PFRMAT TS TARGET T0404 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 T0404 model 1 Thu May 15 16:24:07 2008 MODEL 1 PARENT N/A ATOM 1 N MET 1 -7.775 7.846 17.479 1.00 0.00 ATOM 2 CA MET 1 -8.761 7.057 18.273 1.00 0.00 ATOM 3 CB MET 1 -10.134 7.705 18.187 1.00 0.00 ATOM 4 CG MET 1 -11.221 6.951 18.983 1.00 0.00 ATOM 5 SD MET 1 -12.740 7.956 19.052 1.00 0.00 ATOM 6 CE MET 1 -13.301 7.735 17.414 1.00 0.00 ATOM 7 O MET 1 -9.078 5.485 16.490 1.00 0.00 ATOM 8 C MET 1 -8.925 5.648 17.702 1.00 0.00 ATOM 9 N SER 2 -8.879 4.639 18.538 1.00 0.00 ATOM 10 CA SER 2 -9.079 3.270 18.072 1.00 0.00 ATOM 11 CB SER 2 -8.875 2.328 19.261 1.00 0.00 ATOM 12 OG SER 2 -9.912 2.478 20.215 1.00 0.00 ATOM 13 O SER 2 -10.587 2.338 16.455 1.00 0.00 ATOM 14 C SER 2 -10.445 3.101 17.410 1.00 0.00 ATOM 15 N LYS 3 -11.466 3.876 18.012 1.00 0.00 ATOM 16 CA LYS 3 -12.802 3.811 17.440 1.00 0.00 ATOM 17 CB LYS 3 -13.791 4.342 18.480 1.00 0.00 ATOM 18 CG LYS 3 -13.869 3.502 19.745 1.00 0.00 ATOM 19 CD LYS 3 -14.948 4.020 20.684 1.00 0.00 ATOM 20 CE LYS 3 -14.996 3.209 21.969 1.00 0.00 ATOM 21 NZ LYS 3 -16.065 3.689 22.889 1.00 0.00 ATOM 22 O LYS 3 -14.054 4.823 15.646 1.00 0.00 ATOM 23 C LYS 3 -12.942 4.662 16.173 1.00 0.00 ATOM 24 N ARG 4 -11.832 5.202 15.685 1.00 0.00 ATOM 25 CA ARG 4 -11.842 6.014 14.487 1.00 0.00 ATOM 26 CB ARG 4 -10.569 6.828 14.345 1.00 0.00 ATOM 27 CG ARG 4 -10.405 7.819 15.479 1.00 0.00 ATOM 28 CD ARG 4 -10.848 9.207 15.166 1.00 0.00 ATOM 29 NE ARG 4 -10.807 10.092 16.337 1.00 0.00 ATOM 30 CZ ARG 4 -10.896 11.416 16.272 1.00 0.00 ATOM 31 NH1 ARG 4 -11.026 12.015 15.102 1.00 0.00 ATOM 32 NH2 ARG 4 -10.872 12.148 17.380 1.00 0.00 ATOM 33 O ARG 4 -11.240 4.015 13.194 1.00 0.00 ATOM 34 C ARG 4 -11.546 5.234 13.187 1.00 0.00 ATOM 35 N ALA 5 -11.740 5.971 12.110 1.00 0.00 ATOM 36 CA ALA 5 -11.618 5.551 10.715 1.00 0.00 ATOM 37 CB ALA 5 -12.880 5.905 9.943 1.00 0.00 ATOM 38 O ALA 5 -10.246 7.518 10.357 1.00 0.00 ATOM 39 C ALA 5 -10.409 6.312 10.099 1.00 0.00 ATOM 40 N ASN 6 -9.645 5.656 9.243 1.00 0.00 ATOM 41 CA ASN 6 -8.512 6.276 8.574 1.00 0.00 ATOM 42 CB ASN 6 -7.207 5.783 9.201 1.00 0.00 ATOM 43 CG ASN 6 -7.047 6.229 10.641 1.00 0.00 ATOM 44 ND2 ASN 6 -7.277 5.310 11.572 1.00 0.00 ATOM 45 OD1 ASN 6 -6.723 7.384 10.912 1.00 0.00 ATOM 46 O ASN 6 -8.902 4.824 6.715 1.00 0.00 ATOM 47 C ASN 6 -8.506 5.920 7.096 1.00 0.00 ATOM 48 N LYS 7 -8.011 6.848 6.304 1.00 0.00 ATOM 49 CA LYS 7 -7.665 6.601 4.921 1.00 0.00 ATOM 50 CB LYS 7 -7.954 7.838 4.067 1.00 0.00 ATOM 51 CG LYS 7 -7.682 7.647 2.584 1.00 0.00 ATOM 52 CD LYS 7 -8.218 8.814 1.771 1.00 0.00 ATOM 53 CE LYS 7 -7.320 10.033 1.897 1.00 0.00 ATOM 54 NZ LYS 7 -7.831 11.184 1.102 1.00 0.00 ATOM 55 O LYS 7 -5.339 7.114 5.058 1.00 0.00 ATOM 56 C LYS 7 -6.220 6.267 4.749 1.00 0.00 ATOM 57 N LEU 8 -5.936 5.096 4.216 1.00 0.00 ATOM 58 CA LEU 8 -4.587 4.701 3.870 1.00 0.00 ATOM 59 CB LEU 8 -4.380 3.210 4.143 1.00 0.00 ATOM 60 CG LEU 8 -2.999 2.645 3.803 1.00 0.00 ATOM 61 CD1 LEU 8 -1.925 3.302 4.656 1.00 0.00 ATOM 62 CD2 LEU 8 -2.954 1.146 4.055 1.00 0.00 ATOM 63 O LEU 8 -5.109 4.391 1.532 1.00 0.00 ATOM 64 C LEU 8 -4.420 4.995 2.379 1.00 0.00 ATOM 65 N VAL 9 -3.581 5.978 2.067 1.00 0.00 ATOM 66 CA VAL 9 -3.329 6.423 0.664 1.00 0.00 ATOM 67 CB VAL 9 -3.443 7.954 0.538 1.00 0.00 ATOM 68 CG1 VAL 9 -3.163 8.393 -0.890 1.00 0.00 ATOM 69 CG2 VAL 9 -4.842 8.418 0.918 1.00 0.00 ATOM 70 O VAL 9 -0.948 6.455 0.871 1.00 0.00 ATOM 71 C VAL 9 -1.920 5.972 0.328 1.00 0.00 ATOM 72 N ILE 10 -1.811 4.974 -0.546 1.00 0.00 ATOM 73 CA ILE 10 -0.575 4.329 -0.944 1.00 0.00 ATOM 74 CB ILE 10 -0.602 2.802 -0.749 1.00 0.00 ATOM 75 CG1 ILE 10 -0.820 2.457 0.726 1.00 0.00 ATOM 76 CG2 ILE 10 0.714 2.184 -1.198 1.00 0.00 ATOM 77 CD1 ILE 10 -1.088 0.989 0.976 1.00 0.00 ATOM 78 O ILE 10 -1.107 4.237 -3.225 1.00 0.00 ATOM 79 C ILE 10 -0.269 4.547 -2.394 1.00 0.00 ATOM 80 N VAL 11 0.908 5.113 -2.659 1.00 0.00 ATOM 81 CA VAL 11 1.379 5.322 -4.031 1.00 0.00 ATOM 82 CB VAL 11 1.996 6.725 -4.173 1.00 0.00 ATOM 83 CG1 VAL 11 2.498 6.946 -5.593 1.00 0.00 ATOM 84 CG2 VAL 11 0.962 7.796 -3.858 1.00 0.00 ATOM 85 O VAL 11 3.328 4.075 -3.473 1.00 0.00 ATOM 86 C VAL 11 2.418 4.235 -4.275 1.00 0.00 ATOM 87 N THR 12 2.062 3.422 -5.365 1.00 0.00 ATOM 88 CA THR 12 2.892 2.264 -5.666 1.00 0.00 ATOM 89 CB THR 12 2.209 0.953 -5.236 1.00 0.00 ATOM 90 CG2 THR 12 1.810 1.018 -3.769 1.00 0.00 ATOM 91 OG1 THR 12 1.033 0.740 -6.027 1.00 0.00 ATOM 92 O THR 12 2.637 2.968 -8.009 1.00 0.00 ATOM 93 C THR 12 3.171 2.174 -7.182 1.00 0.00 ATOM 94 N GLU 13 4.007 1.197 -7.593 1.00 0.00 ATOM 95 CA GLU 13 4.309 0.989 -9.001 1.00 0.00 ATOM 96 CB GLU 13 5.479 0.015 -9.159 1.00 0.00 ATOM 97 CG GLU 13 5.923 -0.193 -10.597 1.00 0.00 ATOM 98 CD GLU 13 7.119 -1.118 -10.710 1.00 0.00 ATOM 99 OE1 GLU 13 7.592 -1.608 -9.663 1.00 0.00 ATOM 100 OE2 GLU 13 7.581 -1.355 -11.846 1.00 0.00 ATOM 101 O GLU 13 2.316 -0.333 -9.130 1.00 0.00 ATOM 102 C GLU 13 3.071 0.428 -9.705 1.00 0.00 ATOM 103 N LYS 14 2.847 0.787 -10.975 1.00 0.00 ATOM 104 CA LYS 14 1.643 0.316 -11.647 1.00 0.00 ATOM 105 CB LYS 14 1.576 0.864 -13.074 1.00 0.00 ATOM 106 CG LYS 14 0.337 0.438 -13.845 1.00 0.00 ATOM 107 CD LYS 14 0.298 1.077 -15.223 1.00 0.00 ATOM 108 CE LYS 14 -0.927 0.629 -16.005 1.00 0.00 ATOM 109 NZ LYS 14 -0.972 1.237 -17.363 1.00 0.00 ATOM 110 O LYS 14 0.552 -1.870 -11.540 1.00 0.00 ATOM 111 C LYS 14 1.593 -1.238 -11.738 1.00 0.00 ATOM 112 N VAL 15 2.748 -1.855 -11.945 1.00 0.00 ATOM 113 CA VAL 15 2.840 -3.297 -12.061 1.00 0.00 ATOM 114 CB VAL 15 4.260 -3.740 -12.464 1.00 0.00 ATOM 115 CG1 VAL 15 5.205 -3.642 -11.275 1.00 0.00 ATOM 116 CG2 VAL 15 4.250 -5.179 -12.953 1.00 0.00 ATOM 117 O VAL 15 2.201 -5.234 -10.823 1.00 0.00 ATOM 118 C VAL 15 2.501 -4.039 -10.774 1.00 0.00 ATOM 119 N LEU 16 2.509 -3.341 -9.643 1.00 0.00 ATOM 120 CA LEU 16 2.184 -3.930 -8.351 1.00 0.00 ATOM 121 CB LEU 16 2.966 -3.229 -7.239 1.00 0.00 ATOM 122 CG LEU 16 4.491 -3.293 -7.338 1.00 0.00 ATOM 123 CD1 LEU 16 5.139 -2.477 -6.229 1.00 0.00 ATOM 124 CD2 LEU 16 4.979 -4.730 -7.217 1.00 0.00 ATOM 125 O LEU 16 0.306 -4.385 -6.954 1.00 0.00 ATOM 126 C LEU 16 0.704 -3.845 -7.995 1.00 0.00 ATOM 127 N LEU 17 -0.122 -3.168 -8.795 1.00 0.00 ATOM 128 CA LEU 17 -1.539 -2.989 -8.448 1.00 0.00 ATOM 129 CB LEU 17 -2.270 -2.229 -9.556 1.00 0.00 ATOM 130 CG LEU 17 -3.764 -1.983 -9.337 1.00 0.00 ATOM 131 CD1 LEU 17 -3.994 -1.133 -8.097 1.00 0.00 ATOM 132 CD2 LEU 17 -4.370 -1.258 -10.529 1.00 0.00 ATOM 133 O LEU 17 -2.925 -4.555 -7.283 1.00 0.00 ATOM 134 C LEU 17 -2.217 -4.345 -8.261 1.00 0.00 ATOM 135 N LYS 18 -2.014 -5.273 -9.177 1.00 0.00 ATOM 136 CA LYS 18 -2.764 -6.532 -9.157 1.00 0.00 ATOM 137 CB LYS 18 -2.380 -7.401 -10.356 1.00 0.00 ATOM 138 CG LYS 18 -3.143 -8.713 -10.440 1.00 0.00 ATOM 139 CD LYS 18 -2.765 -9.492 -11.689 1.00 0.00 ATOM 140 CE LYS 18 -3.492 -10.826 -11.749 1.00 0.00 ATOM 141 NZ LYS 18 -3.113 -11.611 -12.955 1.00 0.00 ATOM 142 O LYS 18 -3.373 -7.694 -7.130 1.00 0.00 ATOM 143 C LYS 18 -2.468 -7.294 -7.868 1.00 0.00 ATOM 144 N LYS 19 -1.209 -7.501 -7.566 1.00 0.00 ATOM 145 CA LYS 19 -0.835 -8.302 -6.410 1.00 0.00 ATOM 146 CB LYS 19 0.677 -8.537 -6.393 1.00 0.00 ATOM 147 CG LYS 19 1.177 -9.453 -7.499 1.00 0.00 ATOM 148 CD LYS 19 2.682 -9.645 -7.419 1.00 0.00 ATOM 149 CE LYS 19 3.185 -10.536 -8.545 1.00 0.00 ATOM 150 NZ LYS 19 4.663 -10.713 -8.492 1.00 0.00 ATOM 151 O LYS 19 -1.717 -8.317 -4.180 1.00 0.00 ATOM 152 C LYS 19 -1.249 -7.648 -5.110 1.00 0.00 ATOM 153 N VAL 20 -1.079 -6.293 -4.975 1.00 0.00 ATOM 154 CA VAL 20 -1.417 -5.593 -3.743 1.00 0.00 ATOM 155 CB VAL 20 -0.957 -4.125 -3.798 1.00 0.00 ATOM 156 CG1 VAL 20 -1.500 -3.351 -2.606 1.00 0.00 ATOM 157 CG2 VAL 20 0.562 -4.040 -3.775 1.00 0.00 ATOM 158 O VAL 20 -3.367 -5.937 -2.375 1.00 0.00 ATOM 159 C VAL 20 -2.931 -5.624 -3.497 1.00 0.00 ATOM 160 N ALA 21 -3.717 -5.333 -4.508 1.00 0.00 ATOM 161 CA ALA 21 -5.180 -5.304 -4.309 1.00 0.00 ATOM 162 CB ALA 21 -5.910 -4.839 -5.560 1.00 0.00 ATOM 163 O ALA 21 -6.569 -6.796 -3.056 1.00 0.00 ATOM 164 C ALA 21 -5.705 -6.661 -3.923 1.00 0.00 ATOM 165 N LYS 22 -5.165 -7.705 -4.534 1.00 0.00 ATOM 166 CA LYS 22 -5.608 -9.057 -4.216 1.00 0.00 ATOM 167 CB LYS 22 -5.048 -10.001 -5.301 1.00 0.00 ATOM 168 CG LYS 22 -5.478 -11.451 -5.076 1.00 0.00 ATOM 169 CD LYS 22 -4.901 -12.399 -6.140 1.00 0.00 ATOM 170 CE LYS 22 -5.369 -13.821 -5.859 1.00 0.00 ATOM 171 NZ LYS 22 -4.987 -14.722 -6.991 1.00 0.00 ATOM 172 O LYS 22 -6.065 -9.955 -2.045 1.00 0.00 ATOM 173 C LYS 22 -5.248 -9.411 -2.774 1.00 0.00 ATOM 174 N ILE 23 -4.044 -9.092 -2.372 1.00 0.00 ATOM 175 CA ILE 23 -3.619 -9.380 -1.008 1.00 0.00 ATOM 176 CB ILE 23 -2.151 -8.998 -0.743 1.00 0.00 ATOM 177 CG1 ILE 23 -1.213 -9.873 -1.577 1.00 0.00 ATOM 178 CG2 ILE 23 -1.808 -9.188 0.726 1.00 0.00 ATOM 179 CD1 ILE 23 0.223 -9.396 -1.581 1.00 0.00 ATOM 180 O ILE 23 -4.949 -9.186 1.053 1.00 0.00 ATOM 181 C ILE 23 -4.536 -8.608 0.019 1.00 0.00 ATOM 182 N ILE 24 -4.862 -7.344 -0.278 1.00 0.00 ATOM 183 CA ILE 24 -5.775 -6.566 0.594 1.00 0.00 ATOM 184 CB ILE 24 -5.819 -5.100 0.030 1.00 0.00 ATOM 185 CG1 ILE 24 -4.423 -4.464 0.061 1.00 0.00 ATOM 186 CG2 ILE 24 -6.804 -4.255 0.830 1.00 0.00 ATOM 187 CD1 ILE 24 -4.338 -3.125 -0.654 1.00 0.00 ATOM 188 O ILE 24 -7.637 -7.465 1.691 1.00 0.00 ATOM 189 C ILE 24 -7.123 -7.228 0.623 1.00 0.00 ATOM 190 N GLU 25 -7.734 -7.490 -0.527 1.00 0.00 ATOM 191 CA GLU 25 -9.063 -8.016 -0.511 1.00 0.00 ATOM 192 CB GLU 25 -9.611 -8.120 -1.936 1.00 0.00 ATOM 193 CG GLU 25 -9.878 -6.778 -2.597 1.00 0.00 ATOM 194 CD GLU 25 -10.301 -6.916 -4.047 1.00 0.00 ATOM 195 OE1 GLU 25 -10.316 -8.058 -4.555 1.00 0.00 ATOM 196 OE2 GLU 25 -10.620 -5.885 -4.674 1.00 0.00 ATOM 197 O GLU 25 -10.051 -9.727 0.875 1.00 0.00 ATOM 198 C GLU 25 -9.119 -9.421 0.117 1.00 0.00 ATOM 199 N GLU 26 -8.080 -10.228 -0.095 1.00 0.00 ATOM 200 CA GLU 26 -7.989 -11.558 0.594 1.00 0.00 ATOM 201 CB GLU 26 -6.736 -12.277 0.109 1.00 0.00 ATOM 202 CG GLU 26 -6.975 -12.921 -1.244 1.00 0.00 ATOM 203 CD GLU 26 -5.718 -13.379 -1.980 1.00 0.00 ATOM 204 OE1 GLU 26 -4.591 -13.052 -1.574 1.00 0.00 ATOM 205 OE2 GLU 26 -5.879 -14.085 -3.002 1.00 0.00 ATOM 206 O GLU 26 -8.538 -12.274 2.826 1.00 0.00 ATOM 207 C GLU 26 -7.995 -11.409 2.129 1.00 0.00 ATOM 208 N ALA 27 -7.394 -10.348 2.602 1.00 0.00 ATOM 209 CA ALA 27 -7.351 -10.086 4.041 1.00 0.00 ATOM 210 CB ALA 27 -6.144 -9.210 4.336 1.00 0.00 ATOM 211 