PFRMAT TS TARGET T0475 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 T0475 model 2 Thu Jun 26 12:55:10 2008 MODEL 2 PARENT N/A ATOM 2 N SER 3 -18.199 -2.273 -4.371 1.00 0.00 ATOM 3 CA SER 3 -17.236 -2.699 -5.395 1.00 0.00 ATOM 4 CB SER 3 -17.962 -3.322 -6.589 1.00 0.00 ATOM 5 OG SER 3 -18.603 -4.531 -6.221 1.00 0.00 ATOM 6 O SER 3 -15.212 -1.683 -6.151 1.00 0.00 ATOM 7 C SER 3 -16.414 -1.542 -5.910 1.00 0.00 ATOM 8 N GLU 4 -17.083 -0.409 -6.107 1.00 0.00 ATOM 9 CA GLU 4 -16.451 0.833 -6.515 1.00 0.00 ATOM 10 CB GLU 4 -17.464 1.979 -6.503 1.00 0.00 ATOM 11 CG GLU 4 -16.892 3.317 -6.944 1.00 0.00 ATOM 12 CD GLU 4 -17.933 4.419 -6.960 1.00 0.00 ATOM 13 OE1 GLU 4 -19.110 4.128 -6.656 1.00 0.00 ATOM 14 OE2 GLU 4 -17.573 5.572 -7.273 1.00 0.00 ATOM 15 O GLU 4 -14.186 1.495 -6.023 1.00 0.00 ATOM 16 C GLU 4 -15.307 1.201 -5.577 1.00 0.00 ATOM 17 N ILE 5 -15.597 1.196 -4.272 1.00 0.00 ATOM 18 CA ILE 5 -14.612 1.569 -3.244 1.00 0.00 ATOM 19 CB ILE 5 -15.237 1.569 -1.837 1.00 0.00 ATOM 20 CG1 ILE 5 -16.325 2.640 -1.737 1.00 0.00 ATOM 21 CG2 ILE 5 -14.178 1.859 -0.785 1.00 0.00 ATOM 22 CD1 ILE 5 -15.818 4.048 -1.959 1.00 0.00 ATOM 23 O ILE 5 -12.286 1.005 -3.126 1.00 0.00 ATOM 24 C ILE 5 -13.435 0.592 -3.225 1.00 0.00 ATOM 25 N GLU 6 -13.740 -0.691 -3.372 1.00 0.00 ATOM 26 CA GLU 6 -12.739 -1.743 -3.459 1.00 0.00 ATOM 27 CB GLU 6 -13.408 -3.112 -3.591 1.00 0.00 ATOM 28 CG GLU 6 -12.435 -4.279 -3.643 1.00 0.00 ATOM 29 CD GLU 6 -13.137 -5.619 -3.739 1.00 0.00 ATOM 30 OE1 GLU 6 -14.385 -5.637 -3.752 1.00 0.00 ATOM 31 OE2 GLU 6 -12.437 -6.653 -3.801 1.00 0.00 ATOM 32 O GLU 6 -10.589 -1.663 -4.564 1.00 0.00 ATOM 33 C GLU 6 -11.816 -1.558 -4.671 1.00 0.00 ATOM 34 N LEU 7 -12.410 -1.258 -5.816 1.00 0.00 ATOM 35 CA LEU 7 -11.642 -1.067 -7.028 1.00 0.00 ATOM 36 CB LEU 7 -12.572 -0.932 -8.236 1.00 0.00 ATOM 37 CG LEU 7 -13.334 -2.193 -8.650 1.00 0.00 ATOM 38 CD1 LEU 7 -14.347 -1.877 -9.738 1.00 0.00 ATOM 39 CD2 LEU 7 -12.377 -3.249 -9.181 1.00 0.00 ATOM 40 O LEU 7 -9.683 0.129 -7.580 1.00 0.00 ATOM 41 C LEU 7 -10.781 0.155 -7.015 1.00 0.00 ATOM 42 N PRO 8 -11.271 1.228 -6.396 1.00 0.00 ATOM 43 CA PRO 8 -10.460 2.423 -6.250 1.00 0.00 ATOM 44 CB PRO 8 -11.378 3.409 -5.525 1.00 0.00 ATOM 45 CG PRO 8 -12.756 2.994 -5.921 1.00 0.00 ATOM 46 CD PRO 8 -12.742 1.492 -5.972 1.00 0.00 ATOM 47 O PRO 8 -8.092 2.462 -5.779 1.00 0.00 ATOM 48 C PRO 8 -9.208 2.075 -5.427 1.00 0.00 ATOM 49 N VAL 9 -9.391 1.300 -4.356 1.00 0.00 ATOM 50 CA VAL 9 -8.272 0.974 -3.481 1.00 0.00 ATOM 51 CB VAL 9 -8.741 0.223 -2.221 1.00 0.00 ATOM 52 CG1 VAL 9 -7.547 -0.268 -1.418 1.00 0.00 ATOM 53 CG2 VAL 9 -9.573 1.138 -1.334 1.00 0.00 ATOM 54 O VAL 9 -6.058 0.331 -4.148 1.00 0.00 ATOM 55 C VAL 9 -7.256 0.086 -4.200 1.00 0.00 ATOM 56 N GLN 10 -7.741 -0.938 -4.878 1.00 0.00 ATOM 57 CA GLN 10 -6.871 -1.812 -5.670 1.00 0.00 ATOM 58 CB GLN 10 -7.694 -2.894 -6.371 1.00 0.00 ATOM 59 CG GLN 10 -6.865 -3.872 -7.187 1.00 0.00 ATOM 60 CD GLN 10 -7.712 -4.941 -7.851 1.00 0.00 ATOM 61 OE1 GLN 10 -8.940 -4.910 -7.775 1.00 0.00 ATOM 62 NE2 GLN 10 -7.055 -5.893 -8.505 1.00 0.00 ATOM 63 O GLN 10 -4.906 -1.129 -6.824 1.00 0.00 ATOM 64 C GLN 10 -6.132 -1.028 -6.723 1.00 0.00 ATOM 65 N LYS 11 -6.872 -0.238 -7.496 1.00 0.00 ATOM 66 CA LYS 11 -6.269 0.559 -8.557 1.00 0.00 ATOM 67 CB LYS 11 -7.321 1.446 -9.224 1.00 0.00 ATOM 68 CG LYS 11 -8.345 0.683 -10.050 1.00 0.00 ATOM 69 CD LYS 11 -7.702 0.036 -11.266 1.00 0.00 ATOM 70 CE LYS 11 -8.733 -0.687 -12.116 1.00 0.00 ATOM 71 NZ LYS 11 -8.107 -1.386 -13.273 1.00 0.00 ATOM 72 O LYS 11 -4.071 1.498 -8.498 1.00 0.00 ATOM 73 C LYS 11 -5.182 1.438 -7.963 1.00 0.00 ATOM 74 N GLN 12 -5.471 2.077 -6.828 1.00 0.00 ATOM 75 CA GLN 12 -4.488 2.972 -6.211 1.00 0.00 ATOM 76 CB GLN 12 -5.060 3.599 -4.937 1.00 0.00 ATOM 77 CG GLN 12 -4.210 4.720 -4.363 1.00 0.00 ATOM 78 CD GLN 12 -3.025 4.206 -3.568 1.00 0.00 ATOM 79 OE1 GLN 12 -3.126 3.201 -2.866 1.00 0.00 ATOM 80 NE2 GLN 12 -1.896 4.897 -3.681 1.00 0.00 ATOM 81 O GLN 12 -2.085 2.682 -6.153 1.00 0.00 ATOM 82 C GLN 12 -3.200 2.227 -5.830 1.00 0.00 ATOM 83 N LEU 13 -3.362 1.088 -5.163 1.00 0.00 ATOM 84 CA LEU 13 -2.220 0.328 -4.664 1.00 0.00 ATOM 85 CB LEU 13 -2.693 -0.826 -3.776 1.00 0.00 ATOM 86 CG LEU 13 -3.310 -0.437 -2.431 1.00 0.00 ATOM 87 CD1 LEU 13 -3.894 -1.658 -1.734 1.00 0.00 ATOM 88 CD2 LEU 13 -2.262 0.176 -1.515 1.00 0.00 ATOM 89 O LEU 13 -0.158 -0.301 -5.685 1.00 0.00 ATOM 90 C LEU 13 -1.385 -0.274 -5.781 1.00 0.00 ATOM 91 N GLU 14 -2.047 -0.730 -6.843 1.00 0.00 ATOM 92 CA GLU 14 -1.337 -1.140 -8.050 1.00 0.00 ATOM 93 CB GLU 14 -2.312 -1.728 -9.072 1.00 0.00 ATOM 94 CG GLU 14 -2.874 -3.086 -8.684 1.00 0.00 ATOM 95 CD GLU 14 -3.926 -3.581 -9.656 1.00 0.00 ATOM 96 OE1 GLU 14 -4.269 -2.829 -10.593 1.00 0.00 ATOM 97 OE2 GLU 14 -4.408 -4.720 -9.481 1.00 0.00 ATOM 98 O GLU 14 0.484 -0.198 -9.242 1.00 0.00 ATOM 99 C GLU 14 -0.611 -0.001 -8.738 1.00 0.00 ATOM 100 N ALA 15 -1.224 1.180 -8.756 1.00 0.00 ATOM 101 CA ALA 15 -0.591 2.369 -9.350 1.00 0.00 ATOM 102 CB ALA 15 -1.546 3.553 -9.313 1.00 0.00 ATOM 103 O ALA 15 1.670 3.104 -9.215 1.00 0.00 ATOM 104 C ALA 15 0.671 2.753 -8.593 1.00 0.00 ATOM 105 N TYR 16 0.625 2.677 -7.261 1.00 0.00 ATOM 106 CA TYR 16 1.807 2.879 -6.413 1.00 0.00 ATOM 107 CB TYR 16 1.469 2.602 -4.947 1.00 0.00 ATOM 108 CG TYR 16 2.650 2.730 -4.010 1.00 0.00 ATOM 109 CD1 TYR 16 3.069 3.975 -3.562 1.00 0.00 ATOM 110 CD2 TYR 16 3.340 1.605 -3.580 1.00 0.00 ATOM 111 CE1 TYR 16 4.147 4.101 -2.707 1.00 0.00 ATOM 112 CE2 TYR 16 4.420 1.712 -2.724 1.00 0.00 ATOM 113 CZ TYR 16 