIS 12 -3.194 -9.763 24.760 1.00 0.00 ATOM 40 CG HIS 12 -4.367 -9.047 24.169 1.00 0.00 ATOM 41 CD2 HIS 12 -5.675 -8.622 24.648 1.00 0.00 ATOM 42 ND1 HIS 12 -4.389 -8.607 22.863 1.00 0.00 ATOM 43 CE1 HIS 12 -5.567 -8.005 22.623 1.00 0.00 ATOM 44 NE2 HIS 12 -6.343 -8.011 23.689 1.00 0.00 ATOM 45 O HIS 12 -1.552 -10.683 22.386 1.00 0.00 ATOM 46 C HIS 12 -2.623 -11.154 22.751 1.00 0.00 ATOM 47 N ALA 13 -3.510 -11.684 21.918 1.00 0.00 ATOM 48 CA ALA 13 -3.270 -11.781 20.486 1.00 0.00 ATOM 49 CB ALA 13 -4.396 -12.548 19.811 1.00 0.00 ATOM 50 O ALA 13 -2.432 -10.326 18.784 1.00 0.00 ATOM 51 C ALA 13 -3.115 -10.426 19.793 1.00 0.00 ATOM 52 N THR 14 -3.705 -9.379 20.343 1.00 0.00 ATOM 53 CA THR 14 -3.501 -8.029 19.806 1.00 0.00 ATOM 54 CB THR 14 -4.417 -7.001 20.497 1.00 0.00 ATOM 55 CG2 THR 14 -4.156 -5.605 19.955 1.00 0.00 ATOM 56 OG1 THR 14 -5.788 -7.339 20.254 1.00 0.00 ATOM 57 O THR 14 -1.526 -6.980 18.971 1.00 0.00 ATOM 58 C THR 14 -2.071 -7.523 19.919 1.00 0.00 ATOM 59 N ALA 15 -1.471 -7.707 21.091 1.00 0.00 ATOM 60 CA ALA 15 -0.068 -7.353 21.347 1.00 0.00 ATOM 61 CB ALA 15 0.291 -7.633 22.799 1.00 0.00 ATOM 62 O ALA 15 1.767 -7.560 19.795 1.00 0.00 ATOM 63 C ALA 15 0.859 -8.131 20.403 1.00 0.00 ATOM 64 N GLN 16 0.597 -9.432 20.274 1.00 0.00 ATOM 65 CA GLN 16 1.348 -10.323 19.394 1.00 0.00 ATOM 66 CB GLN 16 0.859 -11.764 19.549 1.00 0.00 ATOM 67 CG GLN 16 1.220 -12.402 20.879 1.00 0.00 ATOM 68 CD GLN 16 0.624 -13.788 21.044 1.00 0.00 ATOM 69 OE1 GLN 16 0.122 -14.374 20.084 1.00 0.00 ATOM 70 NE2 GLN 16 0.679 -14.313 22.261 1.00 0.00 ATOM 71 O GLN 16 2.224 -9.745 17.248 1.00 0.00 ATOM 72 C GLN 16 1.226 -9.878 17.932 1.00 0.00 ATOM 73 N ILE 17 -0.001 -9.624 17.471 1.00 0.00 ATOM 74 CA ILE 17 -0.225 -9.120 16.106 1.00 0.00 ATOM 75 CB ILE 17 -1.723 -8.892 15.827 1.00 0.00 ATOM 76 CG1 ILE 17 -2.466 -10.227 15.783 1.00 0.00 ATOM 77 CG2 ILE 17 -1.910 -8.095 14.545 1.00 0.00 ATOM 78 CD1 ILE 17 -3.973 -10.088 15.797 1.00 0.00 ATOM 79 O ILE 17 1.124 -7.710 14.771 1.00 0.00 ATOM 80 C ILE 17 0.527 -7.839 15.823 1.00 0.00 ATOM 81 N ASN 18 0.512 -6.908 16.769 1.00 0.00 ATOM 82 CA ASN 18 1.227 -5.636 16.621 1.00 0.00 ATOM 83 CB ASN 18 0.937 -4.716 17.809 1.00 0.00 ATOM 84 CG ASN 18 -0.463 -4.135 17.766 1.00 0.00 ATOM 85 ND2 ASN 18 -0.942 -3.668 18.913 1.00 0.00 ATOM 86 OD1 ASN 18 -1.103 -4.107 16.715 1.00 0.00 ATOM 87 O ASN 18 3.369 -5.243 15.610 1.00 0.00 ATOM 88 C ASN 18 2.729 -5.847 16.470 1.00 0.00 ATOM 89 N MET 19 3.290 -6.714 17.305 1.00 0.00 ATOM 90 CA MET 19 4.730 -7.001 17.264 1.00 0.00 ATOM 91 CB MET 19 5.129 -7.906 18.432 1.00 0.00 ATOM 92 CG MET 19 6.605 -8.268 18.460 1.00 0.00 ATOM 93 SD MET 19 7.015 -9.413 19.790 1.00 0.00 ATOM 94 CE MET 19 6.267 -10.922 19.180 1.00 0.00 ATOM 95 O MET 19 6.209 -7.263 15.420 1.00 0.00 ATOM 96 C MET 19 5.185 -7.651 15.967 1.00 0.00 ATOM 97 N LEU 20 4.431 -8.656 15.503 1.00 0.00 ATOM 98 CA LEU 20 4.651 -9.288 14.194 1.00 0.00 ATOM 99 CB LEU 20 3.632 -10.405 13.961 1.00 0.00 ATOM 100 CG LEU 20 3.781 -11.651 14.837 1.00 0.00 ATOM 101 CD1 LEU 20 2.606 -12.597 14.630 1.00 0.00 ATOM 102 CD2 LEU 20 5.091 -12.364 14.538 1.00 0.00 ATOM 103 O LEU 20 5.375 -8.236 12.137 1.00 0.00 ATOM 104 C LEU 20 4.565 -8.241 13.074 1.00 0.00 ATOM 105 N ALA 21 3.588 -7.348 13.192 1.00 0.00 ATOM 106 CA ALA 21 3.434 -6.231 12.276 1.00 0.00 ATOM 107 CB ALA 21 2.179 -5.439 12.611 1.00 0.00 ATOM 108 O ALA 21 5.167 -4.957 11.236 1.00 0.00 ATOM 109 C ALA 21 4.648 -5.300 12.294 1.00 0.00 ATOM 110 N ASN 22 5.098 -4.903 13.486 1.00 0.00 ATOM 111 CA ASN 22 6.310 -4.077 13.659 1.00 0.00 ATOM 112 CB ASN 22 6.527 -3.744 15.136 1.00 0.00 ATOM 113 CG ASN 22 5.541 -2.715 15.652 1.00 0.00 ATOM 114 ND2 ASN 22 5.382 -2.657 16.970 1.00 0.00 ATOM 115 OD1 ASN 22 4.930 -1.981 14.874 1.00 0.00 ATOM 116 O ASN 22 8.395 -4.028 12.482 1.00 0.00 ATOM 117 C ASN 22 7.579 -4.718 13.100 1.00 0.00 ATOM 118 N LYS 23 7.754 -6.020 13.314 1.00 0.00 ATOM 119 CA LYS 23 8.912 -6.745 12.753 1.00 0.00 ATOM 120 CB LYS 23 8.947 -8.184 13.274 1.00 0.00 ATOM 121 CG LYS 23 9.312 -8.304 14.743 1.00 0.00 ATOM 122 CD LYS 23 9.310 -9.753 15.197 1.00 0.00 ATOM 123 CE LYS 23 9.660 -9.872 16.671 1.00 0.00 ATOM 124 NZ LYS 23 9.620 -11.285 17.140 1.00 0.00 ATOM 125 O LYS 23 9.864 -6.479 10.560 1.00 0.00 ATOM 126 C LYS 23 8.856 -6.729 11.229 1.00 0.00 ATOM 127 N LEU 24 7.669 -6.980 10.682 1.00 0.00 ATOM 128 CA LEU 24 7.499 -6.977 9.238 1.00 0.00 ATOM 129 CB LEU 24 6.061 -7.348 8.867 1.00 0.00 ATOM 130 CG LEU 24 5.723 -7.342 7.375 1.00 0.00 ATOM 131 CD1 LEU 24 6.573 -8.358 6.626 1.00 0.00 ATOM 132 CD2 LEU 24 4.245 -7.626 7.157 1.00 0.00 ATOM 133 O LEU 24 8.614 -5.512 7.699 1.00 0.00 ATOM 134 C LEU 24 7.865 -5.611 8.676 1.00 0.00 ATOM 135 N MET 25 7.349 -4.559 9.308 1.00 0.00 ATOM 136 CA MET 25 7.649 -3.175 8.907 1.00 0.00 ATOM 137 CB MET 25 6.970 -2.183 9.854 1.00 0.00 ATOM 138 CG MET 25 7.233 -0.725 9.519 1.00 0.00 ATOM 139 SD MET 25 6.460 0.408 10.691 1.00 0.00 ATOM 140 CE MET 25 7.495 0.164 12.131 1.00 0.00 ATOM 141 O MET 25 9.632 -2.168 7.980 1.00 0.00 ATOM 142 C MET 25 9.161 -2.876 8.863 1.00 0.00 ATOM 143 N LEU 26 9.906 -3.435 9.823 1.00 0.00 ATOM 144 CA LEU 26 11.359 -3.294 9.911 1.00 0.00 ATOM 145 CB LEU 26 11.866 -3.806 11.261 1.00 0.00 ATOM 146 CG LEU 26 11.470 -2.987 12.490 1.00 0.00 ATOM 147 CD1 LEU 26 11.888 -3.696 13.768 1.00 0.00 ATOM 148 CD2 LEU 26 12.088 -1.597 12.431 1.00 0.00 ATOM 149 O LEU 26 13.035 -3.496 8.197 1.00 0.00 ATOM 150 C LEU 26 12.102 -4.033 8.778 1.00 0.00 ATOM 151 N LYS 27 11.684 -5.260 8.474 1.00 0.00 ATOM 152 CA LYS 27 12.253 -6.052 7.361 1.00 0.00 ATOM 153 CB LYS 27 11.719 -7.486 7.397 1.00 0.00 ATOM 154 CG LYS 27 12.246 -8.315 8.557 1.00 0.00 ATOM 155 CD LYS 27 11.668 -9.720 8.538 1.00 0.00 ATOM 156 CE LYS 27 12.196 -10.549 9.697 1.00 0.00 ATOM 157 NZ LYS 27 11.605 -11.916 9.717 1.00 0.00 ATOM 158 O LYS 27 12.772 -5.408 5.095 1.00 0.00 ATOM 159 C LYS 27 11.944 -5.419 6.005 1.00 0.00 ATOM 160 N SER 28 10.729 -4.907 5.871 1.00 0.00 ATOM 161 CA SER 28 10.313 -4.276 4.647 1.00 0.00 ATOM 162 CB SER 28 8.820 -3.944 4.696 1.00 0.00 ATOM 163 OG SER 28 8.398 -3.308 3.500 1.00 0.00 ATOM 164 O SER 