O ALA 27 -8.641 -8.994 5.740 1.00 0.00 ATOM 212 C ALA 27 -8.586 -9.342 4.562 1.00 0.00 ATOM 213 N GLY 28 -9.562 -9.096 3.708 1.00 0.00 ATOM 214 CA GLY 28 -10.830 -8.489 4.121 1.00 0.00 ATOM 215 O GLY 28 -12.004 -6.412 4.113 1.00 0.00 ATOM 216 C GLY 28 -10.957 -7.007 3.831 1.00 0.00 ATOM 217 N ALA 29 -9.916 -6.378 3.289 1.00 0.00 ATOM 218 CA ALA 29 -9.908 -4.942 3.037 1.00 0.00 ATOM 219 CB ALA 29 -8.523 -4.367 3.294 1.00 0.00 ATOM 220 O ALA 29 -9.442 -4.610 0.675 1.00 0.00 ATOM 221 C ALA 29 -10.294 -4.746 1.590 1.00 0.00 ATOM 222 N THR 30 -11.586 -4.836 1.369 1.00 0.00 ATOM 223 CA THR 30 -12.169 -4.877 0.008 1.00 0.00 ATOM 224 CB THR 30 -13.500 -5.689 -0.049 1.00 0.00 ATOM 225 CG2 THR 30 -13.274 -7.145 0.341 1.00 0.00 ATOM 226 OG1 THR 30 -14.482 -5.091 0.803 1.00 0.00 ATOM 227 O THR 30 -12.272 -3.263 -1.765 1.00 0.00 ATOM 228 C THR 30 -12.456 -3.495 -0.570 1.00 0.00 ATOM 229 N GLY 31 -12.908 -2.578 0.281 1.00 0.00 ATOM 230 CA GLY 31 -13.209 -1.238 -0.160 1.00 0.00 ATOM 231 O GLY 31 -11.074 -0.256 0.324 1.00 0.00 ATOM 232 C GLY 31 -11.959 -0.436 -0.512 1.00 0.00 ATOM 233 N TYR 32 -11.889 0.045 -1.749 1.00 0.00 ATOM 234 CA TYR 32 -10.742 0.826 -2.193 1.00 0.00 ATOM 235 CB TYR 32 -9.599 -0.126 -2.555 1.00 0.00 ATOM 236 CG TYR 32 -9.939 -1.096 -3.663 1.00 0.00 ATOM 237 CD1 TYR 32 -9.693 -0.773 -4.992 1.00 0.00 ATOM 238 CD2 TYR 32 -10.504 -2.332 -3.378 1.00 0.00 ATOM 239 CE1 TYR 32 -10.000 -1.654 -6.011 1.00 0.00 ATOM 240 CE2 TYR 32 -10.817 -3.225 -4.385 1.00 0.00 ATOM 241 CZ TYR 32 -10.560 -2.876 -5.710 1.00 0.00 ATOM 242 OH TYR 32 -10.866 -3.755 -6.723 1.00 0.00 ATOM 243 O TYR 32 -11.879 1.224 -4.287 1.00 0.00 ATOM 244 C TYR 32 -11.085 1.633 -3.454 1.00 0.00 ATOM 245 N THR 33 -10.370 2.764 -3.598 1.00 0.00 ATOM 246 CA THR 33 -10.448 3.631 -4.773 1.00 0.00 ATOM 247 CB THR 33 -11.014 5.013 -4.400 1.00 0.00 ATOM 248 CG2 THR 33 -11.112 5.900 -5.631 1.00 0.00 ATOM 249 OG1 THR 33 -12.321 4.861 -3.833 1.00 0.00 ATOM 250 O THR 33 -8.139 4.180 -4.617 1.00 0.00 ATOM 251 C THR 33 -9.061 3.814 -5.347 1.00 0.00 ATOM 252 N VAL 34 -8.934 3.597 -6.646 1.00 0.00 ATOM 253 CA VAL 34 -7.658 3.568 -7.328 1.00 0.00 ATOM 254 CB VAL 34 -7.413 2.200 -7.992 1.00 0.00 ATOM 255 CG1 VAL 34 -6.094 2.202 -8.747 1.00 0.00 ATOM 256 CG2 VAL 34 -7.365 1.101 -6.941 1.00 0.00 ATOM 257 O VAL 34 -8.572 4.810 -9.162 1.00 0.00 ATOM 258 C VAL 34 -7.621 4.657 -8.401 1.00 0.00 ATOM 259 N VAL 35 -6.485 5.316 -8.547 1.00 0.00 ATOM 260 CA VAL 35 -6.297 6.424 -9.444 1.00 0.00 ATOM 261 CB VAL 35 -6.501 7.780 -8.743 1.00 0.00 ATOM 262 CG1 VAL 35 -6.256 8.925 -9.713 1.00 0.00 ATOM 263 CG2 VAL 35 -7.922 7.896 -8.211 1.00 0.00 ATOM 264 O VAL 35 -3.884 6.317 -9.330 1.00 0.00 ATOM 265 C VAL 35 -4.878 6.477 -10.042 1.00 0.00 ATOM 266 N ASP 36 -4.796 6.726 -11.375 1.00 0.00 ATOM 267 CA ASP 36 -3.495 6.820 -12.038 1.00 0.00 ATOM 268 CB ASP 36 -3.665 6.670 -13.551 1.00 0.00 ATOM 269 CG ASP 36 -4.021 5.255 -13.961 1.00 0.00 ATOM 270 OD1 ASP 36 -3.914 4.345 -13.110 1.00 0.00 ATOM 271 OD2 ASP 36 -4.409 5.054 -15.130 1.00 0.00 ATOM 272 O ASP 36 -3.502 9.234 -11.887 1.00 0.00 ATOM 273 C ASP 36 -2.882 8.196 -11.724 1.00 0.00 ATOM 274 N THR 37 -1.627 8.227 -11.348 1.00 0.00 ATOM 275 CA THR 37 -0.923 9.455 -10.988 1.00 0.00 ATOM 276 CB THR 37 -0.860 9.628 -9.459 1.00 0.00 ATOM 277 CG2 THR 37 -2.255 9.549 -8.856 1.00 0.00 ATOM 278 OG1 THR 37 -0.050 8.591 -8.890 1.00 0.00 ATOM 279 O THR 37 0.926 8.338 -12.027 1.00 0.00 ATOM 280 C THR 37 0.485 9.386 -11.501 1.00 0.00 ATOM 281 N GLY 38 1.211 10.499 -11.322 1.00 0.00 ATOM 282 CA GLY 38 2.670 10.496 -11.558 1.00 0.00 ATOM 283 O GLY 38 2.714 12.006 -9.700 1.00 0.00 ATOM 284 C GLY 38 3.334 11.200 -10.397 1.00 0.00 ATOM 285 N GLY 39 4.572 10.872 -10.132 1.00 0.00 ATOM 286 CA GLY 39 5.196 11.406 -8.954 1.00 0.00 ATOM 287 O GLY 39 7.314 10.777 -9.913 1.00 0.00 ATOM 288 C GLY 39 6.689 11.329 -8.989 1.00 0.00 ATOM 289 N LYS 40 7.281 11.888 -7.937 1.00 0.00 ATOM 290 CA LYS 40 8.646 11.612 -7.600 1.00 0.00 ATOM 291 CB LYS 40 9.581 12.657 -8.211 1.00 0.00 ATOM 292 CG LYS 40 9.356 14.069 -7.694 1.00 0.00 ATOM 293 CD LYS 40 10.282 15.062 -8.379 1.00 0.00 ATOM 294 CE LYS 40 10.090 16.465 -7.828 1.00 0.00 ATOM 295 NZ LYS 40 11.020 17.441 -8.461 1.00 0.00 ATOM 296 O LYS 40 8.028 12.247 -5.367 1.00 0.00 ATOM 297 C LYS 40 8.825 11.634 -6.090 1.00 0.00 ATOM 298 N GLY 41 9.816 10.907 -5.614 1.00 0.00 ATOM 299 CA GLY 41 10.185 10.898 -4.255 1.00 0.00 ATOM 300 O GLY 41 11.523 12.919 -4.596 1.00 0.00 ATOM 301 C GLY 41 11.314 11.880 -3.930 1.00 0.00 ATOM 302 N SER 42 12.046 11.494 -2.794 1.00 0.00 ATOM 303 CA SER 42 13.146 12.351 -2.353 1.00 0.00 ATOM 304 CB SER 42 13.866 11.726 -1.157 1.00 0.00 ATOM 305 OG SER 42 13.022 11.684 -0.018 1.00 0.00 ATOM 306 O SER 42 14.606 13.667 -3.743 1.00 0.00 ATOM 307 C SER 42 14.163 12.546 -3.481 1.00 0.00 ATOM 308 N ARG 43 14.545 11.475 -4.144 1.00 0.00 ATOM 309 CA ARG 43 15.506 11.535 -5.250 1.00 0.00 ATOM 310 CB ARG 43 16.028 10.137 -5.584 1.00 0.00 ATOM 311 CG ARG 43 16.880 9.516 -4.488 1.00 0.00 ATOM 312 CD ARG 43 17.352 8.124 -4.878 1.00 0.00 ATOM 313 NE ARG 43 16.243 7.181 -4.989 1.00 0.00 ATOM 314 CZ ARG 43 16.370 5.923 -5.400 1.00 0.00 ATOM 315 NH1 ARG 43 15.304 