4.822 2.975 -2.288 1.00 0.00 ATOM 114 OH TYR 16 5.894 3.098 -1.437 1.00 0.00 ATOM 115 O TYR 16 4.062 2.389 -7.059 1.00 0.00 ATOM 116 C TYR 16 2.946 1.953 -6.812 1.00 0.00 ATOM 117 N ASN 17 2.645 0.670 -6.873 1.00 0.00 ATOM 118 CA ASN 17 3.620 -0.339 -7.223 1.00 0.00 ATOM 119 CB ASN 17 2.988 -1.732 -7.184 1.00 0.00 ATOM 120 CG ASN 17 2.728 -2.214 -5.770 1.00 0.00 ATOM 121 ND2 ASN 17 1.837 -3.190 -5.634 1.00 0.00 ATOM 122 OD1 ASN 17 3.319 -1.714 -4.815 1.00 0.00 ATOM 123 O ASN 17 5.370 -0.262 -8.876 1.00 0.00 ATOM 124 C ASN 17 4.173 -0.104 -8.634 1.00 0.00 ATOM 125 N ALA 18 3.306 0.304 -9.554 1.00 0.00 ATOM 126 CA ALA 18 3.699 0.446 -10.943 1.00 0.00 ATOM 127 CB ALA 18 2.498 0.248 -11.856 1.00 0.00 ATOM 128 O ALA 18 4.682 2.056 -12.388 1.00 0.00 ATOM 129 C ALA 18 4.281 1.811 -11.258 1.00 0.00 ATOM 130 N ARG 19 4.326 2.694 -10.257 1.00 0.00 ATOM 131 CA ARG 19 4.844 4.063 -10.412 1.00 0.00 ATOM 132 CB ARG 19 6.298 4.037 -10.884 1.00 0.00 ATOM 133 CG ARG 19 7.244 3.315 -9.939 1.00 0.00 ATOM 134 CD ARG 19 7.401 4.071 -8.630 1.00 0.00 ATOM 135 NE ARG 19 8.401 3.459 -7.759 1.00 0.00 ATOM 136 CZ ARG 19 9.697 3.755 -7.786 1.00 0.00 ATOM 137 NH1 ARG 19 10.533 3.146 -6.957 1.00 0.00 ATOM 138 NH2 ARG 19 10.152 4.657 -8.643 1.00 0.00 ATOM 139 O ARG 19 4.612 5.645 -12.171 1.00 0.00 ATOM 140 C ARG 19 4.056 4.874 -11.421 1.00 0.00 ATOM 141 N ASP 20 2.747 4.659 -11.426 1.00 0.00 ATOM 142 CA ASP 20 1.820 5.326 -12.316 1.00 0.00 ATOM 143 CB ASP 20 0.701 4.372 -12.738 1.00 0.00 ATOM 144 CG ASP 20 -0.199 4.965 -13.804 1.00 0.00 ATOM 145 OD1 ASP 20 0.029 6.128 -14.194 1.00 0.00 ATOM 146 OD2 ASP 20 -1.133 4.265 -14.248 1.00 0.00 ATOM 147 O ASP 20 0.221 6.395 -10.872 1.00 0.00 ATOM 148 C ASP 20 1.277 6.494 -11.498 1.00 0.00 ATOM 149 N ILE 21 2.027 7.591 -11.492 1.00 0.00 ATOM 150 CA ILE 21 1.769 8.701 -10.575 1.00 0.00 ATOM 151 CB ILE 21 2.987 9.637 -10.467 1.00 0.00 ATOM 152 CG1 ILE 21 3.258 10.317 -11.810 1.00 0.00 ATOM 153 CG2 ILE 21 4.228 8.853 -10.064 1.00 0.00 ATOM 154 CD1 ILE 21 4.273 11.436 -11.734 1.00 0.00 ATOM 155 O ILE 21 0.072 10.245 -9.964 1.00 0.00 ATOM 156 C ILE 21 0.627 9.638 -10.883 1.00 0.00 ATOM 157 N ASP 22 0.271 9.764 -12.162 1.00 0.00 ATOM 158 CA ASP 22 -0.976 10.432 -12.519 1.00 0.00 ATOM 159 CB ASP 22 -1.149 10.467 -14.038 1.00 0.00 ATOM 160 CG ASP 22 -0.212 11.454 -14.708 1.00 0.00 ATOM 161 OD1 ASP 22 0.398 12.273 -13.991 1.00 0.00 ATOM 162 OD2 ASP 22 -0.089 11.406 -15.950 1.00 0.00 ATOM 163 O ASP 22 -3.055 10.354 -11.416 1.00 0.00 ATOM 164 C ASP 22 -2.168 9.712 -11.926 1.00 0.00 ATOM 165 N ALA 23 -2.164 8.384 -11.977 1.00 0.00 ATOM 166 CA ALA 23 -3.267 7.593 -11.427 1.00 0.00 ATOM 167 CB ALA 23 -3.099 6.127 -11.790 1.00 0.00 ATOM 168 O ALA 23 -4.371 7.902 -9.329 1.00 0.00 ATOM 169 C ALA 23 -3.295 7.723 -9.903 1.00 0.00 ATOM 170 N PHE 24 -2.119 7.661 -9.273 1.00 0.00 ATOM 171 CA PHE 24 -1.977 7.993 -7.859 1.00 0.00 ATOM 172 CB PHE 24 -0.499 8.031 -7.463 1.00 0.00 ATOM 173 CG PHE 24 -0.266 8.413 -6.029 1.00 0.00 ATOM 174 CD1 PHE 24 -0.398 7.477 -5.018 1.00 0.00 ATOM 175 CD2 PHE 24 0.088 9.707 -5.692 1.00 0.00 ATOM 176 CE1 PHE 24 -0.182 7.828 -3.700 1.00 0.00 ATOM 177 CE2 PHE 24 0.304 10.059 -4.373 1.00 0.00 ATOM 178 CZ PHE 24 0.170 9.126 -3.379 1.00 0.00 ATOM 179 O PHE 24 -3.370 9.448 -6.600 1.00 0.00 ATOM 180 C PHE 24 -2.583 9.359 -7.529 1.00 0.00 ATOM 181 N MET 25 -2.230 10.399 -8.291 1.00 0.00 ATOM 182 CA MET 25 -2.854 11.728 -8.190 1.00 0.00 ATOM 183 CB MET 25 -2.358 12.638 -9.316 1.00 0.00 ATOM 184 CG MET 25 -0.899 13.042 -9.189 1.00 0.00 ATOM 185 SD MET 25 -0.307 13.970 -10.619 1.00 0.00 ATOM 186 CE MET 25 -1.310 15.449 -10.500 1.00 0.00 ATOM 187 O MET 25 -5.056 12.383 -7.498 1.00 0.00 ATOM 188 C MET 25 -4.374 11.726 -8.283 1.00 0.00 ATOM 189 N ALA 26 -4.897 10.996 -9.263 1.00 0.00 ATOM 190 CA ALA 26 -6.327 10.976 -9.523 1.00 0.00 ATOM 191 CB ALA 26 -6.614 10.297 -10.854 1.00 0.00 ATOM 192 O ALA 26 -8.211 10.500 -8.091 1.00 0.00 ATOM 193 C ALA 26 -7.062 10.208 -8.416 1.00 0.00 ATOM 194 N TRP 27 -6.384 9.244 -7.819 1.00 0.00 ATOM 195 CA TRP 27 -6.997 8.427 -6.763 1.00 0.00 ATOM 196 CB TRP 27 -6.144 7.190 -6.480 1.00 0.00 ATOM 197 CG TRP 27 -6.170 6.178 -7.584 1.00 0.00 ATOM 198 CD1 TRP 27 -5.159 5.885 -8.452 1.00 0.00 ATOM 199 CD2 TRP 27 -7.264 5.324 -7.939 1.00 0.00 ATOM 200 CE2 TRP 27 -6.843 4.539 -9.032 1.00 0.00 ATOM 201 CE3 TRP 27 -8.557 5.144 -7.441 1.00 0.00 ATOM 202 NE1 TRP 27 -5.552 4.901 -9.326 1.00 0.00 ATOM 203 CZ2 TRP 27 -7.669 3.591 -9.634 1.00 0.00 ATOM 204 CZ3 TRP 27 -9.374 4.203 -8.041 1.00 0.00 ATOM 205 CH2 TRP 27 -8.930 3.438 -9.125 1.00 0.00 ATOM 206 O TRP 27 -8.072 8.755 -4.641 1.00 0.00 ATOM 207 C TRP 27 -7.181 9.132 -5.407 1.00 0.00 ATOM 208 N TRP 28 -6.346 10.132 -5.107 1.00 0.00 ATOM 209 CA TRP 28 -6.304 10.692 -3.753 1.00 0.00 ATOM 210 CB TRP 28 -4.870 11.059 -3.368 1.00 0.00 ATOM 211 CG TRP 28 -3.976 9.871 -3.184 1.00 0.00 ATOM 212 CD1 TRP 28 -3.157 9.308 -4.120 1.00 0.00 ATOM 213 CD2 TRP 28 -3.810 9.099 -1.988 1.00 0.00 ATOM 214 CE2 TRP 28 -2.875 8.083 -2.274 1.00 0.00 ATOM 215 CE3 TRP 28 -4.359 9.167 -0.704 1.00 0.00 ATOM 216 NE1 TRP 28 -2.491 8.233 -3.583 1.00 0.00 ATOM 217 CZ2 TRP 28 -2.478 7.145 -1.323 1.00 0.00 ATOM 218 CZ3 TRP 28 -3.963 8.232 0.235 1.00 0.00 ATOM 219 CH2 TRP 28 -3.033 7.235 -0.075 1.00 0.00 ATOM 220 O TRP 28 -6.976 12.885 -4.391 1.00 0.00 ATOM 221 C TRP 28 -7.143 11.949 -3.612 1.00 0.00 ATOM 222 N ALA 29 -8.033 11.974 -2.613 1.00 0.00 ATOM 223 CA ALA 29 -8.889 13.164 -2.359 1.00 0.00 ATOM 224 CB ALA 29 -9.931 12.849 -1.297 1.00 0.00 ATOM 225 O