28 11.639 -2.817 3.237 1.00 0.00 ATOM 165 C SER 28 11.114 -2.995 4.352 1.00 0.00 ATOM 166 N SER 29 11.201 -2.114 5.343 1.00 0.00 ATOM 167 CA SER 29 11.992 -0.893 5.219 1.00 0.00 ATOM 168 CB SER 29 11.878 -0.049 6.490 1.00 0.00 ATOM 169 OG SER 29 12.458 -0.715 7.598 1.00 0.00 ATOM 170 O SER 29 14.110 -0.427 4.170 1.00 0.00 ATOM 171 C SER 29 13.475 -1.177 4.929 1.00 0.00 ATOM 172 N THR 30 14.020 -2.249 5.526 1.00 0.00 ATOM 173 CA THR 30 15.408 -2.652 5.285 1.00 0.00 ATOM 174 CB THR 30 15.902 -3.641 6.356 1.00 0.00 ATOM 175 CG2 THR 30 15.833 -3.009 7.737 1.00 0.00 ATOM 176 OG1 THR 30 15.077 -4.813 6.346 1.00 0.00 ATOM 177 O THR 30 16.640 -3.159 3.318 1.00 0.00 ATOM 178 C THR 30 15.587 -3.277 3.920 1.00 0.00 ATOM 179 N ALA 31 14.556 -3.946 3.432 1.00 0.00 ATOM 180 CA ALA 31 14.728 -4.867 2.316 1.00 0.00 ATOM 181 CB ALA 31 14.071 -6.203 2.625 1.00 0.00 ATOM 182 O ALA 31 14.656 -5.003 -0.063 1.00 0.00 ATOM 183 C ALA 31 14.214 -4.451 0.952 1.00 0.00 ATOM 187 N PHE 36 13.370 0.442 -2.713 1.00 0.00 ATOM 188 CA PHE 36 12.816 1.530 -3.540 1.00 0.00 ATOM 189 CB PHE 36 11.737 0.990 -4.483 1.00 0.00 ATOM 190 CG PHE 36 12.274 0.120 -5.583 1.00 0.00 ATOM 191 CD1 PHE 36 11.682 -1.097 -5.876 1.00 0.00 ATOM 192 CD2 PHE 36 13.372 0.518 -6.326 1.00 0.00 ATOM 193 CE1 PHE 36 12.175 -1.897 -6.889 1.00 0.00 ATOM 194 CE2 PHE 36 13.866 -0.283 -7.339 1.00 0.00 ATOM 195 CZ PHE 36 13.272 -1.486 -7.621 1.00 0.00 ATOM 196 O PHE 36 11.608 3.577 -3.260 1.00 0.00 ATOM 197 C PHE 36 12.229 2.669 -2.718 1.00 0.00 ATOM 198 N GLY 37 12.423 2.613 -1.406 1.00 0.00 ATOM 199 CA GLY 37 11.922 3.656 -0.520 1.00 0.00 ATOM 200 O GLY 37 9.916 4.689 0.229 1.00 0.00 ATOM 201 C GLY 37 10.405 3.727 -0.341 1.00 0.00 ATOM 202 N ILE 38 9.659 2.730 -0.823 1.00 0.00 ATOM 203 CA ILE 38 8.198 2.680 -0.623 1.00 0.00 ATOM 204 CB ILE 38 7.493 1.945 -1.779 1.00 0.00 ATOM 205 CG1 ILE 38 7.967 0.492 -1.854 1.00 0.00 ATOM 206 CG2 ILE 38 7.716 2.683 -3.091 1.00 0.00 ATOM 207 CD1 ILE 38 7.171 -0.359 -2.818 1.00 0.00 ATOM 208 O ILE 38 8.474 1.097 1.192 1.00 0.00 ATOM 209 C ILE 38 7.789 2.012 0.708 1.00 0.00 ATOM 210 N GLY 39 6.673 2.468 1.288 1.00 0.00 ATOM 211 CA GLY 39 6.071 1.805 2.451 1.00 0.00 ATOM 212 O GLY 39 5.023 0.301 0.871 1.00 0.00 ATOM 213 C GLY 39 5.338 0.501 2.053 1.00 0.00 ATOM 214 N MET 40 5.100 -0.413 3.028 1.00 0.00 ATOM 215 CA MET 40 4.280 -1.605 2.725 1.00 0.00 ATOM 216 CB MET 40 3.900 -2.334 4.014 1.00 0.00 ATOM 217 CG MET 40 5.060 -3.055 4.684 1.00 0.00 ATOM 218 SD MET 40 4.530 -4.106 6.051 1.00 0.00 ATOM 219 CE MET 40 4.145 -2.875 7.294 1.00 0.00 ATOM 220 O MET 40 2.704 -2.051 0.991 1.00 0.00 ATOM 221 C MET 40 2.997 -1.323 1.947 1.00 0.00 ATOM 222 N THR 41 2.233 -0.300 2.356 1.00 0.00 ATOM 223 CA THR 41 0.908 -0.031 1.769 1.00 0.00 ATOM 224 CB THR 41 0.058 0.867 2.687 1.00 0.00 ATOM 225 CG2 THR 41 -0.374 0.102 3.928 1.00 0.00 ATOM 226 OG1 THR 41 0.827 2.004 3.095 1.00 0.00 ATOM 227 O THR 41 0.313 0.300 -0.520 1.00 0.00 ATOM 228 C THR 41 1.059 0.619 0.411 1.00 0.00 ATOM 229 N GLU 42 2.045 1.509 0.286 1.00 0.00 ATOM 230 CA GLU 42 2.408 2.053 -1.016 1.00 0.00 ATOM 231 CB GLU 42 3.627 2.969 -0.893 1.00 0.00 ATOM 232 CG GLU 42 4.043 3.629 -2.198 1.00 0.00 ATOM 233 CD GLU 42 5.215 4.575 -2.025 1.00 0.00 ATOM 234 OE1 GLU 42 5.719 4.694 -0.889 1.00 0.00 ATOM 235 OE2 GLU 42 5.629 5.196 -3.026 1.00 0.00 ATOM 236 O GLU 42 2.265 1.050 -3.179 1.00 0.00 ATOM 237 C GLU 42 2.695 0.953 -2.035 1.00 0.00 ATOM 238 N TRP 43 3.374 -0.101 -1.590 1.00 0.00 ATOM 239 CA TRP 43 3.744 -1.257 -2.425 1.00 0.00 ATOM 240 CB TRP 43 4.798 -2.112 -1.720 1.00 0.00 ATOM 241 CG TRP 43 5.140 -3.372 -2.457 1.00 0.00 ATOM 242 CD1 TRP 43 4.809 -4.646 -2.097 1.00 0.00 ATOM 243 CD2 TRP 43 5.881 -3.478 -3.678 1.00 0.00 ATOM 244 CE2 TRP 43 5.960 -4.845 -4.000 1.00 0.00 ATOM 245 CE3 TRP 43 6.487 -2.549 -4.531 1.00 0.00 ATOM 246 NE1 TRP 43 5.296 -5.540 -3.020 1.00 0.00 ATOM 247 CZ2 TRP 43 6.618 -5.307 -5.139 1.00 0.00 ATOM 248 CZ3 TRP 43 7.138 -3.012 -5.658 1.00 0.00 ATOM 249 CH2 TRP 43 7.199 -4.377 -5.954 1.00 0.00 ATOM 250 O TRP 43 2.359 -2.539 -3.902 1.00 0.00 ATOM 251 C TRP 43 2.521 -2.101 -2.758 1.00 0.00 ATOM 252 N ARG 44 1.670 -2.327 -1.755 1.00 0.00 ATOM 253 CA ARG 44 0.425 -3.090 -1.902 1.00 0.00 ATOM 254 CB ARG 44 -0.318 -3.166 -0.566 1.00 0.00 ATOM 255 CG ARG 44 0.354 -4.055 0.467 1.00 0.00 ATOM 256 CD ARG 44 -0.386 -4.013 1.795 1.00 0.00 ATOM 257 NE ARG 44 0.245 -4.865 2.801 1.00 0.00 ATOM 258 CZ ARG 44 -0.084 -4.871 4.089 1.00 0.00 ATOM 259 NH1 ARG 44 0.546 -5.680 4.930 1.00 0.00 ATOM 260 NH2 ARG 44 -1.041 -4.068 4.532 1.00 0.00 ATOM 261 O ARG 44 -1.008 -3.205 -3.821 1.00 0.00 ATOM 262 C ARG 44 -0.487 -2.482 -2.967 1.00 0.00 ATOM 263 N ILE 45 -0.687 -1.167 -2.896 1.00 0.00 ATOM 264 CA ILE 45 -1.465 -0.438 -3.906 1.00 0.00 ATOM 265 CB ILE 45 -1.648 1.041 -3.520 1.00 0.00 ATOM 266 CG1 ILE 45 -2.481 1.159 -2.241 1.00 0.00 ATOM 267 CG2 ILE 45 -2.262 1.822 -4.671 1.00 0.00 ATOM 268 CD1 ILE 45 -3.879 0.594 -2.369 1.00 0.00 ATOM 269 O ILE 45 -1.513 -0.694 -6.253 1.00 0.00 ATOM 270 C ILE 45 -0.819 -0.534 -5.273 1.00 0.00 ATOM 271 N ILE 46 0.506 -0.447 -5.336 1.00 0.00 ATOM 272 CA ILE 46 1.231 -0.576 -6.616 1.00 0.00 ATOM 273 CB ILE 46 2.733 -0.285 -6.447 1.00 0.00 ATOM 274 CG1 ILE 46 2.957 1.191 -6.112 1.00 0.00 ATOM 275 CG2 ILE 46 3.501 -0.707 -7.690 1.00 0.00 ATOM 276 CD1 ILE 46 4.361 1.504 -5.640 1.00 0.00 ATOM 277 O ILE 46 0.662 -2.118 -8.381 1.00 0.00 ATOM 278 C ILE 46 1.024 -1.976 -7.209 1.00 0.00 ATOM 279 N SER 47 1.272 -2.998 -6.388 1.00 0.00 ATOM 280 CA SER 47 1.036 -4.381 -6.778 1.00 0.00 ATOM 281 CB SER 47 1.319 -5.323 -5.606 1.00 0.00 ATOM 282 OG SER 47 2.693 -5.311 -5.263 1.00 0.00 ATOM 283 O SER 47 -0.602 -5.065 -8.374 1.00 0.00 ATOM 284 C SER 47 -0.403 -4.566 -7.274 1.00 0.00 ATOM 285 N VAL 48 -1.384 -4.125 -6.486 1.00 0.00 ATOM 286 CA VAL 48 -2.790 -4.299 -6.840 1.00 0.00 ATOM 287 CB VAL 48 -3.720 -3.775 -5.729 1.00 0.00 ATOM 288 CG1 VAL 48 -3.635 -2.259 -5.633 1.00 0.00 ATOM 289 CG2 VAL 48 -5.153 -4.216 -5.983 1.00 0.00 ATOM 290 O VAL 48 -3.879 -4.232 -8.974 1.00 0.00 ATOM 291 C VAL 48 -3.191 -3.620 -8.158 1.00 0.00 ATOM 292 N LEU 49 -2.755 -2.374 -8.369 1.00 0.00 ATOM 293 CA LEU 49 -2.942 -1.690 -9.653 1.00 0.00 ATOM 294 CB LEU 49 -2.366 -0.273 -9.594 1.00 0.00 ATOM 295 CG LEU 49 -3.220 0.776 -8.878 1.00 0.00 ATOM 296 CD1 LEU 49 -2.473 2.097 -8.774 1.00 0.00 ATOM 297 CD2 LEU 49 -4.545 0.974 -9.600 1.00 0.00 ATOM 298 O LEU 49 -2.734 -2.222 -11.987 1.00 0.00 ATOM 299 C LEU 49 -2.314 -2.423 -10.842 1.00 0.00 ATOM 300 N SER 50 -1.293 -3.240 -10.580 1.00 0.00 ATOM 301 CA SER 50 -0.697 -4.080 -11.605 1.00 0.00 ATOM 302 CB SER 50 0.681 -4.572 -11.160 1.00 0.00 ATOM 303 OG SER 50 1.275 -5.391 -12.152 1.00 0.00 ATOM 304 O SER 50 -1.630 -5.669 -13.095 1.00 0.00 ATOM 305 C SER 50 -1.571 -5.261 -11.946 1.00 0.00 ATOM 306 N SER 51 -2.250 -5.820 -10.944 1.00 0.00 ATOM 307 CA SER 51 -3.216 -6.904 -11.158 1.00 0.00 ATOM 308 CB SER 51 -3.647 -7.509 -9.820 1.00 0.00 ATOM 309 OG SER 51 -4.592 -8.549 -10.009 1.00 0.00 ATOM 310 O SER 51 -4.904 -7.093 -12.861 1.00 0.00 ATOM 311 C SER 51 -4.453 -6.436 -11.925 1.00 0.00 ATOM 312 N ALA 52 -4.985 -5.290 -11.523 1.00 0.00 ATOM 313 CA ALA 52 -6.318 -4.855 -11.925 1.00 0.00 ATOM 314 CB ALA 52 -6.940 -3.985 -10.843 1.00 0.00 ATOM 315 O ALA 52 -7.325 -4.196 -13.992 1.00 0.00 ATOM 316 C ALA 52 -6.360 -4.090 -13.237 1.00 0.00 ATOM 317 N SER 53 -5.321 -3.312 -13.507 1.00 0.00 ATOM 318 CA SER 53 -5.392 -2.317 -14.561 1.00 0.00 ATOM 319 CB SER 53 -6.039 -2.910 -15.815 1.00 0.00 ATOM 320 OG SER 53 -5.871 -2.052 -16.930 1.00 0.00 ATOM 321 O SER 53 -6.344 -1.074 -12.755 1.00 0.00 ATOM 322 C SER 53 -6.184 -1.157 -13.982 1.00 0.00 ATOM 323 N ASP 54 -6.680 -0.254 -14.852 1.00 0.00 ATOM 324 CA ASP 54 -7.455 0.912 -14.405 1.00 0.00 ATOM 325 CB ASP 54 -7.983 1.696 -15.607 1.00 0.00 ATOM 326 CG ASP 54 -6.885 2.419 -16.362 1.00 0.00 ATOM 327 OD1 ASP 54 -6.316 3.382 -15.805 1.00 0.00 ATOM 328 OD2 ASP 54 -6.592 2.021 -17.508 1.00 0.00 ATOM 329 O ASP 54 -9.423 -0.359 -13.782 1.00 0.00 ATOM 330 C ASP 54 -8.643 0.550 -13.490 1.00 0.00 ATOM 331 N CYS 55 -8.750 1.283 -12.386 1.00 0.00 ATOM 332 CA CYS 55 -9.560 0.911 -11.239 1.00 0.00 ATOM 333 CB CYS 55 -8.803 -0.071 -10.343 1.00 0.00 ATOM 334 SG CYS 55 -9.864 -1.150 -9.354 1.00 0.00 ATOM 335 O CYS 55 -9.069 3.094 -10.444 1.00 0.00 ATOM 336 C CYS 55 -9.906 2.200 -10.525 1.00 0.00 ATOM 337 N SER 56 -11.149 2.324 -10.026 1.00 0.00 ATOM 338 CA SER 56 -11.489 3.484 -9.192 1.00 0.00 ATOM 339 CB SER 56 -12.978 3.475 -8.842 1.00 0.00 ATOM 340 OG SER 56 -13.304 4.545 -7.974 1.00 0.00 ATOM 341 O SER 56 -10.354 2.448 -7.347 1.00 0.00 ATOM 342 C SER 56 -10.645 3.512 -7.903 1.00 0.00 ATOM 343 N VAL 57 -10.267 4.702 -7.435 1.00 0.00 ATOM 344 CA VAL 57 -9.392 4.848 -6.250 1.00 0.00 ATOM 345 CB VAL 57 -9.115 6.329 -5.931 1.00 0.00 ATOM 346 CG1 VAL 57 -10.381 7.014 -5.440 1.00 0.00 ATOM 347 CG2 VAL 57 -8.002 6.454 -4.902 1.00 0.00 ATOM 348 O VAL 57 -9.214 3.512 -4.259 1.00 0.00 ATOM 349 C VAL 57 -9.944 4.182 -4.983 1.00 0.00 ATOM 350 N GLN 58 -11.233 4.365 -4.734 1.00 0.00 ATOM 351 CA GLN 58 -11.897 3.810 -3.553 1.00 0.00 ATOM 352 CB GLN 58 -13.269 4.459 -3.355 1.00 0.00 ATOM 353 CG GLN 58 -13.210 5.922 -2.951 1.00 0.00 ATOM 354 CD GLN 58 -14.586 6.542 -2.806 1.00 0.00 ATOM 355 OE1 GLN 58 -15.538 5.876 -2.402 1.00 0.00 ATOM 356 NE2 GLN 58 -14.693 7.824 -3.134 1.00 0.00 ATOM 357 O GLN 58 -12.019 1.585 -2.612 1.00 0.00 ATOM 358 C GLN 58 -12.061 2.292 -3.639 1.00 0.00 ATOM 359 N LYS 59 -12.243 1.804 -4.866 1.00 0.00 ATOM 360 CA LYS 59 -12.248 0.374 -5.124 1.00 0.00 ATOM 361 CB LYS 59 -12.740 0.086 -6.544 1.00 0.00 ATOM 362 CG LYS 59 -14.221 0.360 -6.755 1.00 0.00 ATOM 363 CD LYS 59 -14.638 0.066 -8.186 1.00 0.00 ATOM 364 CE LYS 59 -16.118 0.338 -8.396 1.00 0.00 ATOM 365 NZ LYS 59 -16.533 0.095 -9.806 1.00 0.00 ATOM 366 O LYS 59 -10.735 -1.313 -4.377 1.00 0.00 ATOM 367 C LYS 59 -10.863 -0.218 -4.919 1.00 0.00 ATOM 368 N ILE 60 -9.833 0.497 -5.367 1.00 0.00 ATOM 369 CA ILE 60 -8.460 0.097 -5.119 1.00 0.00 ATOM 370 CB ILE 60 -7.462 1.092 -5.739 1.00 0.00 ATOM 371 CG1 ILE 60 -7.524 1.027 -7.266 1.00 0.00 ATOM 372 CG2 ILE 60 -6.057 0.833 -5.219 1.00 0.00 ATOM 373 CD1 ILE 60 -6.791 2.158 -7.956 1.00 0.00 ATOM 374 O ILE 60 -7.610 -0.949 -3.115 1.00 0.00 ATOM 375 C ILE 60 -8.254 -0.026 -3.595 1.00 0.00 ATOM 376 N SER 61 -8.860 0.907 -2.864 1.00 0.00 ATOM 377 CA SER 61 -8.820 0.932 -1.424 1.00 0.00 ATOM 378 CB SER 61 -9.539 2.171 -0.887 1.00 0.00 ATOM 379 OG SER 61 -10.919 2.138 -1.209 1.00 0.00 ATOM 380 O SER 61 -8.840 -0.935 0.034 1.00 0.00 ATOM 381 C SER 61 -9.433 -0.311 -0.838 1.00 0.00 ATOM 382 N ASP 62 -10.607 -0.676 -1.344 1.00 0.00 ATOM 383 CA ASP 62 -11.365 -1.822 -0.844 1.00 0.00 ATOM 384 CB ASP 62 -12.807 -1.774 -1.353 1.00 0.00 ATOM 385 CG ASP 62 -13.613 -0.659 -0.718 1.00 0.00 ATOM 386 OD1 ASP 62 -13.171 -0.125 0.323 1.00 0.00 ATOM 387 OD2 ASP 62 -14.684 -0.315 -1.261 1.00 0.00 ATOM 388 O ASP 62 -11.249 -4.222 -0.729 1.00 0.00 ATOM 389 C ASP 62 -10.771 -3.192 -1.212 1.00 0.00 ATOM 390 N ILE 63 -9.750 -3.206 -2.072 1.00 0.00 ATOM 391 CA ILE 63 -9.068 -4.444 -2.451 1.00 0.00 ATOM 392 CB ILE 63 -8.857 -4.528 -3.974 1.00 0.00 ATOM 393 CG1 ILE 63 -10.204 -4.511 -4.701 1.00 0.00 ATOM 394 CG2 ILE 63 -8.036 -5.759 -4.330 1.00 0.00 ATOM 395 CD1 ILE 63 -11.121 -5.651 -4.313 1.00 0.00 ATOM 396 O ILE 63 -7.077 -5.612 -1.821 1.00 0.00 ATOM 397 C ILE 63 -7.735 -4.567 -1.734 1.00 0.00 ATOM 398 N LEU 64 -7.339 -3.503 -1.032 1.00 0.00 ATOM 399 CA LEU 64 -6.073 -3.489 -0.275 1.00 0.00 ATOM 400 CB LEU 64 -5.079 -2.518 -0.914 1.00 0.00 ATOM 401 CG LEU 64 -4.623 -2.852 -2.337 1.00 0.00 ATOM 402 CD1 LEU 64 -3.768 -1.730 -2.905 1.00 0.00 ATOM 403 CD2 LEU 64 -3.857 -4.166 -2.360 1.00 0.00 ATOM 404 O LEU 64 -5.338 -2.644 1.841 1.00 0.00 ATOM 405 C LEU 64 -6.275 -3.113 1.199 1.00 0.00 ATOM 406 N GLY 65 -7.495 -3.340 1.705 1.00 0.00 ATOM 407 CA GLY 65 -7.932 -3.006 3.068 1.00 0.00 ATOM 408 O GLY 65 -7.103 -1.306 4.564 1.00 0.00 ATOM 409 C GLY 65 -7.605 -1.565 3.475 1.00 0.00 ATOM 410 N LEU 66 -7.910 -0.630 2.594 1.00 0.00 ATOM 411 CA LEU 66 -7.607 0.760 2.834 1.00 0.00 ATOM 412 CB LEU 66 -6.487 1.233 1.905 1.00 0.00 ATOM 413 CG LEU 66 -5.136 0.533 2.062 1.00 0.00 ATOM 414 CD1 LEU 66 -4.173 0.973 0.969 1.00 0.00 ATOM 415 CD2 LEU 66 -4.542 0.812 3.434 1.00 0.00 ATOM 416 O LEU 66 -9.575 1.601 1.711 1.00 0.00 ATOM 417 C LEU 66 -8.797 1.691 2.667 1.00 0.00 ATOM 418 N ASP 67 -8.897 2.583 3.641 1.00 0.00 ATOM 419 CA ASP 67 -9.817 3.705 3.680 1.00 0.00 ATOM 420 CB ASP 67 -9.574 4.553 4.929 1.00 0.00 ATOM 421 CG ASP 67 -10.801 4.655 5.815 1.00 0.00 ATOM 422 OD1 ASP 67 -11.885 4.209 5.379 1.00 0.00 ATOM 423 OD2 ASP 67 -10.680 5.179 6.941 1.00 0.00 ATOM 424 O ASP 67 -8.660 4.647 1.849 1.00 0.00 ATOM 425 C ASP 67 -9.719 4.578 2.465 1.00 0.00 ATOM 426 N LYS 68 -10.810 5.286 2.172 1.00 0.00 ATOM 427 CA LYS 68 -10.833 6.332 1.154 1.00 0.00 ATOM 428 CB LYS 68 -12.213 6.992 1.099 1.00 0.00 ATOM 429 CG LYS 68 -12.335 8.086 0.050 1.00 0.00 ATOM 430 CD LYS 68 -13.740 8.664 0.015 1.00 0.00 ATOM 431 CE LYS 68 -13.853 9.781 -1.010 1.00 0.00 ATOM 432 NZ LYS 68 -15.226 10.356 -1.055 1.00 0.00 ATOM 433 O LYS 68 -9.006 7.747 0.512 1.00 0.00 ATOM 434 C LYS 68 -9.764 7.389 1.414 1.00 0.00 ATOM 435 N ALA 69 -9.711 7.879 2.650 1.00 0.00 ATOM 436 CA ALA 69 -8.665 8.810 3.090 1.00 0.00 ATOM 437 CB ALA 69 -8.949 9.295 4.503 1.00 0.00 ATOM 438 O ALA 69 -6.303 8.857 2.631 1.00 0.00 ATOM 439 C ALA 69 -7.254 8.193 3.040 1.00 0.00 ATOM 440 N ALA 70 -7.125 6.929 3.447 1.00 0.00 ATOM 441 CA ALA 70 -5.844 6.227 3.405 1.00 0.00 ATOM 442 CB ALA 70 -5.940 4.905 4.153 1.00 0.00 ATOM 443 O ALA 70 -4.241 6.298 1.652 1.00 0.00 ATOM 444 C ALA 70 -5.372 5.973 1.979 1.00 0.00 ATOM 445 N VAL 71 -6.230 5.398 1.133 1.00 0.00 ATOM 446 CA VAL 71 -5.853 5.144 -0.250 1.00 0.00 ATOM 447 CB VAL 71 -6.912 4.294 -0.976 1.00 0.00 ATOM 448 CG1 VAL 71 -8.161 5.119 -1.249 1.00 0.00 ATOM 449 CG2 VAL 71 -6.348 3.732 -2.272 1.00 0.00 ATOM 450 O VAL 71 -4.762 6.489 -1.880 1.00 0.00 ATOM 451 C VAL 71 -5.629 6.433 -1.013 1.00 0.00 ATOM 452 N SER 72 -6.403 7.468 -0.680 1.00 0.00 ATOM 453 CA SER 72 -6.242 8.788 -1.283 1.00 0.00 ATOM 454 CB SER 72 -7.142 9.809 -0.583 1.00 0.00 ATOM 455 OG SER 72 -6.988 11.098 -1.152 1.00 0.00 ATOM 456 O SER 72 -4.215 9.672 -2.220 1.00 0.00 ATOM 457 C SER 72 -4.781 9.236 -1.221 1.00 0.00 ATOM 458 N ARG 73 -4.173 9.100 -0.045 1.00 0.00 ATOM 459 CA ARG 73 -2.851 9.643 0.206 1.00 0.00 ATOM 460 CB ARG 73 -2.675 9.958 1.692 1.00 0.00 ATOM 461 CG ARG 73 -3.520 11.121 2.186 1.00 0.00 ATOM 462 CD ARG 73 -3.325 11.352 3.676 1.00 0.00 ATOM 463 NE ARG 73 -4.125 12.472 4.165 1.00 0.00 ATOM 464 CZ ARG 73 -4.216 12.823 5.444 1.00 0.00 ATOM 465 NH1 ARG 73 -4.969 13.856 5.796 1.00 0.00 ATOM 466 NH2 ARG 73 -3.554 12.138 6.368 1.00 0.00 ATOM 467 O ARG 73 -0.643 9.179 -0.594 1.00 0.00 ATOM 468 C ARG 73 -1.734 8.716 -0.242 1.00 0.00 ATOM 469 N THR 74 -1.986 7.412 -0.212 1.00 0.00 ATOM 470 CA THR 74 -1.051 6.468 -0.797 1.00 0.00 ATOM 471 CB THR 74 -1.492 5.014 -0.551 1.00 0.00 ATOM 472 CG2 THR 74 -0.523 4.045 -1.211 1.00 0.00 ATOM 473 OG1 THR 74 -1.515 4.750 0.857 1.00 0.00 ATOM 474 O THR 74 0.183 6.843 -2.829 1.00 0.00 ATOM 475 C THR 74 -0.933 6.745 -2.302 1.00 0.00 ATOM 476 N VAL 75 -2.076 6.886 -2.982 1.00 0.00 ATOM 477 CA VAL 75 -2.081 7.136 -4.428 1.00 0.00 ATOM 478 CB VAL 75 -3.510 7.090 -5.003 1.00 0.00 ATOM 479 CG1 VAL 75 -3.529 7.628 -6.425 1.00 0.00 ATOM 480 CG2 VAL 75 -4.056 5.671 -4.960 1.00 0.00 ATOM 481 O VAL 75 -0.716 8.603 -5.756 1.00 0.00 ATOM 482 C VAL 75 -1.433 8.486 -4.765 1.00 0.00 ATOM 483 N LYS 76 -1.667 9.488 -3.925 1.00 0.00 ATOM 484 CA LYS 76 -1.036 10.796 -4.115 1.00 0.00 ATOM 485 CB LYS 76 -1.623 11.821 -3.141 1.00 0.00 ATOM 486 CG LYS 76 -3.057 12.215 -3.447 1.00 0.00 ATOM 487 CD LYS 76 -3.581 13.224 -2.437 1.00 0.00 ATOM 488 CE LYS 76 -5.015 13.620 -2.743 1.00 0.00 ATOM 489 NZ LYS 76 -5.555 14.576 -1.736 1.00 0.00 ATOM 490 O LYS 76 1.207 11.350 -4.741 1.00 0.00 ATOM 491 C LYS 76 0.485 10.757 -3.943 1.00 0.00 ATOM 492 N LYS 77 0.966 10.037 -2.929 1.00 0.00 ATOM 493 CA LYS 77 2.405 9.833 -2.739 1.00 0.00 ATOM 494 CB LYS 77 2.679 9.177 -1.384 1.00 0.00 ATOM 495 CG LYS 77 2.418 10.083 -0.192 1.00 0.00 ATOM 496 CD LYS 77 2.698 9.366 1.119 1.00 0.00 ATOM 497 CE LYS 77 2.440 10.272 2.311 1.00 0.00 ATOM 498 NZ LYS 77 2.668 9.569 3.604 1.00 0.00 ATOM 499 O LYS 77 4.160 9.217 -4.249 1.00 0.00 ATOM 500 C LYS 77 3.028 8.984 -3.847 1.00 0.00 ATOM 501 N LEU 78 2.276 8.007 -4.343 1.00 0.00 ATOM 502 CA LEU 78 2.661 7.230 -5.516 1.00 0.00 ATOM 503 CB LEU 78 1.705 6.051 -5.715 1.00 0.00 ATOM 504 CG LEU 78 2.339 4.660 -5.732 1.00 0.00 ATOM 505 CD1 LEU 78 3.422 4.550 -4.670 1.00 0.00 ATOM 506 CD2 LEU 78 1.283 3.585 -5.522 1.00 0.00 ATOM 507 O LEU 78 3.431 7.855 -7.724 1.00 0.00 ATOM 508 C LEU 78 2.684 8.120 -6.776 1.00 0.00 ATOM 509 N GLU 79 1.871 9.181 -6.772 1.00 0.00 ATOM 510 CA GLU 79 1.787 10.117 -7.897 1.00 0.00 ATOM 511 CB GLU 79 0.497 10.935 -7.819 1.00 0.00 ATOM 512 CG GLU 79 0.296 11.890 -8.983 1.00 0.00 ATOM 513 CD GLU 79 -1.027 12.627 -8.911 1.00 0.00 ATOM 514 OE1 GLU 79 -1.800 12.368 -7.964 1.00 0.00 ATOM 515 OE2 GLU 79 -1.292 13.464 -9.801 1.00 0.00 ATOM 516 O GLU 79 3.647 11.183 -8.958 1.00 0.00 ATOM 517 C GLU 79 2.990 11.048 -7.932 1.00 0.00 ATOM 518 N GLU 80 3.259 11.685 -6.795 1.00 0.00 ATOM 519 CA GLU 80 4.454 12.504 -6.581 1.00 0.00 ATOM 520 CB GLU 80 4.642 12.796 -5.091 1.00 0.00 ATOM 521 CG GLU 80 5.835 13.685 -4.778 1.00 0.00 ATOM 522 CD GLU 80 5.674 15.089 -5.329 1.00 0.00 ATOM 523 OE1 GLU 80 4.524 15.492 -5.602 1.00 0.00 ATOM 524 OE2 GLU 80 6.698 15.785 -5.487 1.00 0.00 ATOM 525 O GLU 80 6.623 12.515 -7.636 1.00 0.00 ATOM 526 C GLU 80 5.723 11.834 -7.141 1.00 0.00 ATOM 527 N LYS 81 5.784 10.505 -7.071 1.00 0.00 ATOM 528 CA LYS 81 6.926 9.753 -7.588 1.00 0.00 ATOM 529 CB LYS 81 7.116 8.457 -6.796 1.00 0.00 ATOM 530 CG LYS 81 7.500 8.669 -5.341 1.00 0.00 ATOM 531 CD LYS 81 7.676 7.344 -4.618 1.00 0.00 ATOM 532 CE LYS 81 8.067 7.557 -3.164 1.00 0.00 ATOM 533 NZ LYS 81 8.208 6.267 -2.433 1.00 0.00 ATOM 534 O LYS 81 7.745 8.825 -9.638 1.00 0.00 ATOM 535 C LYS 81 6.819 9.403 -9.073 1.00 0.00 ATOM 536 N LYS 82 5.703 9.758 -9.701 1.00 0.00 ATOM 537 CA LYS 82 5.477 9.471 -11.123 1.00 0.00 ATOM 538 CB LYS 82 6.744 9.748 -11.934 1.00 0.00 ATOM 539 CG LYS 82 7.249 11.179 -11.827 1.00 