5.138 -5.469 1.00 0.00 ATOM 316 NH2 ARG 43 17.562 5.456 -5.745 1.00 0.00 ATOM 317 O ARG 43 13.554 12.202 -6.578 1.00 0.00 ATOM 318 C ARG 43 14.803 12.118 -6.471 1.00 0.00 ATOM 319 N ASN 44 15.627 12.459 -7.456 1.00 0.00 ATOM 320 CA ASN 44 15.107 12.951 -8.726 1.00 0.00 ATOM 321 CB ASN 44 15.594 14.378 -8.986 1.00 0.00 ATOM 322 CG ASN 44 15.068 15.367 -7.965 1.00 0.00 ATOM 323 ND2 ASN 44 15.953 15.855 -7.105 1.00 0.00 ATOM 324 OD1 ASN 44 13.879 15.687 -7.952 1.00 0.00 ATOM 325 O ASN 44 15.619 12.628 -11.047 1.00 0.00 ATOM 326 C ASN 44 15.521 12.116 -9.924 1.00 0.00 ATOM 327 N VAL 45 15.665 10.817 -9.706 1.00 0.00 ATOM 328 CA VAL 45 15.978 9.901 -10.789 1.00 0.00 ATOM 329 CB VAL 45 17.447 9.444 -10.720 1.00 0.00 ATOM 330 CG1 VAL 45 17.725 8.735 -9.404 1.00 0.00 ATOM 331 CG2 VAL 45 17.760 8.484 -11.858 1.00 0.00 ATOM 332 O VAL 45 14.961 8.099 -9.612 1.00 0.00 ATOM 333 C VAL 45 15.107 8.661 -10.690 1.00 0.00 ATOM 334 N ARG 46 14.437 8.314 -11.782 1.00 0.00 ATOM 335 CA ARG 46 13.713 7.051 -11.870 1.00 0.00 ATOM 336 CB ARG 46 12.226 7.323 -12.111 1.00 0.00 ATOM 337 CG ARG 46 11.560 8.141 -11.017 1.00 0.00 ATOM 338 CD ARG 46 11.378 7.322 -9.749 1.00 0.00 ATOM 339 NE ARG 46 10.644 8.057 -8.722 1.00 0.00 ATOM 340 CZ ARG 46 10.544 7.671 -7.455 1.00 0.00 ATOM 341 NH1 ARG 46 9.856 8.404 -6.591 1.00 0.00 ATOM 342 NH2 ARG 46 11.133 6.553 -7.054 1.00 0.00 ATOM 343 O ARG 46 14.590 6.753 -14.082 1.00 0.00 ATOM 344 C ARG 46 14.265 6.219 -13.022 1.00 0.00 ATOM 345 N SER 47 14.402 4.915 -12.800 1.00 0.00 ATOM 346 CA SER 47 14.913 4.036 -13.823 1.00 0.00 ATOM 347 CB SER 47 15.153 2.642 -13.373 1.00 0.00 ATOM 348 OG SER 47 14.002 2.021 -12.892 1.00 0.00 ATOM 349 O SER 47 14.465 4.008 -16.178 1.00 0.00 ATOM 350 C SER 47 13.996 4.017 -15.040 1.00 0.00 ATOM 351 N THR 48 12.692 3.922 -14.799 1.00 0.00 ATOM 352 CA THR 48 11.722 3.898 -15.888 1.00 0.00 ATOM 353 CB THR 48 10.281 3.675 -15.391 1.00 0.00 ATOM 354 CG2 THR 48 10.179 2.365 -14.624 1.00 0.00 ATOM 355 OG1 THR 48 9.901 4.751 -14.524 1.00 0.00 ATOM 356 O THR 48 11.468 5.151 -17.854 1.00 0.00 ATOM 357 C THR 48 11.757 5.205 -16.656 1.00 0.00 ATOM 358 N GLY 49 13.434 2.376 -19.334 1.00 0.00 ATOM 359 CA GLY 49 14.711 2.602 -19.995 1.00 0.00 ATOM 360 O GLY 49 16.345 4.212 -20.616 1.00 0.00 ATOM 361 C GLY 49 15.313 3.986 -19.970 1.00 0.00 ATOM 362 N LYS 50 14.756 4.906 -19.179 1.00 0.00 ATOM 363 CA LYS 50 15.394 6.202 -19.076 1.00 0.00 ATOM 364 CB LYS 50 14.650 7.237 -19.910 1.00 0.00 ATOM 365 CG LYS 50 14.371 6.798 -21.337 1.00 0.00 ATOM 366 CD LYS 50 15.414 7.325 -22.302 1.00 0.00 ATOM 367 CE LYS 50 15.100 6.909 -23.729 1.00 0.00 ATOM 368 NZ LYS 50 16.076 7.460 -24.697 1.00 0.00 ATOM 369 O LYS 50 14.312 6.400 -16.925 1.00 0.00 ATOM 370 C LYS 50 15.284 6.703 -17.633 1.00 0.00 ATOM 371 N PRO 51 16.205 7.582 -17.281 1.00 0.00 ATOM 372 CA PRO 51 16.150 8.309 -16.029 1.00 0.00 ATOM 373 CB PRO 51 17.550 8.909 -15.889 1.00 0.00 ATOM 374 CG PRO 51 18.006 9.126 -17.292 1.00 0.00 ATOM 375 CD PRO 51 17.450 7.982 -18.093 1.00 0.00 ATOM 376 O PRO 51 14.809 10.006 -17.160 1.00 0.00 ATOM 377 C PRO 51 15.071 9.385 -16.090 1.00 0.00 ATOM 378 N ASN 52 14.435 9.606 -14.922 1.00 0.00 ATOM 379 CA ASN 52 13.499 10.691 -14.700 1.00 0.00 ATOM 380 CB ASN 52 12.086 10.144 -14.478 1.00 0.00 ATOM 381 CG ASN 52 11.582 9.337 -15.659 1.00 0.00 ATOM 382 ND2 ASN 52 11.587 8.016 -15.516 1.00 0.00 ATOM 383 OD1 ASN 52 11.194 9.896 -16.685 1.00 0.00 ATOM 384 O ASN 52 13.881 11.006 -12.361 1.00 0.00 ATOM 385 C ASN 52 13.853 11.523 -13.482 1.00 0.00 ATOM 386 N THR 53 14.330 12.823 -13.656 1.00 0.00 ATOM 387 CA THR 53 14.732 13.699 -12.559 1.00 0.00 ATOM 388 CB THR 53 16.170 14.215 -12.757 1.00 0.00 ATOM 389 CG2 THR 53 17.164 13.066 -12.679 1.00 0.00 ATOM 390 OG1 THR 53 16.284 14.840 -14.041 1.00 0.00 ATOM 391 O THR 53 12.893 14.995 -11.626 1.00 0.00 ATOM 392 C THR 53 13.732 14.860 -12.551 1.00 0.00 ATOM 393 N SER 54 13.703 15.636 -13.621 1.00 0.00 ATOM 394 CA SER 54 12.694 16.711 -13.742 1.00 0.00 ATOM 395 CB SER 54 13.045 17.642 -14.905 1.00 0.00 ATOM 396 OG SER 54 14.280 18.299 -14.678 1.00 0.00 ATOM 397 O SER 54 10.296 16.593 -13.410 1.00 0.00 ATOM 398 C SER 54 11.305 16.131 -13.983 1.00 0.00 ATOM 399 N ASP 55 11.225 15.096 -14.803 1.00 0.00 ATOM 400 CA ASP 55 9.949 14.540 -15.159 1.00 0.00 ATOM 401 CB ASP 55 10.058 13.735 -16.455 1.00 0.00 ATOM 402 CG ASP 55 10.253 14.614 -17.675 1.00 0.00 ATOM 403 OD1 ASP 55 10.072 15.844 -17.554 1.00 0.00 ATOM 404 OD2 ASP 55 10.588 14.075 -18.750 1.00 0.00 ATOM 405 O ASP 55 10.117 12.838 -13.314 1.00 0.00 ATOM 406 C ASP 55 9.387 13.583 -14.059 1.00 0.00 ATOM 407 N THR 56 8.073 13.582 -13.945 1.00 0.00 ATOM 408 CA THR 56 7.378 12.711 -12.976 1.00 0.00 ATOM 409 CB THR 56 5.998 13.279 -12.594 1.00 0.00 ATOM 410 CG2 THR 56 6.142 14.670 -11.998 1.00 0.00 ATOM 411 OG1 THR 56 5.171 13.358 -13.761 1.00 0.00 ATOM 412 O THR 56 7.160 11.165 -14.829 1.00 0.00 ATOM 413 C THR 56 7.217 11.331 -13.590 1.00 0.00 ATOM 414 N ASP 57 7.137 10.340 -12.710 1.00 0.00 ATOM 415 CA ASP 57 7.092 8.915 -13.095 1.00 0.00 ATOM 416 CB ASP 57 8.076 8.087 -12.265 1.00 0.00 ATOM 417 CG ASP 57 8.150 6.642 -12.721 1.00 0.00 ATOM 418 OD1 ASP 57 7.476 6.298 -13.714 