ALA 29 -7.022 14.248 -1.305 1.00 0.00 ATOM 226 C ALA 29 -8.111 14.381 -1.867 1.00 0.00 ATOM 227 N ASP 30 -8.665 15.570 -2.076 1.00 0.00 ATOM 228 CA ASP 30 -8.013 16.820 -1.675 1.00 0.00 ATOM 229 CB ASP 30 -8.881 18.022 -2.051 1.00 0.00 ATOM 230 CG ASP 30 -8.887 18.292 -3.543 1.00 0.00 ATOM 231 OD1 ASP 30 -8.046 17.705 -4.256 1.00 0.00 ATOM 232 OD2 ASP 30 -9.733 19.090 -4.000 1.00 0.00 ATOM 233 O ASP 30 -6.781 17.380 0.278 1.00 0.00 ATOM 234 C ASP 30 -7.780 16.860 -0.175 1.00 0.00 ATOM 235 N ASP 31 -8.699 16.279 0.588 1.00 0.00 ATOM 236 CA ASP 31 -8.626 16.315 2.041 1.00 0.00 ATOM 237 CB ASP 31 -10.001 16.620 2.639 1.00 0.00 ATOM 238 CG ASP 31 -9.934 16.942 4.119 1.00 0.00 ATOM 239 OD1 ASP 31 -8.811 17.099 4.642 1.00 0.00 ATOM 240 OD2 ASP 31 -11.005 17.038 4.755 1.00 0.00 ATOM 241 O ASP 31 -8.406 14.713 3.830 1.00 0.00 ATOM 242 C ASP 31 -8.155 14.995 2.645 1.00 0.00 ATOM 246 N TYR 34 -3.420 10.855 5.584 1.00 0.00 ATOM 247 CA TYR 34 -2.575 9.688 5.358 1.00 0.00 ATOM 248 CB TYR 34 -1.652 9.919 4.159 1.00 0.00 ATOM 249 CG TYR 34 -0.782 8.730 3.818 1.00 0.00 ATOM 250 CD1 TYR 34 -1.313 7.625 3.164 1.00 0.00 ATOM 251 CD2 TYR 34 0.566 8.718 4.150 1.00 0.00 ATOM 252 CE1 TYR 34 -0.525 6.534 2.848 1.00 0.00 ATOM 253 CE2 TYR 34 1.369 7.636 3.842 1.00 0.00 ATOM 254 CZ TYR 34 0.810 6.539 3.185 1.00 0.00 ATOM 255 OH TYR 34 1.598 5.455 2.872 1.00 0.00 ATOM 256 O TYR 34 -0.926 10.305 6.967 1.00 0.00 ATOM 257 C TYR 34 -1.739 9.454 6.603 1.00 0.00 ATOM 261 N PHE 37 0.494 4.382 11.170 1.00 0.00 ATOM 262 CA PHE 37 0.096 4.541 12.578 1.00 0.00 ATOM 263 CB PHE 37 -0.942 3.487 12.964 1.00 0.00 ATOM 264 CG PHE 37 -1.442 3.615 14.376 1.00 0.00 ATOM 265 CD1 PHE 37 -2.386 4.572 14.707 1.00 0.00 ATOM 266 CD2 PHE 37 -0.967 2.780 15.371 1.00 0.00 ATOM 267 CE1 PHE 37 -2.844 4.690 16.006 1.00 0.00 ATOM 268 CE2 PHE 37 -1.425 2.898 16.670 1.00 0.00 ATOM 269 CZ PHE 37 -2.359 3.848 16.988 1.00 0.00 ATOM 270 O PHE 37 2.115 3.538 13.449 1.00 0.00 ATOM 271 C PHE 37 1.227 4.402 13.568 1.00 0.00 ATOM 272 N PRO 38 1.227 5.352 14.500 1.00 0.00 ATOM 273 CA PRO 38 2.321 5.552 15.430 1.00 0.00 ATOM 274 CB PRO 38 2.776 4.133 15.779 1.00 0.00 ATOM 275 CG PRO 38 2.519 3.344 14.538 1.00 0.00 ATOM 276 CD PRO 38 1.253 3.896 13.947 1.00 0.00 ATOM 277 O PRO 38 4.387 6.701 15.589 1.00 0.00 ATOM 278 C PRO 38 3.479 6.347 14.856 1.00 0.00 ATOM 279 N ALA 39 3.469 6.642 13.554 1.00 0.00 ATOM 280 CA ALA 39 4.696 7.144 12.914 1.00 0.00 ATOM 281 CB ALA 39 5.235 6.121 11.926 1.00 0.00 ATOM 282 O ALA 39 5.470 9.264 12.224 1.00 0.00 ATOM 283 C ALA 39 4.590 8.430 12.123 1.00 0.00 ATOM 284 N THR 40 3.536 8.587 11.320 1.00 0.00 ATOM 285 CA THR 40 3.390 9.793 10.499 1.00 0.00 ATOM 286 CB THR 40 4.129 9.654 9.154 1.00 0.00 ATOM 287 CG2 THR 40 3.514 8.539 8.322 1.00 0.00 ATOM 288 OG1 THR 40 4.034 10.883 8.425 1.00 0.00 ATOM 289 O THR 40 1.096 9.252 9.950 1.00 0.00 ATOM 290 C THR 40 1.935 10.132 10.154 1.00 0.00 ATOM 291 N LEU 42 1.650 11.425 10.117 1.00 0.00 ATOM 292 CA LEU 42 0.401 11.900 9.579 1.00 0.00 ATOM 293 CB LEU 42 -0.520 12.379 10.705 1.00 0.00 ATOM 294 CG LEU 42 -1.863 12.974 10.275 1.00 0.00 ATOM 295 CD1 LEU 42 -2.747 11.906 9.646 1.00 0.00 ATOM 296 CD2 LEU 42 -2.599 13.556 11.471 1.00 0.00 ATOM 297 O LEU 42 1.256 14.052 8.944 1.00 0.00 ATOM 298 C LEU 42 0.604 13.066 8.619 1.00 0.00 ATOM 299 N ALA 43 0.027 12.933 7.437 1.00 0.00 ATOM 300 CA ALA 43 0.088 13.970 6.431 1.00 0.00 ATOM 301 CB ALA 43 0.893 13.498 5.230 1.00 0.00 ATOM 302 O ALA 43 -2.175 13.376 5.831 1.00 0.00 ATOM 303 C ALA 43 -1.344 14.284 6.006 1.00 0.00 ATOM 304 N GLY 44 -1.632 15.570 5.845 1.00 0.00 ATOM 305 CA GLY 44 -2.938 16.012 5.350 1.00 0.00 ATOM 306 O GLY 44 -2.012 17.469 3.723 1.00 0.00 ATOM 307 C GLY 44 -2.856 16.620 3.976 1.00 0.00 ATOM 308 N ASN 45 -3.749 16.200 3.093 1.00 0.00 ATOM 309 CA ASN 45 -3.807 16.747 1.750 1.00 0.00 ATOM 310 CB ASN 45 -2.855 17.937 1.615 1.00 0.00 ATOM 311 CG ASN 45 -3.332 19.154 2.380 1.00 0.00 ATOM 312 ND2 ASN 45 -2.405 20.050 2.703 1.00 0.00 ATOM 313 OD1 ASN 45 -4.518 19.287 2.678 1.00 0.00 ATOM 314 O ASN 45 -2.355 15.081 0.832 1.00 0.00 ATOM 315 C ASN 45 -3.412 15.705 0.728 1.00 0.00 ATOM 316 N ALA 46 -4.274 15.504 -0.259 1.00 0.00 ATOM 317 CA ALA 46 -3.999 14.590 -1.354 1.00 0.00 ATOM 318 CB ALA 46 -5.246 14.385 -2.199 1.00 0.00 ATOM 319 O ALA 46 -2.163 14.147 -2.792 1.00 0.00 ATOM 320 C ALA 46 -2.915 15.006 -2.338 1.00 0.00 ATOM 321 N ALA 47 -2.856 16.297 -2.696 1.00 0.00 ATOM 322 CA ALA 47 -1.776 16.855 -3.531 1.00 0.00 ATOM 323 CB ALA 47 -2.027 18.330 -3.806 1.00 0.00 ATOM 324 O ALA 47 0.543 16.388 -3.516 1.00 0.00 ATOM 325 C ALA 47 -0.419 16.735 -2.863 1.00 0.00 ATOM 326 N GLU 48 -0.333 17.119 -1.587 1.00 0.00 ATOM 327 CA GLU 48 0.911 16.981 -0.851 1.00 0.00 ATOM 328 CB GLU 48 0.730 17.443 0.597 1.00 0.00 ATOM 329 CG GLU 48 1.998 17.376 1.433 1.00 0.00 ATOM 330 CD GLU 48 1.789 17.873 2.850 1.00 0.00 ATOM 331 OE1 GLU 48 0.654 18.281 3.174 1.00 0.00 ATOM 332 OE2 GLU 48 2.759 17.853 3.636 1.00 0.00 ATOM 333 O GLU 48 2.569 15.230 -1.105 1.00 0.00 ATOM 334 C GLU 48 1.393 15.520 -0.824 1.00 0.00 ATOM 335 N ILE 49 0.486 14.601 -0.501 1.00 0.00 ATOM 336 CA ILE 49 0.845 13.188 -0.409 1.00 0.00 ATOM 337 CB ILE 49 -0.342 12.333 0.075 1.00 0.00 ATOM 338 CG1 ILE 49 -0.683 12.668 1.528 1.00 0.00 ATOM 339 CG2 ILE 49 -0.004 10.854 -0.013 1.00 0.00 ATOM 340 CD1 ILE 49 -1.995 12.079 1.999 1.00 0.00 ATOM 341 O ILE 49 2.327 11.980 -1.896 1.00 0.00 ATOM 342 C ILE 49 1.284 12.646 -1.772 1.00 0.00 ATOM 343 N ARG 50 0.482 12.951 -2.786 1.00 0.00 ATOM 344 CA ARG 50 0.776 