0.00 ATOM 540 CD LYS 82 8.456 11.406 -12.721 1.00 0.00 ATOM 541 CE LYS 82 9.003 12.816 -12.563 1.00 0.00 ATOM 542 NZ LYS 82 10.233 13.028 -13.373 1.00 0.00 ATOM 543 O LYS 82 5.149 7.573 -12.547 1.00 0.00 ATOM 544 C LYS 82 5.028 8.046 -11.417 1.00 0.00 ATOM 545 N TYR 83 4.485 7.361 -10.412 1.00 0.00 ATOM 546 CA TYR 83 4.231 5.929 -10.546 1.00 0.00 ATOM 547 CB TYR 83 4.545 5.205 -9.235 1.00 0.00 ATOM 548 CG TYR 83 6.001 5.273 -8.831 1.00 0.00 ATOM 549 CD1 TYR 83 6.995 5.460 -9.782 1.00 0.00 ATOM 550 CD2 TYR 83 6.375 5.154 -7.498 1.00 0.00 ATOM 551 CE1 TYR 83 8.327 5.524 -9.422 1.00 0.00 ATOM 552 CE2 TYR 83 7.702 5.216 -7.119 1.00 0.00 ATOM 553 CZ TYR 83 8.682 5.402 -8.095 1.00 0.00 ATOM 554 OH TYR 83 10.008 5.466 -7.734 1.00 0.00 ATOM 555 O TYR 83 2.533 4.400 -11.261 1.00 0.00 ATOM 556 C TYR 83 2.810 5.564 -10.956 1.00 0.00 ATOM 557 N ILE 84 1.912 6.547 -10.969 1.00 0.00 ATOM 558 CA ILE 84 0.527 6.303 -11.384 1.00 0.00 ATOM 559 CB ILE 84 -0.442 6.386 -10.190 1.00 0.00 ATOM 560 CG1 ILE 84 -0.344 7.756 -9.517 1.00 0.00 ATOM 561 CG2 ILE 84 -0.179 5.253 -9.209 1.00 0.00 ATOM 562 CD1 ILE 84 -1.502 8.677 -9.834 1.00 0.00 ATOM 563 O ILE 84 0.649 8.358 -12.639 1.00 0.00 ATOM 564 C ILE 84 0.071 7.270 -12.468 1.00 0.00 ATOM 565 N GLU 85 -0.955 6.847 -13.210 1.00 0.00 ATOM 566 CA GLU 85 -1.670 7.718 -14.136 1.00 0.00 ATOM 567 CB GLU 85 -1.375 7.319 -15.583 1.00 0.00 ATOM 568 CG GLU 85 -2.032 8.216 -16.620 1.00 0.00 ATOM 569 CD GLU 85 -1.664 7.831 -18.039 1.00 0.00 ATOM 570 OE1 GLU 85 -2.294 6.902 -18.586 1.00 0.00 ATOM 571 OE2 GLU 85 -0.744 8.460 -18.605 1.00 0.00 ATOM 572 O GLU 85 -3.749 6.614 -13.517 1.00 0.00 ATOM 573 C GLU 85 -3.181 7.666 -13.861 1.00 0.00 ATOM 574 N VAL 86 -3.812 8.827 -13.982 1.00 0.00 ATOM 575 CA VAL 86 -5.252 8.936 -13.837 1.00 0.00 ATOM 576 CB VAL 86 -5.636 10.049 -12.844 1.00 0.00 ATOM 577 CG1 VAL 86 -5.093 9.737 -11.459 1.00 0.00 ATOM 578 CG2 VAL 86 -5.126 11.396 -13.330 1.00 0.00 ATOM 579 O VAL 86 -5.274 9.756 -16.111 1.00 0.00 ATOM 580 C VAL 86 -5.895 9.192 -15.199 1.00 0.00 ATOM 581 N ASN 87 -7.139 8.751 -15.337 1.00 0.00 ATOM 582 CA ASN 87 -7.878 8.904 -16.578 1.00 0.00 ATOM 583 CB ASN 87 -7.325 7.964 -17.651 1.00 0.00 ATOM 584 CG ASN 87 -7.507 6.501 -17.294 1.00 0.00 ATOM 585 ND2 ASN 87 -6.490 5.914 -16.672 1.00 0.00 ATOM 586 OD1 ASN 87 -8.550 5.909 -17.575 1.00 0.00 ATOM 587 O ASN 87 -9.692 7.817 -15.476 1.00 0.00 ATOM 588 C ASN 87 -9.353 8.649 -16.313 1.00 0.00 ATOM 589 N GLY 88 -10.209 9.370 -17.036 1.00 0.00 ATOM 590 CA GLY 88 -11.664 9.309 -16.906 1.00 0.00 ATOM 591 O GLY 88 -11.849 7.113 -17.865 1.00 0.00 ATOM 592 C GLY 88 -12.237 7.899 -17.001 1.00 0.00 ATOM 593 N HIS 89 -13.162 7.589 -16.102 1.00 0.00 ATOM 594 CA HIS 89 -13.936 6.362 -16.195 1.00 0.00 ATOM 595 CB HIS 89 -14.772 6.158 -14.930 1.00 0.00 ATOM 596 CG HIS 89 -15.476 4.838 -14.877 1.00 0.00 ATOM 597 CD2 HIS 89 -16.839 4.377 -15.098 1.00 0.00 ATOM 598 ND1 HIS 89 -14.830 3.663 -14.557 1.00 0.00 ATOM 599 CE1 HIS 89 -15.717 2.652 -14.591 1.00 0.00 ATOM 600 NE2 HIS 89 -16.924 3.074 -14.915 1.00 0.00 ATOM 601 O HIS 89 -15.562 7.435 -17.578 1.00 0.00 ATOM 602 C HIS 89 -14.800 6.478 -17.450 1.00 0.00 ATOM 603 N SER 90 -14.641 5.534 -18.402 1.00 0.00 ATOM 604 CA SER 90 -15.410 5.522 -19.657 1.00 0.00 ATOM 605 CB SER 90 -14.868 4.455 -20.610 1.00 0.00 ATOM 606 OG SER 90 -15.114 3.152 -20.111 1.00 0.00 ATOM 607 O SER 90 -17.683 5.526 -20.441 1.00 0.00 ATOM 608 C SER 90 -16.923 5.283 -19.501 1.00 0.00 ATOM 609 N GLU 91 -17.349 4.807 -18.335 1.00 0.00 ATOM 610 CA GLU 91 -18.754 4.518 -18.085 1.00 0.00 ATOM 611 CB GLU 91 -18.917 3.107 -17.515 1.00 0.00 ATOM 612 CG GLU 91 -18.485 2.001 -18.463 1.00 0.00 ATOM 613 CD GLU 91 -18.666 0.618 -17.866 1.00 0.00 ATOM 614 OE1 GLU 91 -19.068 0.528 -16.687 1.00 0.00 ATOM 615 OE2 GLU 91 -18.405 -0.375 -18.578 1.00 0.00 ATOM 616 O GLU 91 -20.540 5.484 -16.808 1.00 0.00 ATOM 617 C GLU 91 -19.349 5.540 -17.140 1.00 0.00 ATOM 618 N ASP 92 -18.527 6.483 -16.701 1.00 0.00 ATOM 619 CA ASP 92 -18.997 7.485 -15.768 1.00 0.00 ATOM 620 CB ASP 92 -19.187 6.875 -14.377 1.00 0.00 ATOM 621 CG ASP 92 -20.154 7.668 -13.522 1.00 0.00 ATOM 622 OD1 ASP 92 -20.212 8.906 -13.681 1.00 0.00 ATOM 623 OD2 ASP 92 -20.855 7.053 -12.690 1.00 0.00 ATOM 624 O ASP 92 -17.089 8.655 -14.898 1.00 0.00 ATOM 625 C ASP 92 -18.020 8.648 -15.713 1.00 0.00 ATOM 626 N LYS 93 -18.254 9.630 -16.581 1.00 0.00 ATOM 627 CA LYS 93 -17.377 10.777 -16.755 1.00 0.00 ATOM 628 CB LYS 93 -17.901 11.689 -17.866 1.00 0.00 ATOM 629 CG LYS 93 -19.209 12.386 -17.531 1.00 0.00 ATOM 630 CD LYS 93 -19.697 13.234 -18.695 1.00 0.00 ATOM 631 CE LYS 93 -21.002 13.934 -18.358 1.00 0.00 ATOM 632 NZ LYS 93 -21.505 14.750 -19.497 1.00 0.00 ATOM 633 O LYS 93 -16.225 12.467 -15.536 1.00 0.00 ATOM 634 C LYS 93 -17.141 11.655 -15.541 1.00 0.00 ATOM 635 N ARG 94 -17.960 11.508 -14.509 1.00 0.00 ATOM 636 CA ARG 94 -17.675 12.161 -13.235 1.00 0.00 ATOM 637 CB ARG 94 -18.932 12.206 -12.363 1.00 0.00 ATOM 638 CG ARG 94 -18.895 13.265 -11.274 1.00 0.00 ATOM 639 CD ARG 94 -20.192 13.290 -10.483 1.00 0.00 ATOM 640 NE ARG 94 -20.173 12.343 -9.370 1.00 0.00 ATOM 641 CZ ARG 94 -20.987 11.298 -9.267 1.00 0.00 ATOM 642 NH1 ARG 94 -20.897 10.490 -8.219 1.00 0.00 ATOM 643 NH2 ARG 94 -21.889 11.062 -10.210 1.00 0.00 ATOM 644 O ARG 94 -15.982 11.942 -11.546 1.00 0.00 ATOM 645 C ARG 94 -16.544 11.429 -12.516 1.00 0.00 ATOM 646 N THR 95 -16.194 10.243 -13.010 1.00 0.00 ATOM 647 CA THR 95 -15.293 9.346 -12.295 1.00 0.00 ATOM 648 CB THR 95 -15.872 7.922 -12.200 1.00 0.00 ATOM 649 CG2 THR 95 -14.910 7.005 -11.459 1.00 0.00 ATOM 650 OG1 THR 95 -17.115 7.955 -11.487 1.00 0.00 ATOM 651 O THR 95 -13.708 9.317 -14.112 1.00 0.00 ATOM 652 C THR 95 -13.893 9.231 -12.901 1.00 0.00 ATOM 653 N TYR 96 -12.915 9.038 -12.017 1.00 0.00 ATOM 654 CA TYR 96 -11.521 8.792 -12.382 1.00 0.00 ATOM 655 CB TYR 96 -10.588 9.696 -11.572 1.00 0.00 ATOM 656 CG TYR 96 -10.721 11.165 -11.901 1.00 0.00 ATOM 657 CD1 TYR 96 -11.661 11.956 -11.252 1.00 0.00 ATOM 658 CD2 TYR 96 -9.906 11.756 -12.857 1.00 0.00 ATOM 659 CE1 TYR 96 -11.789 13.301 -11.546 1.00 0.00 ATOM 660 CE2 TYR 96 -10.020 13.099 -13.163 1.00 0.00 ATOM 661 CZ TYR 96 -10.972 13.871 -12.498 1.00 0.00 ATOM 662 OH TYR 96 -11.099 15.209 -12.793 1.00 0.00 ATOM 663 O TYR 96 -11.631 6.661 -11.282 1.00 0.00 ATOM 664 C TYR 96 -11.128 7.339 -12.178 1.00 0.00 ATOM 665 N ALA 97 -10.210 6.885 -13.023 1.00 0.00 ATOM 666 CA ALA 97 -9.602 5.574 -12.919 1.00 0.00 ATOM 667 CB ALA 97 -9.847 4.775 -14.190 1.00 0.00 ATOM 668 O ALA 97 -7.508 6.646 -13.247 1.00 0.00 ATOM 669 C ALA 97 -8.130 5.778 -12.651 1.00 0.00 ATOM 670 N ILE 98 -7.581 4.982 -11.738 1.00 0.00 ATOM 671 CA ILE 98 -6.154 5.022 -11.429 1.00 0.00 ATOM 672 CB ILE 98 -5.905 5.037 -9.909 1.00 0.00 ATOM 673 CG1 ILE 98 -6.509 6.296 -9.283 1.00 0.00 ATOM 674 CG2 ILE 98 -4.419 4.912 -9.612 1.00 0.00 ATOM 675 CD1 ILE 98 -6.543 6.268 -7.771 1.00 0.00 ATOM 676 O ILE 98 -6.046 2.722 -12.158 1.00 0.00 ATOM 677 C ILE 98 -5.479 3.818 -12.090 1.00 0.00 ATOM 678 N ASN 99 -4.271 4.036 -12.592 1.00 0.00 ATOM 679 CA ASN 99 -3.563 3.029 -13.362 1.00 0.00 ATOM 680 CB ASN 99 -3.874 3.176 -14.852 1.00 0.00 ATOM 681 CG ASN 99 -3.352 4.476 -15.431 1.00 0.00 ATOM 682 ND2 ASN 99 -4.233 5.230 -16.079 1.00 0.00 ATOM 683 OD1 ASN 99 -2.171 4.796 -15.295 1.00 0.00 ATOM 684 O ASN 99 -1.621 4.200 -12.649 1.00 0.00 ATOM 685 C ASN 99 -2.086 3.152 -13.082 1.00 0.00 ATOM 686 N LEU 100 -1.344 2.086 -13.340 1.00 0.00 ATOM 687 CA LEU 100 0.115 2.151 -13.280 1.00 0.00 ATOM 688 CB LEU 100 0.714 0.744 -13.241 1.00 0.00 ATOM 689 CG LEU 100 1.373 0.323 -11.926 1.00 0.00 ATOM 690 CD1 LEU 100 0.531 0.764 -10.738 1.00 0.00 ATOM 691 CD2 LEU 100 1.592 -1.182 -11.891 1.00 0.00 ATOM 692 O LEU 100 0.317 2.676 -15.617 1.00 0.00 ATOM 693 C LEU 100 0.684 2.927 -14.463 1.00 0.00 ATOM 694 N THR 101 1.557 3.884 -14.165 1.00 0.00 ATOM 695 CA THR 101 2.489 4.456 -15.143 1.00 0.00 ATOM 696 CB THR 101 3.345 5.573 -14.519 1.00 0.00 ATOM 697 CG2 THR 101 2.458 6.692 -13.990 1.00 0.00 ATOM 698 OG1 THR 101 4.112 5.043 -13.432 1.00 0.00 ATOM 699 O THR 101 3.564 2.327 -15.153 1.00 0.00 ATOM 700 C THR 101 3.412 3.403 -15.735 1.00 0.00 ATOM 701 N GLU 102 4.050 3.718 -16.886 1.00 0.00 ATOM 702 CA GLU 102 5.223 2.954 -17.334 1.00 0.00 ATOM 703 CB GLU 102 5.804 3.564 -18.611 1.00 0.00 ATOM 704 CG GLU 102 6.991 2.802 -19.180 1.00 0.00 ATOM 705 CD GLU 102 7.501 3.399 -20.475 1.00 0.00 ATOM 706 OE1 GLU 102 6.943 4.427 -20.916 1.00 0.00 ATOM 707 OE2 GLU 102 8.458 2.842 -21.051 1.00 0.00 ATOM 708 O GLU 102 6.907 1.789 -16.072 1.00 0.00 ATOM 709 C GLU 102 6.337 2.866 -16.274 1.00 0.00 ATOM 710 N MET 103 6.638 3.985 -15.615 1.00 0.00 ATOM 711 CA MET 103 7.637 4.009 -14.540 1.00 0.00 ATOM 712 CB MET 103 7.979 5.450 -14.160 1.00 0.00 ATOM 713 CG MET 103 8.740 6.211 -15.233 1.00 0.00 ATOM 714 SD MET 103 9.026 7.936 -14.793 1.00 0.00 ATOM 715 CE MET 103 10.251 7.756 -13.499 1.00 0.00 ATOM 716 O MET 103 7.937 2.570 -12.642 1.00 0.00 ATOM 717 C MET 103 7.155 3.244 -13.296 1.00 0.00 ATOM 718 N GLY 104 5.866 3.349 -12.998 1.00 0.00 ATOM 719 CA GLY 104 5.225 2.566 -11.952 1.00 0.00 ATOM 720 O GLY 104 5.224 0.276 -11.327 1.00 0.00 ATOM 721 C GLY 104 5.171 1.085 -12.247 1.00 0.00 ATOM 722 N GLN 105 5.073 0.721 -13.526 1.00 0.00 ATOM 723 CA GLN 105 5.188 -0.683 -13.932 1.00 0.00 ATOM 724 CB GLN 105 4.701 -0.865 -15.371 1.00 0.00 ATOM 725 CG GLN 105 4.675 -2.312 -15.838 1.00 0.00 ATOM 726 CD GLN 105 3.698 -3.162 -15.048 1.00 0.00 ATOM 727 OE1 GLN 105 2.517 -2.831 -14.943 1.00 0.00 ATOM 728 NE2 GLN 105 4.190 -4.261 -14.489 1.00 0.00 ATOM 729 O GLN 105 6.878 -2.340 -13.394 1.00 0.00 ATOM 730 C GLN 105 6.640 -1.200 -13.803 1.00 0.00 ATOM 731 N GLU 106 7.599 -0.354 -14.165 1.00 0.00 ATOM 732 CA GLU 106 9.006 -0.714 -14.089 1.00 0.00 ATOM 733 CB GLU 106 9.867 0.332 -14.799 1.00 0.00 ATOM 734 CG GLU 106 9.698 0.352 -16.311 1.00 0.00 ATOM 735 CD GLU 106 10.520 1.440 -16.974 1.00 0.00 ATOM 736 OE1 GLU 106 11.068 2.296 -16.249 1.00 0.00 ATOM 737 OE2 GLU 106 10.615 1.436 -18.220 1.00 0.00 ATOM 738 O GLU 106 10.230 -1.746 -12.280 1.00 0.00 ATOM 739 C GLU 106 9.440 -0.862 -12.617 1.00 0.00 ATOM 740 N LEU 107 8.879 0.003 -11.763 1.00 0.00 ATOM 741 CA LEU 107 9.092 -0.008 -10.305 1.00 0.00 ATOM 742 CB LEU 107 8.360 1.163 -9.646 1.00 0.00 ATOM 743 CG LEU 107 8.456 1.252 -8.122 1.00 0.00 ATOM 744 CD1 LEU 107 9.902 1.427 -7.685 1.00 0.00 ATOM 745 CD2 LEU 107 7.602 2.396 -7.595 1.00 0.00 ATOM 746 O LEU 107 9.335 -1.917 -8.871 1.00 0.00 ATOM 747 C LEU 107 8.632 -1.324 -9.685 1.00 0.00 ATOM 748 N TYR 108 7.433 -1.753 -10.073 1.00 0.00 ATOM 749 CA TYR 108 6.868 -3.032 -9.660 1.00 0.00 ATOM 750 CB TYR 108 5.509 -3.258 -10.326 1.00 0.00 ATOM 751 CG TYR 108 4.874 -4.587 -9.984 1.00 0.00 ATOM 752 CD1 TYR 108 4.219 -4.772 -8.774 1.00 0.00 ATOM 753 CD2 TYR 108 4.930 -5.651 -10.875 1.00 0.00 ATOM 754 CE1 TYR 108 3.636 -5.984 -8.453 1.00 0.00 ATOM 755 CE2 TYR 108 4.352 -6.869 -10.572 1.00 0.00 ATOM 756 CZ TYR 108 3.701 -7.028 -9.348 1.00 0.00 ATOM 757 OH TYR 108 3.121 -8.235 -9.032 1.00 0.00 ATOM 758 O TYR 108 8.207 -4.930 -9.103 1.00 0.00 ATOM 759 C TYR 108 7.813 -4.185 -9.992 1.00 0.00 ATOM 760 N GLU 109 8.191 -4.314 -11.269 1.00 0.00 ATOM 761 CA GLU 109 9.124 -5.370 -11.710 1.00 0.00 ATOM 762 CB GLU 109 9.347 -5.291 -13.222 1.00 0.00 ATOM 763 CG GLU 109 8.067 -5.165 -14.033 1.00 0.00 ATOM 764 CD GLU 109 7.035 -6.208 -13.655 1.00 0.00 ATOM 765 OE1 GLU 109 7.402 -7.398 -13.549 1.00 0.00 ATOM 766 OE2 GLU 109 5.856 -5.837 -13.466 1.00 0.00 ATOM 767 O GLU 109 11.062 -6.355 -10.688 1.00 0.00 ATOM 768 C GLU 109 10.486 -5.318 -11.008 1.00 0.00 ATOM 769 N VAL 110 10.991 -4.107 -10.785 1.00 0.00 ATOM 770 CA VAL 110 12.291 -3.894 -10.140 1.00 0.00 ATOM 771 CB VAL 110 12.792 -2.453 -10.341 1.00 0.00 ATOM 772 CG1 VAL 110 14.044 -2.202 -9.514 1.00 0.00 ATOM 773 CG2 VAL 110 13.061 -2.182 -11.814 1.00 0.00 ATOM 774 O VAL 110 13.234 -4.489 -8.025 1.00 0.00 ATOM 775 C VAL 110 12.215 -4.217 -8.648 1.00 0.00 ATOM 776 N ALA 111 10.991 -4.204 -8.095 1.00 0.00 ATOM 777 CA ALA 111 10.758 -4.471 -6.684 1.00 0.00 ATOM 778 CB ALA 111 9.647 -3.579 -6.152 1.00 0.00 ATOM 779 O ALA 111 10.441 -6.256 -5.158 1.00 0.00 ATOM 780 C ALA 111 10.401 -5.903 -6.325 1.00 0.00 ATOM 781 N SER 112 