1.00 0.00 ATOM 419 OD2 ASP 57 8.882 5.857 -12.082 1.00 0.00 ATOM 420 O ASP 57 5.054 8.702 -11.877 1.00 0.00 ATOM 421 C ASP 57 5.682 8.366 -12.875 1.00 0.00 ATOM 422 N SER 58 5.121 7.549 -13.782 1.00 0.00 ATOM 423 CA SER 58 3.802 6.934 -13.551 1.00 0.00 ATOM 424 CB SER 58 3.432 6.010 -14.714 1.00 0.00 ATOM 425 OG SER 58 2.192 5.366 -14.477 1.00 0.00 ATOM 426 O SER 58 4.708 5.354 -11.950 1.00 0.00 ATOM 427 C SER 58 3.777 6.118 -12.245 1.00 0.00 ATOM 428 N ASN 59 2.680 6.278 -11.519 1.00 0.00 ATOM 429 CA ASN 59 2.417 5.507 -10.311 1.00 0.00 ATOM 430 CB ASN 59 2.947 6.257 -9.094 1.00 0.00 ATOM 431 CG ASN 59 2.605 7.721 -9.116 1.00 0.00 ATOM 432 ND2 ASN 59 3.611 8.580 -8.961 1.00 0.00 ATOM 433 OD1 ASN 59 1.451 8.085 -9.282 1.00 0.00 ATOM 434 O ASN 59 0.115 5.929 -10.937 1.00 0.00 ATOM 435 C ASN 59 0.894 5.272 -10.250 1.00 0.00 ATOM 436 N VAL 60 0.499 4.383 -9.310 1.00 0.00 ATOM 437 CA VAL 60 -0.897 4.126 -9.007 1.00 0.00 ATOM 438 CB VAL 60 -1.225 2.637 -9.223 1.00 0.00 ATOM 439 CG1 VAL 60 -2.680 2.357 -8.876 1.00 0.00 ATOM 440 CG2 VAL 60 -0.993 2.246 -10.673 1.00 0.00 ATOM 441 O VAL 60 -0.385 4.136 -6.634 1.00 0.00 ATOM 442 C VAL 60 -1.165 4.512 -7.515 1.00 0.00 ATOM 443 N LYS 61 -2.291 5.295 -7.271 1.00 0.00 ATOM 444 CA LYS 61 -2.741 5.578 -5.900 1.00 0.00 ATOM 445 CB LYS 61 -3.246 7.018 -5.788 1.00 0.00 ATOM 446 CG LYS 61 -3.671 7.419 -4.386 1.00 0.00 ATOM 447 CD LYS 61 -3.938 8.914 -4.297 1.00 0.00 ATOM 448 CE LYS 61 -5.262 9.277 -4.948 1.00 0.00 ATOM 449 NZ LYS 61 -5.547 10.735 -4.852 1.00 0.00 ATOM 450 O LYS 61 -4.865 4.562 -6.278 1.00 0.00 ATOM 451 C LYS 61 -3.878 4.638 -5.529 1.00 0.00 ATOM 452 N PHE 62 -3.760 3.977 -4.403 1.00 0.00 ATOM 453 CA PHE 62 -4.809 3.185 -3.819 1.00 0.00 ATOM 454 CB PHE 62 -4.277 1.753 -3.547 1.00 0.00 ATOM 455 CG PHE 62 -5.254 0.832 -2.851 1.00 0.00 ATOM 456 CD1 PHE 62 -6.132 0.056 -3.572 1.00 0.00 ATOM 457 CD2 PHE 62 -5.260 0.713 -1.481 1.00 0.00 ATOM 458 CE1 PHE 62 -7.010 -0.812 -2.936 1.00 0.00 ATOM 459 CE2 PHE 62 -6.108 -0.140 -0.855 1.00 0.00 ATOM 460 CZ PHE 62 -6.972 -0.916 -1.583 1.00 0.00 ATOM 461 O PHE 62 -4.364 4.014 -1.621 1.00 0.00 ATOM 462 C PHE 62 -5.193 3.822 -2.512 1.00 0.00 ATOM 463 N GLU 63 -6.471 4.140 -2.360 1.00 0.00 ATOM 464 CA GLU 63 -7.069 4.727 -1.140 1.00 0.00 ATOM 465 CB GLU 63 -7.883 5.974 -1.490 1.00 0.00 ATOM 466 CG GLU 63 -7.049 7.140 -1.995 1.00 0.00 ATOM 467 CD GLU 63 -7.881 8.378 -2.266 1.00 0.00 ATOM 468 OE1 GLU 63 -9.100 8.342 -2.005 1.00 0.00 ATOM 469 OE2 GLU 63 -7.311 9.384 -2.741 1.00 0.00 ATOM 470 O GLU 63 -8.907 3.271 -1.147 1.00 0.00 ATOM 471 C GLU 63 -7.984 3.716 -0.483 1.00 0.00 ATOM 472 N VAL 64 -7.774 3.333 0.780 1.00 0.00 ATOM 473 CA VAL 64 -8.589 2.400 1.530 1.00 0.00 ATOM 474 CB VAL 64 -7.964 0.972 1.438 1.00 0.00 ATOM 475 CG1 VAL 64 -6.582 0.964 2.124 1.00 0.00 ATOM 476 CG2 VAL 64 -8.829 -0.072 2.109 1.00 0.00 ATOM 477 O VAL 64 -8.093 3.311 3.648 1.00 0.00 ATOM 478 C VAL 64 -8.968 3.012 2.839 1.00 0.00 ATOM 479 N LEU 65 -10.279 3.241 3.023 1.00 0.00 ATOM 480 CA LEU 65 -10.785 3.675 4.328 1.00 0.00 ATOM 481 CB LEU 65 -12.128 4.191 4.122 1.00 0.00 ATOM 482 CG LEU 65 -11.874 5.695 4.188 1.00 0.00 ATOM 483 CD1 LEU 65 -12.987 6.452 3.550 1.00 0.00 ATOM 484 CD2 LEU 65 -11.719 6.161 5.646 1.00 0.00 ATOM 485 O LEU 65 -11.896 1.594 4.763 1.00 0.00 ATOM 486 C LEU 65 -11.128 2.458 5.190 1.00 0.00 ATOM 487 N THR 66 -10.453 2.417 6.336 1.00 0.00 ATOM 488 CA THR 66 -10.488 1.282 7.266 1.00 0.00 ATOM 489 CB THR 66 -9.201 0.440 7.177 1.00 0.00 ATOM 490 CG2 THR 66 -8.961 -0.017 5.746 1.00 0.00 ATOM 491 OG1 THR 66 -8.082 1.226 7.606 1.00 0.00 ATOM 492 O THR 66 -10.457 2.918 8.987 1.00 0.00 ATOM 493 C THR 66 -10.632 1.773 8.684 1.00 0.00 ATOM 494 N GLU 67 -10.885 0.858 9.602 1.00 0.00 ATOM 495 CA GLU 67 -10.829 1.147 11.032 1.00 0.00 ATOM 496 CB GLU 67 -11.372 -0.035 11.838 1.00 0.00 ATOM 497 CG GLU 67 -12.867 -0.261 11.679 1.00 0.00 ATOM 498 CD GLU 67 -13.369 -1.437 12.495 1.00 0.00 ATOM 499 OE1 GLU 67 -12.540 -2.100 13.153 1.00 0.00 ATOM 500 OE2 GLU 67 -14.590 -1.695 12.474 1.00 0.00 ATOM 501 O GLU 67 -8.473 0.824 10.839 1.00 0.00 ATOM 502 C GLU 67 -9.388 1.397 11.427 1.00 0.00 ATOM 503 N ASN 68 -9.166 2.240 12.437 1.00 0.00 ATOM 504 CA ASN 68 -7.809 2.576 12.849 1.00 0.00 ATOM 505 CB ASN 68 -7.832 3.499 14.068 1.00 0.00 ATOM 506 CG ASN 68 -6.451 3.999 14.448 1.00 0.00 ATOM 507 ND2 ASN 68 -5.998 3.630 15.641 1.00 0.00 ATOM 508 OD1 ASN 68 -5.802 4.703 13.677 1.00 0.00 ATOM 509 O ASN 68 -5.827 1.251 13.103 1.00 0.00 ATOM 510 C ASN 68 -7.034 1.345 13.287 1.00 0.00 ATOM 511 N ARG 69 -7.715 0.359 13.860 1.00 0.00 ATOM 512 CA ARG 69 -7.062 -0.872 14.275 1.00 0.00 ATOM 513 CB ARG 69 -7.954 -1.696 15.177 1.00 0.00 ATOM 514 CG ARG 69 -7.205 -2.791 15.926 1.00 0.00 ATOM 515 CD ARG 69 -8.151 -3.695 16.700 1.00 0.00 ATOM 516 NE ARG 69 -8.885 -4.603 15.822 1.00 0.00 ATOM 517 CZ ARG 69 -8.317 -5.571 15.109 1.00 0.00 ATOM 518 NH1 ARG 69 -7.007 -5.761 15.168 1.00 0.00 ATOM 519 NH2 ARG 69 -9.061 -6.353 14.338 1.00 0.00 ATOM 520 O ARG 69 -5.476 -2.178 13.056 1.00 0.00 ATOM 521 C ARG 69 -6.591 -1.684 13.053 1.00 0.00 ATOM 522 N GLU 70 -7.518 -1.660 11.969 1.00 0.00 ATOM 523 CA GLU 70 -7.140 -2.423 10.787 1.00 