12.551 -4.143 1.00 0.00 ATOM 345 CB ARG 50 -0.271 13.113 -5.107 1.00 0.00 ATOM 346 CG ARG 50 -1.638 12.458 -4.991 1.00 0.00 ATOM 347 CD ARG 50 -2.626 13.063 -5.974 1.00 0.00 ATOM 348 NE ARG 50 -3.069 14.392 -5.556 1.00 0.00 ATOM 349 CZ ARG 50 -3.752 15.229 -6.330 1.00 0.00 ATOM 350 NH1 ARG 50 -4.113 16.418 -5.865 1.00 0.00 ATOM 351 NH2 ARG 50 -4.072 14.876 -7.567 1.00 0.00 ATOM 352 O ARG 50 2.898 12.272 -5.186 1.00 0.00 ATOM 353 C ARG 50 2.149 13.050 -4.611 1.00 0.00 ATOM 354 N VAL 51 2.500 14.317 -4.377 1.00 0.00 ATOM 355 CA VAL 51 3.810 14.777 -4.832 1.00 0.00 ATOM 356 CB VAL 51 3.924 16.311 -4.769 1.00 0.00 ATOM 357 CG1 VAL 51 5.347 16.753 -5.070 1.00 0.00 ATOM 358 CG2 VAL 51 2.995 16.958 -5.785 1.00 0.00 ATOM 359 O VAL 51 6.048 13.944 -4.521 1.00 0.00 ATOM 360 C VAL 51 4.979 14.218 -3.992 1.00 0.00 ATOM 361 N ARG 52 4.738 13.960 -2.713 1.00 0.00 ATOM 362 CA ARG 52 5.724 13.282 -1.881 1.00 0.00 ATOM 363 CB ARG 52 5.203 13.130 -0.451 1.00 0.00 ATOM 364 CG ARG 52 5.131 14.436 0.325 1.00 0.00 ATOM 365 CD ARG 52 4.564 14.220 1.719 1.00 0.00 ATOM 366 NE ARG 52 4.442 15.472 2.459 1.00 0.00 ATOM 367 CZ ARG 52 3.923 15.572 3.679 1.00 0.00 ATOM 368 NH1 ARG 52 3.854 16.753 4.277 1.00 0.00 ATOM 369 NH2 ARG 52 3.476 14.487 4.299 1.00 0.00 ATOM 370 O ARG 52 7.230 11.510 -2.440 1.00 0.00 ATOM 371 C ARG 52 6.053 11.893 -2.395 1.00 0.00 ATOM 372 N HIS 53 5.017 11.132 -2.762 1.00 0.00 ATOM 373 CA HIS 53 5.227 9.807 -3.355 1.00 0.00 ATOM 374 CB HIS 53 3.889 9.092 -3.559 1.00 0.00 ATOM 375 CG HIS 53 3.244 8.643 -2.286 1.00 0.00 ATOM 376 CD2 HIS 53 2.034 8.993 -1.556 1.00 0.00 ATOM 377 ND1 HIS 53 3.789 7.669 -1.479 1.00 0.00 ATOM 378 CE1 HIS 53 2.987 7.482 -0.415 1.00 0.00 ATOM 379 NE2 HIS 53 1.932 8.274 -0.455 1.00 0.00 ATOM 380 O HIS 53 6.895 9.194 -4.979 1.00 0.00 ATOM 381 C HIS 53 5.924 9.908 -4.720 1.00 0.00 ATOM 382 N ILE 54 5.440 10.813 -5.566 1.00 0.00 ATOM 383 CA ILE 54 6.020 11.029 -6.905 1.00 0.00 ATOM 384 CB ILE 54 5.369 12.231 -7.617 1.00 0.00 ATOM 385 CG1 ILE 54 3.912 11.918 -7.965 1.00 0.00 ATOM 386 CG2 ILE 54 6.114 12.557 -8.900 1.00 0.00 ATOM 387 CD1 ILE 54 3.121 13.124 -8.419 1.00 0.00 ATOM 388 O ILE 54 8.302 10.773 -7.570 1.00 0.00 ATOM 389 C ILE 54 7.515 11.300 -6.801 1.00 0.00 ATOM 390 N GLU 55 7.900 12.088 -5.800 1.00 0.00 ATOM 391 CA GLU 55 9.297 12.490 -5.635 1.00 0.00 ATOM 392 CB GLU 55 9.403 13.681 -4.682 1.00 0.00 ATOM 393 CG GLU 55 8.791 14.964 -5.221 1.00 0.00 ATOM 394 CD GLU 55 8.852 16.103 -4.221 1.00 0.00 ATOM 395 OE1 GLU 55 9.351 15.882 -3.098 1.00 0.00 ATOM 396 OE2 GLU 55 8.400 17.216 -4.562 1.00 0.00 ATOM 397 O GLU 55 11.435 11.652 -5.076 1.00 0.00 ATOM 398 C GLU 55 10.243 11.446 -5.074 1.00 0.00 ATOM 399 N ARG 56 9.698 10.327 -4.619 1.00 0.00 ATOM 400 CA ARG 56 10.480 9.190 -4.172 1.00 0.00 ATOM 401 CB ARG 56 9.674 8.336 -3.192 1.00 0.00 ATOM 402 CG ARG 56 9.409 9.010 -1.856 1.00 0.00 ATOM 403 CD ARG 56 8.557 8.130 -0.953 1.00 0.00 ATOM 404 NE ARG 56 8.259 8.780 0.321 1.00 0.00 ATOM 405 CZ ARG 56 7.380 8.322 1.206 1.00 0.00 ATOM 406 NH1 ARG 56 7.174 8.978 2.339 1.00 0.00 ATOM 407 NH2 ARG 56 6.708 7.205 0.955 1.00 0.00 ATOM 408 O ARG 56 11.800 7.445 -5.138 1.00 0.00 ATOM 409 C ARG 56 10.914 8.271 -5.315 1.00 0.00 ATOM 410 N PHE 57 10.305 8.436 -6.482 1.00 0.00 ATOM 411 CA PHE 57 10.618 7.592 -7.609 1.00 0.00 ATOM 412 CB PHE 57 9.880 8.074 -8.861 1.00 0.00 ATOM 413 CG PHE 57 10.134 7.229 -10.077 1.00 0.00 ATOM 414 CD1 PHE 57 9.473 6.026 -10.251 1.00 0.00 ATOM 415 CD2 PHE 57 11.034 7.637 -11.046 1.00 0.00 ATOM 416 CE1 PHE 57 9.706 5.249 -11.370 1.00 0.00 ATOM 417 CE2 PHE 57 11.267 6.861 -12.163 1.00 0.00 ATOM 418 CZ PHE 57 10.608 5.671 -12.329 1.00 0.00 ATOM 419 O PHE 57 12.737 8.625 -8.097 1.00 0.00 ATOM 420 C PHE 57 12.119 7.577 -7.941 1.00 0.00 ATOM 421 N LYS 58 12.687 6.382 -8.060 1.00 0.00 ATOM 422 CA LYS 58 14.101 6.223 -8.368 1.00 0.00 ATOM 423 CB LYS 58 14.601 7.398 -9.211 1.00 0.00 ATOM 424 CG LYS 58 13.969 7.485 -10.590 1.00 0.00 ATOM 425 CD LYS 58 14.519 8.665 -11.376 1.00 0.00 ATOM 426 CE LYS 58 13.871 8.767 -12.745 1.00 0.00 ATOM 427 NZ LYS 58 14.424 9.899 -13.539 1.00 0.00 ATOM 428 O LYS 58 16.153 5.957 -7.169 1.00 0.00 ATOM 429 C LYS 58 14.944 6.161 -7.099 1.00 0.00 ATOM 430 N GLU 59 14.317 6.348 -5.940 1.00 0.00 ATOM 431 CA GLU 59 15.007 6.193 -4.653 1.00 0.00 ATOM 432 CB GLU 59 14.921 7.487 -3.841 1.00 0.00 ATOM 433 CG GLU 59 15.666 8.658 -4.459 1.00 0.00 ATOM 434 CD GLU 59 15.459 9.950 -3.694 1.00 0.00 ATOM 435 OE1 GLU 59 14.677 9.944 -2.720 1.00 0.00 ATOM 436 OE2 GLU 59 16.077 10.969 -4.068 1.00 0.00 ATOM 437 O GLU 59 15.156 4.391 -3.103 1.00 0.00 ATOM 438 C GLU 59 14.427 5.100 -3.804 1.00 0.00 ATOM 439 N PRO 60 13.101 5.060 -3.766 1.00 0.00 ATOM 440 CA PRO 60 12.407 3.942 -3.136 1.00 0.00 ATOM 441 CB PRO 60 11.863 4.531 -1.834 1.00 0.00 ATOM 442 CG PRO 60 11.688 5.985 -2.124 1.00 0.00 ATOM 443 CD PRO 60 12.807 6.359 -3.057 1.00 0.00 ATOM 444 O PRO 60 10.418 4.142 -4.463 1.00 0.00 ATOM 445 C PRO 60 11.275 3.395 -3.999 1.00 0.00 ATOM 446 N ASP 61 11.341 2.086 -4.242 1.00 0.00 ATOM 447 CA ASP 61 10.290 1.375 -4.939 1.00 0.00 ATOM 448 CB ASP 61 10.882 0.280 -5.827 1.00 0.00 ATOM 449 CG ASP 61 9.903 -0.217 -6.873 1.00 0.00 ATOM 450 OD1 ASP 61 8.806 0.371 -6.985 1.00 0.00 ATOM 451 OD2 ASP 61 10.232 -1.191 -7.580 1.00 0.00 ATOM 452 O ASP 61 9.727 0.504 -2.776 1.00 0.00 ATOM 453 C ASP 61 9.353 0.738 -3.928 1.00 0.00 ATOM 454 N LEU 62 8.128 0.482 -4.370 1.00 0.00 ATOM 455 CA LEU 62 7.122 -0.148 -3.559 1.00 0.00 ATOM 456 CB LEU 62 5.939 0.799 -3.343 1.00 0.00 ATOM 457 CG LEU 