10.061 -6.729 -7.313 1.00 0.00 ATOM 782 CA SER 112 9.583 -8.095 -7.047 1.00 0.00 ATOM 783 CB SER 112 9.286 -8.823 -8.359 1.00 0.00 ATOM 784 OG SER 112 8.200 -8.224 -9.042 1.00 0.00 ATOM 785 O SER 112 10.171 -9.515 -5.213 1.00 0.00 ATOM 786 C SER 112 10.563 -8.944 -6.225 1.00 0.00 ATOM 787 N ASP 113 11.812 -9.050 -6.664 1.00 0.00 ATOM 788 CA ASP 113 12.818 -9.863 -5.949 1.00 0.00 ATOM 789 CB ASP 113 14.197 -9.693 -6.589 1.00 0.00 ATOM 790 CG ASP 113 14.299 -10.367 -7.943 1.00 0.00 ATOM 791 OD1 ASP 113 13.411 -11.183 -8.268 1.00 0.00 ATOM 792 OD2 ASP 113 15.266 -10.081 -8.678 1.00 0.00 ATOM 793 O ASP 113 12.876 -10.398 -3.606 1.00 0.00 ATOM 794 C ASP 113 12.912 -9.521 -4.453 1.00 0.00 ATOM 795 N PHE 114 13.055 -8.237 -4.152 1.00 0.00 ATOM 796 CA PHE 114 13.112 -7.739 -2.778 1.00 0.00 ATOM 797 CB PHE 114 13.395 -6.236 -2.764 1.00 0.00 ATOM 798 CG PHE 114 14.818 -5.883 -3.089 1.00 0.00 ATOM 799 CD1 PHE 114 15.108 -4.811 -3.915 1.00 0.00 ATOM 800 CD2 PHE 114 15.866 -6.623 -2.572 1.00 0.00 ATOM 801 CE1 PHE 114 16.418 -4.487 -4.217 1.00 0.00 ATOM 802 CE2 PHE 114 17.175 -6.299 -2.872 1.00 0.00 ATOM 803 CZ PHE 114 17.453 -5.236 -3.690 1.00 0.00 ATOM 804 O PHE 114 11.869 -8.486 -0.842 1.00 0.00 ATOM 805 C PHE 114 11.810 -8.018 -1.979 1.00 0.00 ATOM 806 N ALA 115 10.649 -7.753 -2.567 1.00 0.00 ATOM 807 CA ALA 115 9.380 -8.058 -1.890 1.00 0.00 ATOM 808 CB ALA 115 8.203 -7.595 -2.736 1.00 0.00 ATOM 809 O ALA 115 8.745 -9.937 -0.521 1.00 0.00 ATOM 810 C ALA 115 9.244 -9.556 -1.587 1.00 0.00 ATOM 811 N ILE 116 9.718 -10.399 -2.504 1.00 0.00 ATOM 812 CA ILE 116 9.760 -11.840 -2.266 1.00 0.00 ATOM 813 CB ILE 116 10.185 -12.608 -3.532 1.00 0.00 ATOM 814 CG1 ILE 116 9.098 -12.509 -4.605 1.00 0.00 ATOM 815 CG2 ILE 116 10.516 -14.053 -3.193 1.00 0.00 ATOM 816 CD1 ILE 116 9.542 -12.989 -5.969 1.00 0.00 ATOM 817 O ILE 116 10.393 -13.045 -0.308 1.00 0.00 ATOM 818 C ILE 116 10.697 -12.177 -1.120 1.00 0.00 ATOM 819 N GLU 117 11.831 -11.485 -1.064 1.00 0.00 ATOM 820 CA GLU 117 12.840 -11.705 -0.031 1.00 0.00 ATOM 821 CB GLU 117 14.150 -11.008 -0.404 1.00 0.00 ATOM 822 CG GLU 117 15.187 -10.998 0.706 1.00 0.00 ATOM 823 CD GLU 117 15.570 -12.394 1.159 1.00 0.00 ATOM 824 OE1 GLU 117 15.188 -13.365 0.475 1.00 0.00 ATOM 825 OE2 GLU 117 16.252 -12.515 2.199 1.00 0.00 ATOM 826 O GLU 117 12.587 -11.909 2.343 1.00 0.00 ATOM 827 C GLU 117 12.380 -11.219 1.344 1.00 0.00 ATOM 828 N ARG 118 11.777 -10.036 1.400 1.00 0.00 ATOM 829 CA ARG 118 11.173 -9.546 2.646 1.00 0.00 ATOM 830 CB ARG 118 10.479 -8.204 2.413 1.00 0.00 ATOM 831 CG ARG 118 9.831 -7.615 3.655 1.00 0.00 ATOM 832 CD ARG 118 9.047 -6.356 3.326 1.00 0.00 ATOM 833 NE ARG 118 7.910 -6.632 2.451 1.00 0.00 ATOM 834 CZ ARG 118 7.254 -5.704 1.762 1.00 0.00 ATOM 835 NH1 ARG 118 6.232 -6.049 0.992 1.00 0.00 ATOM 836 NH2 ARG 118 7.622 -4.433 1.846 1.00 0.00 ATOM 837 O ARG 118 10.204 -10.864 4.399 1.00 0.00 ATOM 838 C ARG 118 10.176 -10.564 3.210 1.00 0.00 ATOM 839 N GLU 119 9.326 -11.106 2.337 1.00 0.00 ATOM 840 CA GLU 119 8.316 -12.102 2.696 1.00 0.00 ATOM 841 CB GLU 119 7.391 -12.378 1.510 1.00 0.00 ATOM 842 CG GLU 119 6.468 -11.222 1.161 1.00 0.00 ATOM 843 CD GLU 119 5.476 -10.913 2.266 1.00 0.00 ATOM 844 OE1 GLU 119 4.785 -11.848 2.723 1.00 0.00 ATOM 845 OE2 GLU 119 5.389 -9.737 2.673 1.00 0.00 ATOM 846 O GLU 119 8.408 -14.018 4.107 1.00 0.00 ATOM 847 C GLU 119 8.929 -13.405 3.169 1.00 0.00 ATOM 848 N LYS 120 10.017 -13.850 2.515 1.00 0.00 ATOM 849 CA LYS 120 10.692 -15.079 2.967 1.00 0.00 ATOM 850 CB LYS 120 11.730 -15.530 1.939 1.00 0.00 ATOM 851 CG LYS 120 11.132 -16.060 0.646 1.00 0.00 ATOM 852 CD LYS 120 12.218 -16.479 -0.333 1.00 0.00 ATOM 853 CE LYS 120 11.622 -17.013 -1.625 1.00 0.00 ATOM 854 NZ LYS 120 12.673 -17.385 -2.610 1.00 0.00 ATOM 855 O LYS 120 11.354 -15.866 5.123 1.00 0.00 ATOM 856 C LYS 120 11.379 -14.934 4.331 1.00 0.00 ATOM 857 N GLN 121 11.964 -13.765 4.594 1.00 0.00 ATOM 858 CA GLN 121 12.595 -13.442 5.883 1.00 0.00 ATOM 859 CB GLN 121 13.379 -12.132 5.782 1.00 0.00 ATOM 860 CG GLN 121 14.672 -12.242 4.991 1.00 0.00 ATOM 861 CD GLN 121 15.406 -10.919 4.887 1.00 0.00 ATOM 862 OE1 GLN 121 16.295 -10.756 4.053 1.00 0.00 ATOM 863 NE2 GLN 121 15.034 -9.971 5.739 1.00 0.00 ATOM 864 O GLN 121 11.817 -13.827 8.132 1.00 0.00 ATOM 865 C GLN 121 11.568 -13.341 7.016 1.00 0.00 ATOM 866 N LEU 122 10.432 -12.692 6.738 1.00 0.00 ATOM 867 CA LEU 122 9.330 -12.620 7.688 1.00 0.00 ATOM 868 CB LEU 122 8.114 -11.947 7.048 1.00 0.00 ATOM 869 CG LEU 122 6.876 -11.800 7.935 1.00 0.00 ATOM 870 CD1 LEU 122 7.184 -10.940 9.151 1.00 0.00 ATOM 871 CD2 LEU 122 5.718 -11.207 7.147 1.00 0.00 ATOM 872 O LEU 122 8.708 -14.199 9.399 1.00 0.00 ATOM 873 C LEU 122 8.954 -14.011 8.200 1.00 0.00 ATOM 874 N LEU 123 8.930 -14.980 7.286 1.00 0.00 ATOM 875 CA LEU 123 8.485 -16.325 7.616 1.00 0.00 ATOM 876 CB LEU 123 7.716 -16.937 6.444 1.00 0.00 ATOM 877 CG LEU 123 6.413 -16.239 6.048 1.00 0.00 ATOM 878 CD1 LEU 123 5.858 -16.827 4.760 1.00 0.00 ATOM 879 CD2 LEU 123 5.386 -16.346 7.164 1.00 0.00 ATOM 880 O LEU 123 9.373 -18.372 8.460 1.00 0.00 ATOM 881 C LEU 123 9.624 -17.260 8.001 1.00 0.00 ATOM 882 N GLU 124 10.864 -16.799 7.853 1.00 0.00 ATOM 883 CA GLU 124 12.047 -17.640 8.050 1.00 0.00 ATOM 884 CB GLU 124 13.320 -16.789 8.026 1.00 0.00 ATOM 885 CG GLU 124 14.603 -17.591 8.167 1.00 0.00 ATOM 886 CD GLU 124 15.844 -16.722 8.078 1.00 0.00 ATOM 887 OE1 GLU 124 15.698 -15.490 7.933 1.00 0.00 ATOM 888 OE2 GLU 124 16.962 -17.273 8.152 1.00 0.00 ATOM 889 O GLU 124 12.571 -19.622 9.279 1.00 0.00 ATOM 890 C GLU 124 12.099 -18.486 9.343 1.00 0.00 ATOM 891 N GLU 125 11.655 -17.940 10.509 1.00 0.00 ATOM 892 CA GLU 125 11.606 -18.686 11.787 1.00 0.00 ATOM 893 CB GLU 125 11.073 -17.793 12.910 1.00 0.00 ATOM 894 CG GLU 125 11.979 -16.620 13.253 1.00 0.00 ATOM 895 CD GLU 125 11.802 -15.450 12.306 1.00 0.00 ATOM 896 OE1 GLU 125 11.044 -15.590 11.324 1.00 0.00 ATOM 897 OE2 GLU 125 12.422 -14.393 12.546 1.00 0.00 ATOM 898 O GLU 125 10.652 -20.652 12.821 1.00 0.00 ATOM 899 C GLU 125 10.760 -19.976 11.784 1.00 0.00 ATOM 900 N PHE 126 10.171 -20.297 10.634 1.00 0.00 ATOM 901 CA PHE 126 