0.00 ATOM 524 CB GLU 70 -8.231 -2.332 9.718 1.00 0.00 ATOM 525 CG GLU 70 -9.503 -3.089 10.064 1.00 0.00 ATOM 526 CD GLU 70 -10.603 -2.875 9.043 1.00 0.00 ATOM 527 OE1 GLU 70 -10.396 -2.078 8.104 1.00 0.00 ATOM 528 OE2 GLU 70 -11.672 -3.506 9.181 1.00 0.00 ATOM 529 O GLU 70 -4.984 -2.657 9.722 1.00 0.00 ATOM 530 C GLU 70 -5.831 -1.887 10.186 1.00 0.00 ATOM 531 N MET 71 -5.663 -0.569 10.202 1.00 0.00 ATOM 532 CA MET 71 -4.454 0.055 9.662 1.00 0.00 ATOM 533 CB MET 71 -4.479 1.567 9.903 1.00 0.00 ATOM 534 CG MET 71 -5.533 2.307 9.095 1.00 0.00 ATOM 535 SD MET 71 -5.304 2.123 7.318 1.00 0.00 ATOM 536 CE MET 71 -3.792 3.052 7.072 1.00 0.00 ATOM 537 O MET 71 -2.135 -0.563 9.696 1.00 0.00 ATOM 538 C MET 71 -3.191 -0.496 10.321 1.00 0.00 ATOM 539 N ALA 72 -3.300 -0.878 11.591 1.00 0.00 ATOM 540 CA ALA 72 -2.162 -1.417 12.322 1.00 0.00 ATOM 541 CB ALA 72 -2.582 -1.783 13.742 1.00 0.00 ATOM 542 O ALA 72 -0.368 -2.818 11.567 1.00 0.00 ATOM 543 C ALA 72 -1.585 -2.645 11.625 1.00 0.00 ATOM 544 N GLU 73 -2.461 -3.495 11.099 1.00 0.00 ATOM 545 CA GLU 73 -2.020 -4.699 10.409 1.00 0.00 ATOM 546 CB GLU 73 -3.214 -5.619 10.149 1.00 0.00 ATOM 547 CG GLU 73 -3.988 -5.994 11.403 1.00 0.00 ATOM 548 CD GLU 73 -5.086 -7.002 11.127 1.00 0.00 ATOM 549 OE1 GLU 73 -5.824 -6.822 10.134 1.00 0.00 ATOM 550 OE2 GLU 73 -5.215 -7.970 11.906 1.00 0.00 ATOM 551 O GLU 73 -0.332 -4.946 8.734 1.00 0.00 ATOM 552 C GLU 73 -1.358 -4.364 9.090 1.00 0.00 ATOM 553 N LYS 74 -1.942 -3.422 8.359 1.00 0.00 ATOM 554 CA LYS 74 -1.392 -3.015 7.071 1.00 0.00 ATOM 555 CB LYS 74 -2.396 -2.131 6.327 1.00 0.00 ATOM 556 CG LYS 74 -3.710 -2.842 6.037 1.00 0.00 ATOM 557 CD LYS 74 -4.751 -1.915 5.441 1.00 0.00 ATOM 558 CE LYS 74 -6.069 -2.656 5.244 1.00 0.00 ATOM 559 NZ LYS 74 -7.151 -1.760 4.748 1.00 0.00 ATOM 560 O LYS 74 0.771 -2.297 6.304 1.00 0.00 ATOM 561 C LYS 74 -0.057 -2.276 7.215 1.00 0.00 ATOM 562 N ILE 75 0.146 -1.630 8.359 1.00 0.00 ATOM 563 CA ILE 75 1.381 -0.897 8.604 1.00 0.00 ATOM 564 CB ILE 75 1.393 -0.220 9.988 1.00 0.00 ATOM 565 CG1 ILE 75 0.349 0.897 10.043 1.00 0.00 ATOM 566 CG2 ILE 75 2.759 0.383 10.274 1.00 0.00 ATOM 567 CD1 ILE 75 0.106 1.436 11.436 1.00 0.00 ATOM 568 O ILE 75 3.597 -1.472 7.969 1.00 0.00 ATOM 569 C ILE 75 2.578 -1.835 8.527 1.00 0.00 ATOM 570 N ALA 76 2.382 -3.065 9.022 1.00 0.00 ATOM 571 CA ALA 76 3.452 -4.048 8.888 1.00 0.00 ATOM 572 CB ALA 76 3.035 -5.374 9.508 1.00 0.00 ATOM 573 O ALA 76 4.961 -4.365 7.050 1.00 0.00 ATOM 574 C ALA 76 3.789 -4.295 7.422 1.00 0.00 ATOM 575 N ASP 77 2.760 -4.453 6.595 1.00 0.00 ATOM 576 CA ASP 77 2.964 -4.692 5.167 1.00 0.00 ATOM 577 CB ASP 77 1.638 -4.890 4.425 1.00 0.00 ATOM 578 CG ASP 77 1.009 -6.237 4.682 1.00 0.00 ATOM 579 OD1 ASP 77 1.745 -7.235 4.801 1.00 0.00 ATOM 580 OD2 ASP 77 -0.225 -6.387 4.764 1.00 0.00 ATOM 581 O ASP 77 4.573 -3.745 3.649 1.00 0.00 ATOM 582 C ASP 77 3.739 -3.530 4.528 1.00 0.00 ATOM 583 N GLN 78 3.457 -2.310 4.971 1.00 0.00 ATOM 584 CA GLN 78 4.134 -1.136 4.435 1.00 0.00 ATOM 585 CB GLN 78 3.488 0.178 4.894 1.00 0.00 ATOM 586 CG GLN 78 1.973 0.204 4.959 1.00 0.00 ATOM 587 CD GLN 78 1.313 -0.227 3.669 1.00 0.00 ATOM 588 OE1 GLN 78 1.653 0.266 2.600 1.00 0.00 ATOM 589 NE2 GLN 78 0.354 -1.138 3.771 1.00 0.00 ATOM 590 O GLN 78 6.443 -0.708 3.966 1.00 0.00 ATOM 591 C GLN 78 5.616 -1.125 4.781 1.00 0.00 ATOM 592 N VAL 79 5.952 -1.586 5.980 1.00 0.00 ATOM 593 CA VAL 79 7.348 -1.669 6.405 1.00 0.00 ATOM 594 CB VAL 79 7.467 -1.800 7.940 1.00 0.00 ATOM 595 CG1 VAL 79 8.927 -1.846 8.355 1.00 0.00 ATOM 596 CG2 VAL 79 6.743 -0.621 8.617 1.00 0.00 ATOM 597 O VAL 79 9.258 -2.610 5.276 1.00 0.00 ATOM 598 C VAL 79 8.094 -2.777 5.641 1.00 0.00 ATOM 599 N ALA 80 7.430 -3.895 5.359 1.00 0.00 ATOM 600 CA ALA 80 7.986 -4.885 4.447 1.00 0.00 ATOM 601 CB ALA 80 7.010 -6.034 4.248 1.00 0.00 ATOM 602 O ALA 80 9.379 -4.502 2.514 1.00 0.00 ATOM 603 C ALA 80 8.314 -4.254 3.087 1.00 0.00 ATOM 604 N ILE 81 7.394 -3.429 2.593 1.00 0.00 ATOM 605 CA ILE 81 7.585 -2.779 1.297 1.00 0.00 ATOM 606 CB ILE 81 6.265 -2.143 0.777 1.00 0.00 ATOM 607 CG1 ILE 81 5.204 -3.181 0.395 1.00 0.00 ATOM 608 CG2 ILE 81 6.529 -1.206 -0.415 1.00 0.00 ATOM 609 CD1 ILE 81 3.822 -2.584 0.204 1.00 0.00 ATOM 610 O ILE 81 9.549 -1.719 0.408 1.00 0.00 ATOM 611 C ILE 81 8.753 -1.797 1.348 1.00 0.00 ATOM 612 N LYS 82 8.854 -1.058 2.426 1.00 0.00 ATOM 613 CA LYS 82 9.921 -0.065 2.573 1.00 0.00 ATOM 614 CB LYS 82 9.762 0.702 3.888 1.00 0.00 ATOM 615 CG LYS 82 8.572 1.648 3.913 1.00 0.00 ATOM 616 CD LYS 82 8.471 2.370 5.247 1.00 0.00 ATOM 617 CE LYS 82 7.278 3.312 5.275 1.00 0.00 ATOM 618 NZ LYS 82 7.147 4.003 6.586 1.00 0.00 ATOM 619 O LYS 82 12.257 -0.061 2.109 1.00 0.00 ATOM 620 C LYS 82 11.312 -0.684 2.581 1.00 0.00 ATOM 621 N PHE 83 11.448 -1.913 3.087 1.00 0.00 ATOM 622 CA PHE 83 12.734 -2.616 3.034 1.00 0.00 ATOM 623 CB PHE 83 12.611 -4.007 3.660 1.00 0.00 ATOM 624 CG PHE 83 12.403 -3.986 5.148 1.00 0.00 ATOM 625 CD1 PHE 83 12.650 -2.837 5.880 1.00 0.00 ATOM 626 CD2 PHE 83 11.962 -5.114 5.817 1.00 0.00 ATOM 627 CE1 PHE 83 12.459 -2.817 7.247 1.00 0.00 ATOM 628 CE2 PHE 83 11.771 -5.094 7.186 1.00 0.00 ATOM 629 CZ PHE 83 12.018 -3.952 7.901 1.00 0.00 ATOM 630 O PHE 83 