62 4.776 0.250 -2.515 1.00 0.00 ATOM 458 CD1 LEU 62 5.191 0.058 -1.064 1.00 0.00 ATOM 459 CD2 LEU 62 3.595 1.208 -2.548 1.00 0.00 ATOM 460 O LEU 62 6.480 -1.458 -5.453 1.00 0.00 ATOM 461 C LEU 62 6.622 -1.407 -4.244 1.00 0.00 ATOM 462 N TYR 63 6.372 -2.433 -3.444 1.00 0.00 ATOM 463 CA TYR 63 5.609 -3.591 -3.881 1.00 0.00 ATOM 464 CB TYR 63 6.503 -4.832 -3.938 1.00 0.00 ATOM 465 CG TYR 63 7.628 -4.731 -4.943 1.00 0.00 ATOM 466 CD1 TYR 63 8.862 -4.207 -4.581 1.00 0.00 ATOM 467 CD2 TYR 63 7.452 -5.162 -6.251 1.00 0.00 ATOM 468 CE1 TYR 63 9.895 -4.111 -5.492 1.00 0.00 ATOM 469 CE2 TYR 63 8.474 -5.074 -7.178 1.00 0.00 ATOM 470 CZ TYR 63 9.702 -4.543 -6.786 1.00 0.00 ATOM 471 OH TYR 63 10.729 -4.449 -7.698 1.00 0.00 ATOM 472 O TYR 63 4.681 -3.604 -1.696 1.00 0.00 ATOM 473 C TYR 63 4.498 -3.807 -2.893 1.00 0.00 ATOM 474 N GLY 64 3.331 -4.171 -3.418 1.00 0.00 ATOM 475 CA GLY 64 2.131 -4.406 -2.613 1.00 0.00 ATOM 476 O GLY 64 1.137 -5.750 -4.312 1.00 0.00 ATOM 477 C GLY 64 1.459 -5.657 -3.126 1.00 0.00 ATOM 478 N GLU 65 1.282 -6.629 -2.237 1.00 0.00 ATOM 479 CA GLU 65 0.490 -7.819 -2.517 1.00 0.00 ATOM 480 CB GLU 65 1.325 -9.083 -2.296 1.00 0.00 ATOM 481 CG GLU 65 0.594 -10.374 -2.627 1.00 0.00 ATOM 482 CD GLU 65 1.452 -11.603 -2.400 1.00 0.00 ATOM 483 OE1 GLU 65 2.593 -11.450 -1.915 1.00 0.00 ATOM 484 OE2 GLU 65 0.983 -12.721 -2.706 1.00 0.00 ATOM 485 O GLU 65 -0.556 -7.789 -0.342 1.00 0.00 ATOM 486 C GLU 65 -0.725 -7.831 -1.564 1.00 0.00 ATOM 487 N LEU 66 -1.939 -7.826 -2.112 1.00 0.00 ATOM 488 CA LEU 66 -3.164 -7.793 -1.294 1.00 0.00 ATOM 489 CB LEU 66 -4.225 -6.912 -1.955 1.00 0.00 ATOM 490 CG LEU 66 -3.853 -5.444 -2.168 1.00 0.00 ATOM 491 CD1 LEU 66 -4.969 -4.704 -2.889 1.00 0.00 ATOM 492 CD2 LEU 66 -3.607 -4.752 -0.836 1.00 0.00 ATOM 493 O LEU 66 -4.076 -9.796 -2.146 1.00 0.00 ATOM 494 C LEU 66 -3.700 -9.194 -1.153 1.00 0.00 ATOM 495 N LEU 67 -3.725 -9.718 0.067 1.00 0.00 ATOM 496 CA LEU 67 -4.145 -11.094 0.306 1.00 0.00 ATOM 497 CB LEU 67 -3.521 -11.627 1.598 1.00 0.00 ATOM 498 CG LEU 67 -1.994 -11.716 1.627 1.00 0.00 ATOM 499 CD1 LEU 67 -1.506 -12.136 3.006 1.00 0.00 ATOM 500 CD2 LEU 67 -1.497 -12.738 0.615 1.00 0.00 ATOM 501 O LEU 67 -6.276 -12.139 0.007 1.00 0.00 ATOM 502 C LEU 67 -5.657 -11.170 0.434 1.00 0.00 ATOM 503 N THR 68 -6.227 -10.141 1.050 1.00 0.00 ATOM 504 CA THR 68 -7.655 -10.031 1.328 1.00 0.00 ATOM 505 CB THR 68 -8.022 -10.697 2.667 1.00 0.00 ATOM 506 CG2 THR 68 -7.560 -12.147 2.686 1.00 0.00 ATOM 507 OG1 THR 68 -7.389 -9.995 3.744 1.00 0.00 ATOM 508 O THR 68 -7.262 -7.692 1.851 1.00 0.00 ATOM 509 C THR 68 -8.036 -8.549 1.396 1.00 0.00 ATOM 510 N ARG 69 -9.241 -8.265 0.932 1.00 0.00 ATOM 511 CA ARG 69 -9.755 -6.908 0.813 1.00 0.00 ATOM 512 CB ARG 69 -9.374 -6.308 -0.540 1.00 0.00 ATOM 513 CG ARG 69 -7.879 -6.127 -0.741 1.00 0.00 ATOM 514 CD ARG 69 -7.573 -5.518 -2.100 1.00 0.00 ATOM 515 NE ARG 69 -7.968 -6.400 -3.196 1.00 0.00 ATOM 516 CZ ARG 69 -7.957 -6.050 -4.478 1.00 0.00 ATOM 517 NH1 ARG 69 -8.333 -6.917 -5.407 1.00 0.00 ATOM 518 NH2 ARG 69 -7.570 -4.830 -4.829 1.00 0.00 ATOM 519 O ARG 69 -11.948 -7.623 0.149 1.00 0.00 ATOM 520 C ARG 69 -11.280 -6.956 0.941 1.00 0.00 ATOM 521 N VAL 70 -11.820 -6.281 1.954 1.00 0.00 ATOM 522 CA VAL 70 -13.267 -6.180 2.135 1.00 0.00 ATOM 523 CB VAL 70 -13.746 -7.008 3.342 1.00 0.00 ATOM 524 CG1 VAL 70 -13.433 -8.483 3.134 1.00 0.00 ATOM 525 CG2 VAL 70 -13.050 -6.545 4.613 1.00 0.00 ATOM 526 O VAL 70 -12.951 -3.873 2.637 1.00 0.00 ATOM 527 C VAL 70 -13.741 -4.767 2.372 1.00 0.00 ATOM 528 N ILE 71 -15.039 -4.560 2.279 1.00 0.00 ATOM 529 CA ILE 71 -15.591 -3.217 2.383 1.00 0.00 ATOM 530 CB ILE 71 -16.065 -2.695 1.014 1.00 0.00 ATOM 531 CG1 ILE 71 -17.151 -3.608 0.441 1.00 0.00 ATOM 532 CG2 ILE 71 -14.906 -2.650 0.030 1.00 0.00 ATOM 533 CD1 ILE 71 -17.806 -3.067 -0.811 1.00 0.00 ATOM 534 O ILE 71 -17.470 -4.185 3.457 1.00 0.00 ATOM 535 C ILE 71 -16.771 -3.201 3.318 1.00 0.00 ATOM 536 N VAL 72 -16.954 -2.063 3.963 1.00 0.00 ATOM 537 CA VAL 72 -18.170 -1.776 4.687 1.00 0.00 ATOM 538 CB VAL 72 -17.983 -1.972 6.204 1.00 0.00 ATOM 539 CG1 VAL 72 -19.281 -1.684 6.943 1.00 0.00 ATOM 540 CG2 VAL 72 -17.562 -3.401 6.510 1.00 0.00 ATOM 541 O VAL 72 -18.035 0.617 5.008 1.00 0.00 ATOM 542 C VAL 72 -18.560 -0.331 4.418 1.00 0.00 ATOM 543 N GLY 73 -19.456 -0.207 3.441 1.00 0.00 ATOM 544 CA GLY 73 -19.886 1.073 2.898 1.00 0.00 ATOM 545 O GLY 73 -18.163 1.288 1.209 1.00 0.00 ATOM 546 C GLY 73 -18.742 1.789 2.196 1.00 0.00 ATOM 547 N ASN 74 -18.387 2.963 2.723 1.00 0.00 ATOM 548 CA ASN 74 -17.265 3.728 2.213 1.00 0.00 ATOM 549 CB ASN 74 -17.414 5.206 2.584 1.00 0.00 ATOM 550 CG ASN 74 -18.522 5.892 1.809 1.00 0.00 ATOM 551 ND2 ASN 74 -19.017 7.001 2.345 1.00 0.00 ATOM 552 OD1 ASN 74 -18.926 5.429 0.742 1.00 0.00 ATOM 553 O ASN 74 -14.870 3.679 2.281 1.00 0.00 ATOM 554 C ASN 74 -15.915 3.253 2.773 1.00 0.00 ATOM 555 N VAL 75 -15.913 2.385 3.785 1.00 0.00 ATOM 556 CA VAL 75 -14.646 1.886 4.327 1.00 0.00 ATOM 557 CB VAL 75 -14.771 1.536 5.821 1.00 0.00 ATOM 558 CG1 VAL 75 -13.475 0.925 6.335 1.00 0.00 ATOM 559 CG2 VAL 75 -15.071 2.784 6.637 1.00 0.00 ATOM 560 O VAL 75 -14.958 -0.251 3.289 1.00 0.00 ATOM 561 C VAL 75 -14.163 0.622 3.615 1.00 0.00 ATOM 562 N VAL 76 -12.855 0.551 3.363 1.00 0.00 ATOM 563 CA VAL 76 -12.221 -0.599 2.725 1.00 0.00 ATOM 564 CB VAL 76 -11.724 -0.255 1.309 1.00 0.00 ATOM 565 CG1 VAL 76 -11.036 -1.456 0.679 1.00 0.00 ATOM 566 CG2 VAL 76 -12.887 0.155 0.420 1.00 0.00 ATOM 567 O VAL 76 -10.205 -0.162 3.961 1.00 0.00 ATOM 568 C VAL 76 -11.042 -1.005 