9.164 -21.351 10.505 1.00 0.00 ATOM 902 CB PHE 126 7.771 -20.744 10.335 1.00 0.00 ATOM 903 CG PHE 126 7.315 -19.931 11.513 1.00 0.00 ATOM 904 CD1 PHE 126 7.595 -18.577 11.588 1.00 0.00 ATOM 905 CD2 PHE 126 6.609 -20.520 12.546 1.00 0.00 ATOM 906 CE1 PHE 126 7.175 -17.829 12.671 1.00 0.00 ATOM 907 CE2 PHE 126 6.189 -19.771 13.630 1.00 0.00 ATOM 908 CZ PHE 126 6.470 -18.433 13.696 1.00 0.00 ATOM 909 O PHE 126 9.979 -21.776 8.309 1.00 0.00 ATOM 910 C PHE 126 9.504 -22.250 9.334 1.00 0.00 ATOM 911 N GLU 127 9.226 -23.541 9.473 1.00 0.00 ATOM 912 CA GLU 127 9.448 -24.483 8.378 1.00 0.00 ATOM 913 CB GLU 127 9.430 -25.922 8.897 1.00 0.00 ATOM 914 CG GLU 127 10.554 -26.244 9.870 1.00 0.00 ATOM 915 CD GLU 127 11.919 -26.215 9.212 1.00 0.00 ATOM 916 OE1 GLU 127 12.061 -26.785 8.110 1.00 0.00 ATOM 917 OE2 GLU 127 12.849 -25.623 9.800 1.00 0.00 ATOM 918 O GLU 127 7.297 -23.761 7.602 1.00 0.00 ATOM 919 C GLU 127 8.380 -24.277 7.306 1.00 0.00 ATOM 920 N GLU 128 8.675 -24.676 6.071 1.00 0.00 ATOM 921 CA GLU 128 7.733 -24.487 4.961 1.00 0.00 ATOM 922 CB GLU 128 8.282 -25.118 3.679 1.00 0.00 ATOM 923 CG GLU 128 9.490 -24.401 3.102 1.00 0.00 ATOM 924 CD GLU 128 9.169 -22.989 2.650 1.00 0.00 ATOM 925 OE1 GLU 128 8.194 -22.817 1.888 1.00 0.00 ATOM 926 OE2 GLU 128 9.891 -22.055 3.056 1.00 0.00 ATOM 927 O GLU 128 5.333 -24.536 4.786 1.00 0.00 ATOM 928 C GLU 128 6.346 -25.066 5.254 1.00 0.00 ATOM 929 N ALA 129 6.317 -26.158 6.023 1.00 0.00 ATOM 930 CA ALA 129 5.078 -26.760 6.501 1.00 0.00 ATOM 931 CB ALA 129 5.364 -28.086 7.187 1.00 0.00 ATOM 932 O ALA 129 3.179 -25.513 7.280 1.00 0.00 ATOM 933 C ALA 129 4.361 -25.800 7.455 1.00 0.00 ATOM 934 N GLU 130 5.091 -25.301 8.455 1.00 0.00 ATOM 935 CA GLU 130 4.555 -24.388 9.462 1.00 0.00 ATOM 936 CB GLU 130 5.613 -24.080 10.524 1.00 0.00 ATOM 937 CG GLU 130 5.917 -25.244 11.453 1.00 0.00 ATOM 938 CD GLU 130 6.951 -24.897 12.504 1.00 0.00 ATOM 939 OE1 GLU 130 8.039 -24.410 12.130 1.00 0.00 ATOM 940 OE2 GLU 130 6.674 -25.110 13.703 1.00 0.00 ATOM 941 O GLU 130 3.052 -22.521 9.338 1.00 0.00 ATOM 942 C GLU 130 4.049 -23.073 8.867 1.00 0.00 ATOM 943 N LYS 131 4.751 -22.584 7.846 1.00 0.00 ATOM 944 CA LYS 131 4.371 -21.386 7.104 1.00 0.00 ATOM 945 CB LYS 131 5.390 -21.093 6.001 1.00 0.00 ATOM 946 CG LYS 131 6.736 -20.610 6.512 1.00 0.00 ATOM 947 CD LYS 131 7.705 -20.357 5.367 1.00 0.00 ATOM 948 CE LYS 131 9.055 -19.888 5.881 1.00 0.00 ATOM 949 NZ LYS 131 10.028 -19.677 4.771 1.00 0.00 ATOM 950 O LYS 131 2.161 -20.622 6.613 1.00 0.00 ATOM 951 C LYS 131 2.983 -21.533 6.507 1.00 0.00 ATOM 952 N ASP 132 2.728 -22.695 5.909 1.00 0.00 ATOM 953 CA ASP 132 1.431 -23.042 5.320 1.00 0.00 ATOM 954 CB ASP 132 1.516 -24.386 4.591 1.00 0.00 ATOM 955 CG ASP 132 2.318 -24.303 3.308 1.00 0.00 ATOM 956 OD1 ASP 132 2.578 -23.173 2.841 1.00 0.00 ATOM 957 OD2 ASP 132 2.686 -25.366 2.767 1.00 0.00 ATOM 958 O ASP 132 -0.798 -22.575 6.142 1.00 0.00 ATOM 959 C ASP 132 0.299 -23.102 6.365 1.00 0.00 ATOM 960 N GLN 133 0.574 -23.742 7.501 1.00 0.00 ATOM 961 CA GLN 133 -0.358 -23.783 8.620 1.00 0.00 ATOM 962 CB GLN 133 0.211 -24.632 9.759 1.00 0.00 ATOM 963 CG GLN 133 0.267 -26.120 9.455 1.00 0.00 ATOM 964 CD GLN 133 0.939 -26.914 10.559 1.00 0.00 ATOM 965 OE1 GLN 133 1.635 -26.353 11.406 1.00 0.00 ATOM 966 NE2 GLN 133 0.734 -28.226 10.551 1.00 0.00 ATOM 967 O GLN 133 -1.820 -22.016 9.312 1.00 0.00 ATOM 968 C GLN 133 -0.665 -22.368 9.110 1.00 0.00 ATOM 969 N LEU 134 0.376 -21.565 9.296 1.00 0.00 ATOM 970 CA LEU 134 0.212 -20.205 9.803 1.00 0.00 ATOM 971 CB LEU 134 1.575 -19.562 10.064 1.00 0.00 ATOM 972 CG LEU 134 1.564 -18.078 10.439 1.00 0.00 ATOM 973 CD1 LEU 134 1.263 -17.900 11.919 1.00 0.00 ATOM 974 CD2 LEU 134 2.891 -17.425 10.085 1.00 0.00 ATOM 975 O LEU 134 -1.525 -18.673 9.257 1.00 0.00 ATOM 976 C LEU 134 -0.592 -19.336 8.842 1.00 0.00 ATOM 977 N PHE 135 -0.232 -19.355 7.564 1.00 0.00 ATOM 978 CA PHE 135 -0.946 -18.582 6.549 1.00 0.00 ATOM 979 CB PHE 135 -0.341 -18.825 5.166 1.00 0.00 ATOM 980 CG PHE 135 -1.012 -18.053 4.066 1.00 0.00 ATOM 981 CD1 PHE 135 -0.734 -16.711 3.874 1.00 0.00 ATOM 982 CD2 PHE 135 -1.921 -18.669 3.224 1.00 0.00 ATOM 983 CE1 PHE 135 -1.351 -16.000 2.862 1.00 0.00 ATOM 984 CE2 PHE 135 -2.539 -17.957 2.212 1.00 0.00 ATOM 985 CZ PHE 135 -2.257 -16.628 2.030 1.00 0.00 ATOM 986 O PHE 135 -3.283 -18.019 6.434 1.00 0.00 ATOM 987 C PHE 135 -2.447 -18.924 6.534 1.00 0.00 ATOM 988 N ILE 136 -2.767 -20.221 6.649 1.00 0.00 ATOM 989 CA ILE 136 -4.149 -20.709 6.690 1.00 0.00 ATOM 990 CB ILE 136 -4.206 -22.246 6.613 1.00 0.00 ATOM 991 CG1 ILE 136 -3.725 -22.730 5.244 1.00 0.00 ATOM 992 CG2 ILE 136 -5.608 -22.743 6.930 1.00 0.00 ATOM 993 CD1 ILE 136 -3.485 -24.222 5.172 1.00 0.00 ATOM 994 O ILE 136 -6.047 -19.757 7.812 1.00 0.00 ATOM 995 C ILE 136 -4.927 -20.266 7.920 1.00 0.00 ATOM 996 N LEU 137 -4.329 -20.472 9.091 1.00 0.00 ATOM 997 CA LEU 137 -4.879 -20.001 10.363 1.00 0.00 ATOM 998 CB LEU 137 -3.987 -20.439 11.527 1.00 0.00 ATOM 999 CG LEU 137 -4.358 -21.758 12.206 1.00 0.00 ATOM 1000 CD1 LEU 137 -4.941 -22.736 11.198 1.00 0.00 ATOM 1001 CD2 LEU 137 -3.146 -22.367 12.894 1.00 0.00 ATOM 1002 O LEU 137 -6.096 -17.968 10.789 1.00 0.00 ATOM 1003 C LEU 137 -5.049 -18.473 10.395 1.00 0.00 ATOM 1004 N LEU 138 -4.026 -17.747 9.957 1.00 0.00 ATOM 1005 CA LEU 138 -4.044 -16.285 9.947 1.00 0.00 ATOM 1006 CB LEU 138 -2.637 -15.733 9.709 1.00 0.00 ATOM 1007 CG LEU 138 -2.327 -14.372 10.334 1.00 0.00 ATOM 1008 CD1 LEU 138 -2.594 -14.395 11.831 1.00 0.00 ATOM 1009 CD2 LEU 138 -0.888 -13.968 10.058 1.00 0.00 ATOM 1010 O LEU 138 -5.573 -14.628 9.078 1.00 0.00 ATOM 1011 C LEU 138 -5.003 -15.703 8.883 1.00 0.00 ATOM 1012 N LYS 139 -5.205 -16.417 7.775 1.00 0.00 ATOM 1013 CA LYS 139 -6.169 -15.993 6.741 1.00 0.00 ATOM 1014 CB LYS 139 -6.131 -16.950 5.548 1.00 0.00 ATOM 1015 CG LYS 139 -7.032 -16.538 4.394 1.00 0.00 ATOM 1016 CD LYS 139 -6.889 -17.489 3.217 1.00 0.00 ATOM 1017 CE LYS 139 -7.795 -17.083 2.067 1.00 0.00 ATOM 1018 NZ LYS 139 -7.669 -18.008 0.907 1.00 0.00 ATOM 1019 O LYS 139 -8.404 -15.086 6.843 1.00 0.00 ATOM 1020 C LYS 139 -7.589 -15.911 7.289 1.00 0.00 TER END