14.424 -2.765 1.366 1.00 0.00 ATOM 631 C PHE 83 13.234 -2.798 1.603 1.00 0.00 ATOM 632 N PHE 84 12.336 -3.046 0.709 1.00 0.00 ATOM 633 CA PHE 84 12.639 -3.368 -0.684 1.00 0.00 ATOM 634 CB PHE 84 12.009 -4.707 -1.072 1.00 0.00 ATOM 635 CG PHE 84 12.521 -5.872 -0.275 1.00 0.00 ATOM 636 CD1 PHE 84 11.773 -6.403 0.759 1.00 0.00 ATOM 637 CD2 PHE 84 13.753 -6.436 -0.560 1.00 0.00 ATOM 638 CE1 PHE 84 12.244 -7.477 1.494 1.00 0.00 ATOM 639 CE2 PHE 84 14.224 -7.508 0.174 1.00 0.00 ATOM 640 CZ PHE 84 13.477 -8.028 1.196 1.00 0.00 ATOM 641 O PHE 84 12.173 -2.492 -2.868 1.00 0.00 ATOM 642 C PHE 84 12.127 -2.307 -1.652 1.00 0.00 ATOM 643 N THR 85 11.688 -1.173 -1.113 1.00 0.00 ATOM 644 CA THR 85 11.185 -0.103 -1.939 1.00 0.00 ATOM 645 CB THR 85 9.667 0.022 -1.894 1.00 0.00 ATOM 646 CG2 THR 85 8.968 -1.344 -2.219 1.00 0.00 ATOM 647 OG1 THR 85 9.194 0.568 -0.672 1.00 0.00 ATOM 648 O THR 85 11.970 1.391 -0.244 1.00 0.00 ATOM 649 C THR 85 11.688 1.234 -1.432 1.00 0.00 ATOM 650 N ASP 86 11.803 2.203 -2.334 1.00 0.00 ATOM 651 CA ASP 86 12.275 3.531 -1.960 1.00 0.00 ATOM 652 CB ASP 86 13.635 3.710 -2.565 1.00 0.00 ATOM 653 CG ASP 86 14.154 5.118 -2.307 1.00 0.00 ATOM 654 OD1 ASP 86 13.485 6.134 -2.658 1.00 0.00 ATOM 655 OD2 ASP 86 15.270 5.320 -1.758 1.00 0.00 ATOM 656 O ASP 86 11.287 4.126 -4.036 1.00 0.00 ATOM 657 C ASP 86 11.600 4.502 -2.916 1.00 0.00 ATOM 658 N TYR 87 11.214 3.816 -5.382 1.00 0.00 ATOM 659 CA TYR 87 10.011 3.843 -6.191 1.00 0.00 ATOM 660 CB TYR 87 10.260 3.328 -7.582 1.00 0.00 ATOM 661 CG TYR 87 9.018 3.291 -8.437 1.00 0.00 ATOM 662 CD1 TYR 87 8.353 4.467 -8.794 1.00 0.00 ATOM 663 CD2 TYR 87 8.501 2.080 -8.890 1.00 0.00 ATOM 664 CE1 TYR 87 7.205 4.432 -9.583 1.00 0.00 ATOM 665 CE2 TYR 87 7.365 2.033 -9.680 1.00 0.00 ATOM 666 CZ TYR 87 6.723 3.216 -10.024 1.00 0.00 ATOM 667 OH TYR 87 5.621 3.181 -10.842 1.00 0.00 ATOM 668 O TYR 87 7.795 3.368 -5.306 1.00 0.00 ATOM 669 C TYR 87 8.936 2.952 -5.532 1.00 0.00 ATOM 670 N ALA 88 9.277 1.688 -5.247 1.00 0.00 ATOM 671 CA ALA 88 8.262 0.768 -4.704 1.00 0.00 ATOM 672 CB ALA 88 8.857 -0.646 -4.679 1.00 0.00 ATOM 673 O ALA 88 6.582 1.126 -3.068 1.00 0.00 ATOM 674 C ALA 88 7.767 1.260 -3.355 1.00 0.00 ATOM 675 N GLY 89 7.089 3.143 -3.263 1.00 0.00 ATOM 676 CA GLY 89 5.845 3.678 -2.765 1.00 0.00 ATOM 677 O GLY 89 6.927 4.450 -0.818 1.00 0.00 ATOM 678 C GLY 89 5.912 4.421 -1.480 1.00 0.00 ATOM 679 N ILE 90 4.788 4.999 -1.125 1.00 0.00 ATOM 680 CA ILE 90 4.649 5.740 0.128 1.00 0.00 ATOM 681 CB ILE 90 4.979 7.233 -0.059 1.00 0.00 ATOM 682 CG1 ILE 90 5.052 7.937 1.297 1.00 0.00 ATOM 683 CG2 ILE 90 3.910 7.915 -0.900 1.00 0.00 ATOM 684 CD1 ILE 90 5.686 9.309 1.240 1.00 0.00 ATOM 685 O ILE 90 2.270 5.642 -0.206 1.00 0.00 ATOM 686 C ILE 90 3.205 5.631 0.589 1.00 0.00 ATOM 687 N ILE 91 3.000 5.522 1.905 1.00 0.00 ATOM 688 CA ILE 91 1.668 5.420 2.479 1.00 0.00 ATOM 689 CB ILE 91 1.543 4.123 3.298 1.00 0.00 ATOM 690 CG1 ILE 91 2.553 4.118 4.447 1.00 0.00 ATOM 691 CG2 ILE 91 1.807 2.910 2.421 1.00 0.00 ATOM 692 CD1 ILE 91 2.363 2.978 5.422 1.00 0.00 ATOM 693 O ILE 91 2.350 7.041 4.152 1.00 0.00 ATOM 694 C ILE 91 1.446 6.625 3.399 1.00 0.00 ATOM 695 N TYR 92 0.251 7.200 3.304 1.00 0.00 ATOM 696 CA TYR 92 -0.225 8.268 4.128 1.00 0.00 ATOM 697 CB TYR 92 -0.573 9.487 3.271 1.00 0.00 ATOM 698 CG TYR 92 0.617 10.097 2.565 1.00 0.00 ATOM 699 CD1 TYR 92 0.968 9.693 1.283 1.00 0.00 ATOM 700 CD2 TYR 92 1.384 11.078 3.183 1.00 0.00 ATOM 701 CE1 TYR 92 2.054 10.246 0.630 1.00 0.00 ATOM 702 CE2 TYR 92 2.473 11.642 2.544 1.00 0.00 ATOM 703 CZ TYR 92 2.802 11.217 1.257 1.00 0.00 ATOM 704 OH TYR 92 3.885 11.770 0.610 1.00 0.00 ATOM 705 O TYR 92 -2.415 7.252 4.269 1.00 0.00 ATOM 706 C TYR 92 -1.480 7.828 4.872 1.00 0.00 ATOM 707 N ILE 93 -1.531 8.117 6.173 1.00 0.00 ATOM 708 CA ILE 93 -2.715 7.835 7.002 1.00 0.00 ATOM 709 CB ILE 93 -2.321 7.142 8.320 1.00 0.00 ATOM 710 CG1 ILE 93 -1.619 5.812 8.035 1.00 0.00 ATOM 711 CG2 ILE 93 -3.555 6.865 9.165 1.00 0.00 ATOM 712 CD1 ILE 93 -1.011 5.169 9.262 1.00 0.00 ATOM 713 O ILE 93 -2.864 9.988 8.032 1.00 0.00 ATOM 714 C ILE 93 -3.428 9.134 7.355 1.00 0.00 ATOM 715 N CYS 94 -4.683 9.219 6.904 1.00 0.00 ATOM 716 CA CYS 94 -5.489 10.463 6.993 1.00 0.00 ATOM 717 CB CYS 94 -5.933 10.881 5.589 1.00 0.00 ATOM 718 SG CYS 94 -4.576 11.268 4.460 1.00 0.00 ATOM 719 O CYS 94 -7.437 9.189 7.766 1.00 0.00 ATOM 720 C CYS 94 -6.723 10.196 7.872 1.00 0.00 ATOM 721 N GLU 95 -6.982 11.152 8.848 1.00 0.00 ATOM 722 CA GLU 95 -8.166 11.075 9.723 1.00 0.00 ATOM 723 CB GLU 95 -8.325 12.193 10.757 1.00 0.00 ATOM 724 CG GLU 95 -7.081 12.419 11.618 1.00 0.00 ATOM 725 CD GLU 95 -6.352 13.717 11.258 1.00 0.00 ATOM 726 OE1 GLU 95 -6.057 13.943 10.053 1.00 0.00 ATOM 727 OE2 GLU 95 -6.054 14.507 12.191 1.00 0.00 ATOM 728 O GLU 95 -9.612 11.914 8.004 1.00 0.00 ATOM 729 C GLU 95 -9.436 11.066 8.879 1.00 0.00 ATOM 730 N ALA 96 -10.330 10.125 9.159 1.00 0.00 ATOM 731 CA ALA 96 -11.568 10.028 8.422 1.00 0.00 ATOM 732 CB ALA 96 -12.351 8.793 8.797 1.00 0.00 ATOM 733 O ALA 96 -12.979 11.853 7.761 1.00 0.00 ATOM 734 C ALA 96 -12.429 11.260 8.689 1.00 0.00 ATOM 735 N GLU 97 -12.515 11.662 9.953 1.00 0.00 ATOM 736 CA GLU 97 -13.308 12.829 10.321 1.00 