3.596 1.00 0.00 ATOM 569 N ILE 77 -10.984 -2.285 3.958 1.00 0.00 ATOM 570 CA ILE 77 -9.873 -2.783 4.754 1.00 0.00 ATOM 571 CB ILE 77 -10.365 -3.496 6.028 1.00 0.00 ATOM 572 CG1 ILE 77 -11.106 -2.513 6.936 1.00 0.00 ATOM 573 CG2 ILE 77 -9.191 -4.076 6.802 1.00 0.00 ATOM 574 CD1 ILE 77 -11.820 -3.171 8.095 1.00 0.00 ATOM 575 O ILE 77 -9.675 -4.483 3.106 1.00 0.00 ATOM 576 C ILE 77 -9.088 -3.764 3.910 1.00 0.00 ATOM 577 N ASP 78 -7.766 -3.780 4.106 1.00 0.00 ATOM 578 CA ASP 78 -6.869 -4.653 3.357 1.00 0.00 ATOM 579 CB ASP 78 -6.023 -3.838 2.377 1.00 0.00 ATOM 580 CG ASP 78 -6.857 -3.185 1.292 1.00 0.00 ATOM 581 OD1 ASP 78 -8.056 -3.517 1.185 1.00 0.00 ATOM 582 OD2 ASP 78 -6.311 -2.343 0.549 1.00 0.00 ATOM 583 O ASP 78 -5.428 -4.853 5.244 1.00 0.00 ATOM 584 C ASP 78 -5.909 -5.413 4.270 1.00 0.00 ATOM 585 N HIS 79 -5.633 -6.675 3.940 1.00 0.00 ATOM 586 CA HIS 79 -4.528 -7.420 4.530 1.00 0.00 ATOM 587 CB HIS 79 -5.010 -8.781 5.037 1.00 0.00 ATOM 588 CG HIS 79 -5.958 -8.694 6.193 1.00 0.00 ATOM 589 CD2 HIS 79 -6.305 -7.678 7.176 1.00 0.00 ATOM 590 ND1 HIS 79 -6.781 -9.735 6.559 1.00 0.00 ATOM 591 CE1 HIS 79 -7.512 -9.361 7.624 1.00 0.00 ATOM 592 NE2 HIS 79 -7.231 -8.129 8.001 1.00 0.00 ATOM 593 O HIS 79 -3.774 -8.245 2.393 1.00 0.00 ATOM 594 C HIS 79 -3.482 -7.603 3.429 1.00 0.00 ATOM 598 N VAL 82 3.716 -5.701 1.994 1.00 0.00 ATOM 599 CA VAL 82 4.370 -4.601 1.294 1.00 0.00 ATOM 600 CB VAL 82 4.099 -3.252 1.984 1.00 0.00 ATOM 601 CG1 VAL 82 2.607 -2.949 1.995 1.00 0.00 ATOM 602 CG2 VAL 82 4.592 -3.281 3.422 1.00 0.00 ATOM 603 O VAL 82 6.395 -5.571 2.016 1.00 0.00 ATOM 604 C VAL 82 5.873 -4.808 1.253 1.00 0.00 ATOM 605 N THR 83 6.571 -4.107 0.367 1.00 0.00 ATOM 606 CA THR 83 8.024 -4.074 0.399 1.00 0.00 ATOM 607 CB THR 83 8.634 -5.069 -0.604 1.00 0.00 ATOM 608 CG2 THR 83 10.154 -5.038 -0.528 1.00 0.00 ATOM 609 OG1 THR 83 8.182 -6.394 -0.303 1.00 0.00 ATOM 610 O THR 83 7.971 -2.047 -0.868 1.00 0.00 ATOM 611 C THR 83 8.507 -2.679 0.047 1.00 0.00 ATOM 612 N ARG 84 9.502 -2.187 0.785 1.00 0.00 ATOM 613 CA ARG 84 10.245 -1.003 0.345 1.00 0.00 ATOM 614 CB ARG 84 10.488 -0.055 1.521 1.00 0.00 ATOM 615 CG ARG 84 9.221 0.561 2.093 1.00 0.00 ATOM 616 CD ARG 84 9.535 1.521 3.227 1.00 0.00 ATOM 617 NE ARG 84 8.325 2.014 3.879 1.00 0.00 ATOM 618 CZ ARG 84 8.319 2.878 4.890 1.00 0.00 ATOM 619 NH1 ARG 84 7.169 3.270 5.421 1.00 0.00 ATOM 620 NH2 ARG 84 9.465 3.347 5.366 1.00 0.00 ATOM 621 O ARG 84 12.212 -2.359 0.362 1.00 0.00 ATOM 622 C ARG 84 11.564 -1.461 -0.214 1.00 0.00 ATOM 623 N ASN 85 11.938 -0.862 -1.341 1.00 0.00 ATOM 624 CA ASN 85 13.138 -1.241 -2.072 1.00 0.00 ATOM 625 CB ASN 85 12.771 -1.843 -3.430 1.00 0.00 ATOM 626 CG ASN 85 13.985 -2.311 -4.207 1.00 0.00 ATOM 627 ND2 ASN 85 14.074 -3.617 -4.431 1.00 0.00 ATOM 628 OD1 ASN 85 14.829 -1.507 -4.601 1.00 0.00 ATOM 629 O ASN 85 13.591 0.970 -2.942 1.00 0.00 ATOM 630 C ASN 85 14.003 -0.008 -2.293 1.00 0.00 ATOM 631 N PHE 86 15.197 -0.067 -1.723 1.00 0.00 ATOM 632 CA PHE 86 16.193 1.001 -1.832 1.00 0.00 ATOM 633 CB PHE 86 16.456 1.631 -0.462 1.00 0.00 ATOM 634 CG PHE 86 15.243 2.267 0.155 1.00 0.00 ATOM 635 CD1 PHE 86 14.440 1.557 1.031 1.00 0.00 ATOM 636 CD2 PHE 86 14.906 3.576 -0.139 1.00 0.00 ATOM 637 CE1 PHE 86 13.325 2.143 1.598 1.00 0.00 ATOM 638 CE2 PHE 86 13.790 4.162 0.428 1.00 0.00 ATOM 639 CZ PHE 86 13.002 3.451 1.293 1.00 0.00 ATOM 640 O PHE 86 18.211 -0.278 -1.627 1.00 0.00 ATOM 641 C PHE 86 17.480 0.394 -2.371 1.00 0.00 ATOM 642 N PRO 87 17.723 0.605 -3.665 1.00 0.00 ATOM 643 CA PRO 87 18.758 -0.128 -4.395 1.00 0.00 ATOM 644 CB PRO 87 20.067 0.372 -3.780 1.00 0.00 ATOM 645 CG PRO 87 19.697 0.781 -2.395 1.00 0.00 ATOM 646 CD PRO 87 18.305 1.338 -2.482 1.00 0.00 ATOM 647 O PRO 87 17.566 -2.207 -4.498 1.00 0.00 ATOM 648 C PRO 87 18.625 -1.633 -4.236 1.00 0.00 ATOM 649 N GLU 88 19.704 -2.285 -3.779 1.00 0.00 ATOM 650 CA GLU 88 19.674 -3.746 -3.638 1.00 0.00 ATOM 651 CB GLU 88 21.097 -4.309 -3.594 1.00 0.00 ATOM 652 CG GLU 88 21.864 -4.156 -4.896 1.00 0.00 ATOM 653 CD GLU 88 23.291 -4.660 -4.794 1.00 0.00 ATOM 654 OE1 GLU 88 23.686 -5.108 -3.696 1.00 0.00 ATOM 655 OE2 GLU 88 24.013 -4.610 -5.812 1.00 0.00 ATOM 656 O GLU 88 18.668 -5.380 -2.228 1.00 0.00 ATOM 657 C GLU 88 18.969 -4.194 -2.368 1.00 0.00 ATOM 658 N GLY 89 18.725 -3.253 -1.452 1.00 0.00 ATOM 659 CA GLY 89 18.068 -3.554 -0.178 1.00 0.00 ATOM 660 O GLY 89 15.913 -2.658 -0.673 1.00 0.00 ATOM 661 C GLY 89 16.558 -3.638 -0.321 1.00 0.00 ATOM 662 N LYS 90 16.006 -4.809 -0.025 1.00 0.00 ATOM 663 CA LYS 90 14.568 -5.015 -0.051 1.00 0.00 ATOM 664 CB LYS 90 14.210 -6.187 -0.967 1.00 0.00 ATOM 665 CG LYS 90 14.558 -5.961 -2.429 1.00 0.00 ATOM 666 CD LYS 90 14.118 -7.134 -3.289 1.00 0.00 ATOM 667 CE LYS 90 14.480 -6.914 -4.749 1.00 0.00 ATOM 668 NZ LYS 90 13.977 -8.014 -5.619 1.00 0.00 ATOM 669 O LYS 90 14.567 -6.235 2.010 1.00 0.00 ATOM 670 C LYS 90 14.072 -5.318 1.356 1.00 0.00 ATOM 671 N GLY 91 13.109 -4.531 1.824 1.00 0.00 ATOM 672 CA GLY 91 12.524 -4.737 3.162 1.00 0.00 ATOM 673 O GLY 91 10.233 -4.279 2.569 1.00 0.00 ATOM 674 C GLY 91 11.048 -5.096 3.012 1.00 0.00 ATOM 675 N GLU 92 10.715 -6.323 3.386 1.00 0.00 ATOM 676 CA GLU 92 9.347 -6.808 3.275 1.00 0.00 ATOM 677 CB GLU 92 9.316 -8.171 2.581 1.00 0.00 ATOM 678 CG GLU 92 7.923 -8.760 2.430 1.00 0.00 ATOM 679 CD GLU 92 7.929 -10.096 1.713 1.00 0.00 ATOM 680 OE1 GLU 92 9.025 -10.563 1.338 1.00 0.00 ATOM 681 OE2 GLU 92 6.839 -10.675 1.526 1.00 0.00 ATOM 682 O GLU 92 9.393 -7.351 5.612 1.00 0.00 ATOM 683 C GLU 92 8.704 -6.963 4.657 1.00 0.00 ATOM 684 N