0.00 ATOM 737 CB GLU 97 -13.243 13.089 11.828 1.00 0.00 ATOM 738 CG GLU 97 -14.088 14.263 12.293 1.00 0.00 ATOM 739 CD GLU 97 -14.027 14.469 13.793 1.00 0.00 ATOM 740 OE1 GLU 97 -13.331 13.684 14.472 1.00 0.00 ATOM 741 OE2 GLU 97 -14.672 15.414 14.290 1.00 0.00 ATOM 742 O GLU 97 -13.555 14.808 8.957 1.00 0.00 ATOM 743 C GLU 97 -12.792 14.075 9.590 1.00 0.00 ATOM 744 N VAL 98 -11.393 14.249 9.591 1.00 0.00 ATOM 745 CA VAL 98 -10.772 15.362 8.890 1.00 0.00 ATOM 746 CB VAL 98 -9.251 15.403 9.131 1.00 0.00 ATOM 747 CG1 VAL 98 -8.599 16.455 8.246 1.00 0.00 ATOM 748 CG2 VAL 98 -8.951 15.741 10.582 1.00 0.00 ATOM 749 O VAL 98 -11.417 16.212 6.728 1.00 0.00 ATOM 750 C VAL 98 -11.004 15.249 7.382 1.00 0.00 ATOM 751 N LEU 99 -10.750 14.090 6.826 1.00 0.00 ATOM 752 CA LEU 99 -10.923 13.847 5.403 1.00 0.00 ATOM 753 CB LEU 99 -10.362 12.467 5.087 1.00 0.00 ATOM 754 CG LEU 99 -10.708 11.911 3.703 1.00 0.00 ATOM 755 CD1 LEU 99 -10.051 12.737 2.596 1.00 0.00 ATOM 756 CD2 LEU 99 -10.307 10.448 3.624 1.00 0.00 ATOM 757 O LEU 99 -12.708 14.581 3.991 1.00 0.00 ATOM 758 C LEU 99 -12.384 13.967 4.997 1.00 0.00 ATOM 759 N TYR 100 -13.287 13.416 5.791 1.00 0.00 ATOM 760 CA TYR 100 -14.691 13.496 5.417 1.00 0.00 ATOM 761 CB TYR 100 -15.578 12.609 6.259 1.00 0.00 ATOM 762 CG TYR 100 -15.240 11.127 6.205 1.00 0.00 ATOM 763 CD1 TYR 100 -14.746 10.522 5.061 1.00 0.00 ATOM 764 CD2 TYR 100 -15.371 10.338 7.370 1.00 0.00 ATOM 765 CE1 TYR 100 -14.455 9.166 5.047 1.00 0.00 ATOM 766 CE2 TYR 100 -15.115 8.977 7.346 1.00 0.00 ATOM 767 CZ TYR 100 -14.649 8.407 6.187 1.00 0.00 ATOM 768 OH TYR 100 -14.348 7.071 6.160 1.00 0.00 ATOM 769 O TYR 100 -15.926 15.347 4.523 1.00 0.00 ATOM 770 C TYR 100 -15.192 14.936 5.424 1.00 0.00 ATOM 771 N GLY 101 -14.731 15.722 6.390 1.00 0.00 ATOM 772 CA GLY 101 -15.143 17.134 6.496 1.00 0.00 ATOM 773 O GLY 101 -15.176 18.835 4.833 1.00 0.00 ATOM 774 C GLY 101 -14.520 17.966 5.367 1.00 0.00 ATOM 775 N ARG 102 -13.186 17.744 4.880 1.00 0.00 ATOM 776 CA ARG 102 -12.548 18.576 3.807 1.00 0.00 ATOM 777 CB ARG 102 -11.064 18.242 3.745 1.00 0.00 ATOM 778 CG ARG 102 -10.275 18.821 4.920 1.00 0.00 ATOM 779 CD ARG 102 -8.877 18.278 5.053 1.00 0.00 ATOM 780 NE ARG 102 -8.113 18.999 6.078 1.00 0.00 ATOM 781 CZ ARG 102 -6.825 18.784 6.351 1.00 0.00 ATOM 782 NH1 ARG 102 -6.138 17.846 5.696 1.00 0.00 ATOM 783 NH2 ARG 102 -6.227 19.486 7.305 1.00 0.00 ATOM 784 O ARG 102 -13.441 19.298 1.740 1.00 0.00 ATOM 785 C ARG 102 -13.242 18.318 2.491 1.00 0.00 ATOM 786 N THR 103 -13.676 17.092 2.210 1.00 0.00 ATOM 787 CA THR 103 -14.205 16.860 0.868 1.00 0.00 ATOM 788 CB THR 103 -13.426 15.860 -0.006 1.00 0.00 ATOM 789 CG2 THR 103 -12.039 16.398 -0.321 1.00 0.00 ATOM 790 OG1 THR 103 -13.293 14.615 0.692 1.00 0.00 ATOM 791 O THR 103 -16.248 16.193 -0.186 1.00 0.00 ATOM 792 C THR 103 -15.614 16.269 0.867 1.00 0.00 ATOM 793 N PHE 104 -16.045 15.740 2.080 1.00 0.00 ATOM 794 CA PHE 104 -17.310 15.023 2.199 1.00 0.00 ATOM 795 CB PHE 104 -18.451 15.846 1.598 1.00 0.00 ATOM 796 CG PHE 104 -18.613 17.204 2.220 1.00 0.00 ATOM 797 CD1 PHE 104 -18.270 18.347 1.520 1.00 0.00 ATOM 798 CD2 PHE 104 -19.109 17.337 3.505 1.00 0.00 ATOM 799 CE1 PHE 104 -18.419 19.597 2.093 1.00 0.00 ATOM 800 CE2 PHE 104 -19.258 18.586 4.077 1.00 0.00 ATOM 801 CZ PHE 104 -18.916 19.713 3.377 1.00 0.00 ATOM 802 O PHE 104 -18.345 13.009 1.571 1.00 0.00 ATOM 803 C PHE 104 -17.322 13.679 1.519 1.00 0.00 ATOM 804 N CYS 105 -16.181 13.215 1.024 1.00 0.00 ATOM 805 CA CYS 105 -16.116 11.892 0.390 1.00 0.00 ATOM 806 CB CYS 105 -14.710 11.627 -0.153 1.00 0.00 ATOM 807 SG CYS 105 -13.425 11.537 1.116 1.00 0.00 ATOM 808 O CYS 105 -16.078 10.890 2.565 1.00 0.00 ATOM 809 C CYS 105 -16.495 10.829 1.408 1.00 0.00 ATOM 810 N GLY 106 -17.287 9.852 0.978 1.00 0.00 ATOM 811 CA GLY 106 -17.713 8.778 1.867 1.00 0.00 ATOM 812 O GLY 106 -15.606 7.807 1.381 1.00 0.00 ATOM 813 C GLY 106 -16.619 7.770 2.071 1.00 0.00 ATOM 814 N PRO 107 -16.829 6.801 2.959 1.00 0.00 ATOM 815 CA PRO 107 -15.805 5.803 3.226 1.00 0.00 ATOM 816 CB PRO 107 -16.391 4.969 4.368 1.00 0.00 ATOM 817 CG PRO 107 -17.865 5.171 4.259 1.00 0.00 ATOM 818 CD PRO 107 -18.058 6.576 3.761 1.00 0.00 ATOM 819 O PRO 107 -14.236 4.523 1.977 1.00 0.00 ATOM 820 C PRO 107 -15.408 4.891 2.091 1.00 0.00 ATOM 821 N ASP 108 -16.362 4.502 1.262 1.00 0.00 ATOM 822 CA ASP 108 -16.039 3.588 0.172 1.00 0.00 ATOM 823 CB ASP 108 -17.314 3.143 -0.545 1.00 0.00 ATOM 824 CG ASP 108 -18.151 2.196 0.292 1.00 0.00 ATOM 825 OD1 ASP 108 -17.638 1.692 1.313 1.00 0.00 ATOM 826 OD2 ASP 108 -19.323 1.959 -0.073 1.00 0.00 ATOM 827 O ASP 108 -14.139 3.669 -1.277 1.00 0.00 ATOM 828 C ASP 108 -15.130 4.254 -0.843 1.00 0.00 ATOM 829 N GLY 109 -15.450 5.458 -1.220 1.00 0.00 ATOM 830 CA GLY 109 -14.618 6.251 -2.170 1.00 0.00 ATOM 831 O GLY 109 -12.332 6.866 -2.326 1.00 0.00 ATOM 832 C GLY 109 -13.252 6.638 -1.585 1.00 0.00 ATOM 833 N CYS 110 -13.191 6.793 -0.259 1.00 0.00 ATOM 834 CA CYS 110 -11.933 7.155 0.400 1.00 0.00 ATOM 835 CB CYS 110 -12.206 7.962 1.670 1.00 0.00 ATOM 836 SG CYS 110 -12.943 9.587 1.378 1.00 0.00 ATOM 837 O CYS 110 -10.005 5.739 0.421 1.00 0.00 ATOM 838 C CYS 110 -11.206 5.861 0.753 1.00 0.00 TER END