VAL 93 7.403 -6.668 4.751 1.00 0.00 ATOM 685 CA VAL 93 6.678 -6.603 6.033 1.00 0.00 ATOM 686 CB VAL 93 7.037 -5.328 6.819 1.00 0.00 ATOM 687 CG1 VAL 93 6.560 -4.090 6.074 1.00 0.00 ATOM 688 CG2 VAL 93 6.379 -5.346 8.190 1.00 0.00 ATOM 689 O VAL 93 4.687 -6.098 4.765 1.00 0.00 ATOM 690 C VAL 93 5.153 -6.599 5.785 1.00 0.00 ATOM 691 N ASP 94 4.385 -7.153 6.722 1.00 0.00 ATOM 692 CA ASP 94 2.935 -7.120 6.602 1.00 0.00 ATOM 693 CB ASP 94 2.292 -8.060 7.622 1.00 0.00 ATOM 694 CG ASP 94 2.478 -9.523 7.267 1.00 0.00 ATOM 695 OD1 ASP 94 2.923 -9.807 6.136 1.00 0.00 ATOM 696 OD2 ASP 94 2.180 -10.384 8.121 1.00 0.00 ATOM 697 O ASP 94 2.939 -4.950 7.635 1.00 0.00 ATOM 698 C ASP 94 2.377 -5.721 6.843 1.00 0.00 ATOM 699 N VAL 95 1.292 -5.389 6.137 1.00 0.00 ATOM 700 CA VAL 95 0.565 -4.159 6.393 1.00 0.00 ATOM 701 CB VAL 95 0.859 -3.095 5.319 1.00 0.00 ATOM 702 CG1 VAL 95 0.421 -3.588 3.948 1.00 0.00 ATOM 703 CG2 VAL 95 0.113 -1.806 5.628 1.00 0.00 ATOM 704 O VAL 95 -1.410 -5.189 5.540 1.00 0.00 ATOM 705 C VAL 95 -0.920 -4.437 6.394 1.00 0.00 ATOM 706 N ALA 96 -1.640 -3.886 7.372 1.00 0.00 ATOM 707 CA ALA 96 -3.106 -3.829 7.262 1.00 0.00 ATOM 708 CB ALA 96 -3.754 -4.326 8.546 1.00 0.00 ATOM 709 O ALA 96 -3.135 -1.486 7.823 1.00 0.00 ATOM 710 C ALA 96 -3.471 -2.374 7.015 1.00 0.00 ATOM 711 N CYS 97 -4.110 -2.118 5.882 1.00 0.00 ATOM 712 CA CYS 97 -4.456 -0.758 5.515 1.00 0.00 ATOM 713 CB CYS 97 -3.990 -0.452 4.090 1.00 0.00 ATOM 714 SG CYS 97 -2.201 -0.553 3.852 1.00 0.00 ATOM 715 O CYS 97 -6.714 -1.399 5.071 1.00 0.00 ATOM 716 C CYS 97 -5.956 -0.557 5.583 1.00 0.00 ATOM 717 N ILE 98 -6.375 0.540 6.224 1.00 0.00 ATOM 718 CA ILE 98 -7.771 0.946 6.183 1.00 0.00 ATOM 719 CB ILE 98 -8.329 1.189 7.597 1.00 0.00 ATOM 720 CG1 ILE 98 -8.262 -0.095 8.426 1.00 0.00 ATOM 721 CG2 ILE 98 -9.780 1.642 7.526 1.00 0.00 ATOM 722 CD1 ILE 98 -8.575 0.106 9.892 1.00 0.00 ATOM 723 O ILE 98 -7.202 3.183 5.517 1.00 0.00 ATOM 724 C ILE 98 -7.972 2.244 5.392 1.00 0.00 ATOM 725 N TYR 99 -8.988 2.244 4.534 1.00 0.00 ATOM 726 CA TYR 99 -9.199 3.352 3.626 1.00 0.00 ATOM 727 CB TYR 99 -8.955 2.913 2.180 1.00 0.00 ATOM 728 CG TYR 99 -7.540 2.453 1.911 1.00 0.00 ATOM 729 CD1 TYR 99 -7.180 1.123 2.086 1.00 0.00 ATOM 730 CD2 TYR 99 -6.569 3.350 1.482 1.00 0.00 ATOM 731 CE1 TYR 99 -5.890 0.692 1.842 1.00 0.00 ATOM 732 CE2 TYR 99 -5.275 2.937 1.233 1.00 0.00 ATOM 733 CZ TYR 99 -4.940 1.596 1.417 1.00 0.00 ATOM 734 OH TYR 99 -3.654 1.171 1.174 1.00 0.00 ATOM 735 O TYR 99 -11.520 3.096 4.157 1.00 0.00 ATOM 736 C TYR 99 -10.618 3.840 3.758 1.00 0.00 ATOM 737 N GLU 100 -10.817 5.107 3.433 1.00 0.00 ATOM 738 CA GLU 100 -12.154 5.596 3.205 1.00 0.00 ATOM 739 CB GLU 100 -12.525 6.650 4.250 1.00 0.00 ATOM 740 CG GLU 100 -13.925 7.219 4.088 1.00 0.00 ATOM 741 CD GLU 100 -14.269 8.233 5.162 1.00 0.00 ATOM 742 OE1 GLU 100 -13.391 8.534 5.997 1.00 0.00 ATOM 743 OE2 GLU 100 -15.418 8.724 5.169 1.00 0.00 ATOM 744 O GLU 100 -11.316 6.979 1.448 1.00 0.00 ATOM 745 C GLU 100 -12.205 6.209 1.830 1.00 0.00 ATOM 746 N VAL 101 -13.217 5.820 1.059 1.00 0.00 ATOM 747 CA VAL 101 -13.366 6.377 -0.277 1.00 0.00 ATOM 748 CB VAL 101 -13.268 5.285 -1.357 1.00 0.00 ATOM 749 CG1 VAL 101 -13.472 5.883 -2.741 1.00 0.00 ATOM 750 CG2 VAL 101 -11.902 4.617 -1.319 1.00 0.00 ATOM 751 O VAL 101 -15.760 6.581 -0.070 1.00 0.00 ATOM 752 C VAL 101 -14.699 7.071 -0.477 1.00 0.00 ATOM 753 N GLU 102 -14.606 8.243 -1.077 1.00 0.00 ATOM 754 CA GLU 102 -15.739 9.095 -1.297 1.00 0.00 ATOM 755 CB GLU 102 -15.684 10.311 -0.371 1.00 0.00 ATOM 756 CG GLU 102 -16.869 11.253 -0.511 1.00 0.00 ATOM 757 CD GLU 102 -16.757 12.467 0.390 1.00 0.00 ATOM 758 OE1 GLU 102 -15.727 12.601 1.081 1.00 0.00 ATOM 759 OE2 GLU 102 -17.701 13.285 0.403 1.00 0.00 ATOM 760 O GLU 102 -14.720 10.224 -3.164 1.00 0.00 ATOM 761 C GLU 102 -15.680 9.535 -2.753 1.00 0.00 ATOM 762 N ASN 103 -16.666 9.107 -3.542 1.00 0.00 ATOM 763 CA ASN 103 -16.773 9.556 -4.940 1.00 0.00 ATOM 764 CB ASN 103 -16.851 11.082 -5.007 1.00 0.00 ATOM 765 CG ASN 103 -18.140 11.626 -4.423 1.00 0.00 ATOM 766 ND2 ASN 103 -18.090 12.856 -3.924 1.00 0.00 ATOM 767 OD1 ASN 103 -19.166 10.948 -4.422 1.00 0.00 ATOM 768 O ASN 103 -15.044 9.927 -6.577 1.00 0.00 ATOM 769 C ASN 103 -15.582 9.127 -5.793 1.00 0.00 ATOM 770 N GLY 104 -15.153 7.882 -5.617 1.00 0.00 ATOM 771 CA GLY 104 -13.967 7.372 -6.301 1.00 0.00 ATOM 772 O GLY 104 -11.584 7.429 -6.194 1.00 0.00 ATOM 773 C GLY 104 -12.639 7.889 -5.764 1.00 0.00 ATOM 774 N ARG 105 -12.671 8.848 -4.837 1.00 0.00 ATOM 775 CA ARG 105 -11.436 9.401 -4.280 1.00 0.00 ATOM 776 CB ARG 105 -11.514 10.927 -4.217 1.00 0.00 ATOM 777 CG ARG 105 -11.558 11.604 -5.577 1.00 0.00 ATOM 778 CD ARG 105 -11.581 13.118 -5.441 1.00 0.00 ATOM 779 NE ARG 105 -11.598 13.785 -6.741 1.00 0.00 ATOM 780 CZ ARG 105 -11.595 15.103 -6.904 1.00 0.00 ATOM 781 NH1 ARG 105 -11.613 15.620 -8.125 1.00 0.00 ATOM 782 NH2 ARG 105 -11.573 15.902 -5.846 1.00 0.00 ATOM 783 O ARG 105 -12.122 8.756 -2.055 1.00 0.00 ATOM 784 C ARG 105 -11.184 8.876 -2.854 1.00 0.00 ATOM 785 N ILE 106 -9.926 8.555 -2.551 1.00 0.00 ATOM 786 CA ILE 106 -9.501 8.147 -1.200 1.00 0.00 ATOM 787 CB ILE 106 -8.155 7.400 -1.234 1.00 0.00 ATOM 788 CG1 ILE 106 -8.256 6.163 -2.130 1.00 0.00 ATOM 789 CG2 ILE 106 -7.760 6.950 0.164 1.00 0.00 ATOM 790 CD1 ILE 106 -9.290 5.158 -1.671 1.00 0.00 ATOM 791 O ILE 106 -8.537 10.260 -0.535 1.00 0.00 ATOM 792 C ILE 106 -9.323 9.360 -0.260 1.00 0.00 ATOM 793 N ALA 107 -10.073 9.362 0.834 1.00 0.00 ATOM 794 CA ALA 107 -10.080 10.456 1.786 1.00 0.00 ATOM 795 CB ALA 107 -11.509 10.858 2.120 1.00 0.00 ATOM 796 O ALA 107 -9.017 10.966 3.865 1.00 0.00 ATOM 797 C ALA 107 -9.384 10.079 3.094 1.00 0.00 ATOM 798 N LYS 108 -9.235 8.771 3.350 1.00 0.00 ATOM 799 CA LYS 108 -8.432 8.255 4.456 1.00 0.00 ATOM 800 CB LYS 108 -9.336 7.727 5.572 1.00 0.00 ATOM 801 CG LYS 108 -10.170 8.798 6.255 1.00 0.00 ATOM 802 CD LYS 108 -11.009 8.211 7.380 1.00 0.00 ATOM 803 CE LYS 108 -11.896 9.270 8.016 1.00 0.00 ATOM 804 NZ LYS 108 -12.726 8.710 9.117 1.00 0.00 ATOM 805 O LYS 108 -7.970 6.224 3.221 1.00 0.00 ATOM 806 C LYS 108 -7.533 7.104 3.966 1.00 0.00 ATOM 807 N ALA 109 -6.282 7.100 4.395 1.00 0.00 ATOM 808 CA ALA 109 -5.398 6.019 4.066 1.00 0.00 ATOM 809 CB ALA 109 -4.501 6.404 2.898 1.00 0.00 ATOM 810 O ALA 109 -3.697 6.548 5.649 1.00 0.00 ATOM 811 C ALA 109 -4.584 5.764 5.303 1.00 0.00 ATOM 812 N TRP 110 -4.893 4.654 5.971 1.00 0.00 ATOM 813 CA TRP 110 -4.291 4.366 7.251 1.00 0.00 ATOM 814 CB TRP 110 -5.356 4.344 8.350 1.00 0.00 ATOM 815 CG TRP 110 -4.797 4.136 9.724 1.00 0.00 ATOM 816 CD1 TRP 110 -3.481 4.170 10.087 1.00 0.00 ATOM 817 CD2 TRP 110 -5.537 3.861 10.919 1.00 0.00 ATOM 818 CE2 TRP 110 -4.604 3.741 11.968 1.00 0.00 ATOM 819 CE3 TRP 110 -6.897 3.705 11.205 1.00 0.00 ATOM 820 NE1 TRP 110 -3.355 3.934 11.433 1.00 0.00 ATOM 821 CZ2 TRP 110 -4.987 3.471 13.282 1.00 0.00 ATOM 822 CZ3 TRP 110 -7.272 3.439 12.509 1.00 0.00 ATOM 823 CH2 TRP 110 -6.324 3.324 13.531 1.00 0.00 ATOM 824 O TRP 110 -4.258 1.983 7.265 1.00 0.00 ATOM 825 C TRP 110 -3.597 3.020 7.251 1.00 0.00 ATOM 826 N PHE 111 -2.260 3.038 7.227 1.00 0.00 ATOM 827 CA PHE 111 -1.494 1.800 7.241 1.00 0.00 ATOM 828 CB PHE 111 -0.269 1.917 6.331 1.00 0.00 ATOM 829 CG PHE 111 -0.607 2.026 4.871 1.00 0.00 ATOM 830 CD1 PHE 111 -0.749 3.263 4.271 1.00 0.00 ATOM 831 CD2 PHE 111 -0.782 0.889 4.100 1.00 0.00 ATOM 832 CE1 PHE 111 -1.061 3.363 2.927 1.00 0.00 ATOM 833 CE2 PHE 111 -1.092 0.990 2.758 1.00 0.00 ATOM 834 CZ PHE 111 -1.233 2.221 2.171 1.00 0.00 ATOM 835 O PHE 111 -0.399 2.265 9.354 1.00 0.00 ATOM 836 C PHE 111 -0.987 1.438 8.653 1.00 0.00 ATOM 837 N LYS 112 -1.253 0.190 9.040 1.00 0.00 ATOM 838 CA LYS 112 -0.816 -0.407 10.271 1.00 0.00 ATOM 839 CB LYS 112 -1.989 -1.077 10.988 1.00 0.00 ATOM 840 CG LYS 112 -3.052 -0.107 11.478 1.00 0.00 ATOM 841 CD LYS 112 -4.177 -0.835 12.194 1.00 0.00 ATOM 842 CE LYS 112 -5.250 0.132 12.665 1.00 0.00 ATOM 843 NZ LYS 112 -6.382 -0.573 13.328 1.00 0.00 ATOM 844 O LYS 112 0.065 -2.242 9.030 1.00 0.00 ATOM 845 C LYS 112 0.237 -1.444 9.952 1.00 0.00 ATOM 846 N ILE 113 1.299 -1.459 10.753 1.00 0.00 ATOM 847 CA ILE 113 2.344 -2.448 10.671 1.00 0.00 ATOM 848 CB ILE 113 3.384 -2.083 9.595 1.00 0.00 ATOM 849 CG1 ILE 113 4.039 -0.738 9.922 1.00 0.00 ATOM 850 CG2 ILE 113 2.723 -1.978 8.230 1.00 0.00 ATOM 851 CD1 ILE 113 5.236 -0.416 9.054 1.00 0.00 ATOM 852 O ILE 113 2.768 -1.727 12.917 1.00 0.00 ATOM 853 C ILE 113 3.038 -2.531 12.023 1.00 0.00 ATOM 854 N GLY 114 3.973 -3.476 12.132 1.00 0.00 ATOM 855 CA GLY 114 4.623 -3.816 13.398 1.00 0.00 ATOM 856 O GLY 114 6.755 -4.027 12.350 1.00 0.00 ATOM 857 C GLY 114 6.125 -3.537 13.283 1.00 0.00 ATOM 858 N GLU 115 6.689 -2.775 14.223 1.00 0.00 ATOM 859 CA GLU 115 8.134 -2.490 14.196 1.00 0.00 ATOM 860 CB GLU 115 8.520 -1.574 15.360 1.00 0.00 ATOM 861 CG GLU 115 8.018 -0.146 15.220 1.00 0.00 ATOM 862 CD GLU 115 8.312 0.698 16.444 1.00 0.00 ATOM 863 OE1 GLU 115 8.843 0.147 17.431 1.00 0.00 ATOM 864 OE2 GLU 115 8.011 1.910 16.416 1.00 0.00 ATOM 865 O GLU 115 9.984 -3.883 13.664 1.00 0.00 ATOM 866 C GLU 115 8.971 -3.761 14.311 1.00 0.00 ATOM 867 N PRO 116 8.556 -4.710 15.132 1.00 0.00 ATOM 868 CA PRO 116 9.278 -5.969 15.241 1.00 0.00 ATOM 869 CB PRO 116 8.506 -6.748 16.308 1.00 0.00 ATOM 870 CG PRO 116 7.921 -5.694 17.187 1.00 0.00 ATOM 871 CD PRO 116 7.482 -4.585 16.275 1.00 0.00 ATOM 872 O PRO 116 10.351 -7.186 13.423 1.00 0.00 ATOM 873 C PRO 116 9.301 -6.742 13.893 1.00 0.00 ATOM 874 N ARG 117 8.147 -6.861 13.259 1.00 0.00 ATOM 875 CA ARG 117 8.075 -7.452 11.947 1.00 0.00 ATOM 876 CB ARG 117 6.629 -7.471 11.446 1.00 0.00 ATOM 877 CG ARG 117 5.735 -8.462 12.170 1.00 0.00 ATOM 878 CD ARG 117 4.300 -8.375 11.674 1.00 0.00 ATOM 879 NE ARG 117 3.419 -9.304 12.379 1.00 0.00 ATOM 880 CZ ARG 117 2.107 -9.379 12.191 1.00 0.00 ATOM 881 NH1 ARG 117 1.386 -10.253 12.878 1.00 0.00 ATOM 882 NH2 ARG 117 1.516 -8.577 11.314 1.00 0.00 ATOM 883 O ARG 117 9.625 -7.268 10.093 1.00 0.00 ATOM 884 C ARG 117 8.922 -6.672 10.901 1.00 0.00 ATOM 885 N ILE 118 8.856 -5.347 10.933 1.00 0.00 ATOM 886 CA ILE 118 9.686 -4.524 10.085 1.00 0.00 ATOM 887 CB ILE 118 9.331 -3.032 10.224 1.00 0.00 ATOM 888 CG1 ILE 118 7.935 -2.762 9.660 1.00 0.00 ATOM 889 CG2 ILE 118 10.332 -2.172 9.468 1.00 0.00 ATOM 890 CD1 ILE 118 7.398 -1.386 9.990 1.00 0.00 ATOM 891 O ILE 118 11.986 -4.608 9.502 1.00 0.00 ATOM 892 C ILE 118 11.166 -4.643 10.400 1.00 0.00 ATOM 893 N VAL 119 11.514 -4.765 11.674 1.00 0.00 ATOM 894 CA VAL 119 12.903 -4.937 12.048 1.00 0.00 ATOM 895 CB VAL 119 13.074 -4.980 13.578 1.00 0.00 ATOM 896 CG1 VAL 119 14.501 -5.357 13.943 1.00 0.00 ATOM 897 CG2 VAL 119 12.766 -3.621 14.186 1.00 0.00 ATOM 898 O VAL 119 14.493 -6.294 10.867 1.00 0.00 ATOM 899 C VAL 119 13.415 -6.256 11.455 1.00 0.00 ATOM 900 N SER 120 12.627 -7.322 11.596 1.00 0.00 ATOM 901 CA SER 120 12.992 -8.638 11.052 1.00 0.00 ATOM 902 CB SER 120 11.918 -9.673 11.388 1.00 0.00 ATOM 903 OG SER 120 11.805 -9.857 12.788 1.00 0.00 ATOM 904 O SER 120 14.032 -9.200 8.971 1.00 0.00 ATOM 905 C SER 120 13.139 -8.575 9.539 1.00 0.00 TER END