PFRMAT TS TARGET T0634 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 T0634 model 4 Wed Jul 14 20:22:50 2010 MODEL 4 PARENT N/A ATOM 1 N MET 1 -6.312 19.298 3.558 1.00 0.00 ATOM 2 CA MET 1 -5.234 18.826 2.610 1.00 0.00 ATOM 3 CB MET 1 -3.883 18.765 3.325 1.00 0.00 ATOM 4 CG MET 1 -3.458 20.076 3.963 1.00 0.00 ATOM 5 SD MET 1 -1.838 19.976 4.747 1.00 0.00 ATOM 6 CE MET 1 -0.763 20.042 3.315 1.00 0.00 ATOM 7 O MET 1 -6.166 16.602 2.554 1.00 0.00 ATOM 8 C MET 1 -5.505 17.456 1.974 1.00 0.00 ATOM 9 N SER 2 -5.085 17.315 0.720 1.00 0.00 ATOM 10 CA SER 2 -5.016 16.035 0.019 1.00 0.00 ATOM 11 CB SER 2 -4.173 16.164 -1.251 1.00 0.00 ATOM 12 OG SER 2 -4.024 14.910 -1.894 1.00 0.00 ATOM 13 O SER 2 -3.473 14.907 1.481 1.00 0.00 ATOM 14 C SER 2 -4.464 14.829 0.775 1.00 0.00 ATOM 15 N LEU 3 -5.125 13.706 0.568 1.00 0.00 ATOM 16 CA LEU 3 -4.577 12.429 1.020 1.00 0.00 ATOM 17 CB LEU 3 -5.657 11.346 1.003 1.00 0.00 ATOM 18 CG LEU 3 -6.836 11.549 1.958 1.00 0.00 ATOM 19 CD1 LEU 3 -7.889 10.473 1.746 1.00 0.00 ATOM 20 CD2 LEU 3 -6.363 11.550 3.403 1.00 0.00 ATOM 21 O LEU 3 -3.395 12.430 -1.060 1.00 0.00 ATOM 22 C LEU 3 -3.408 12.074 0.114 1.00 0.00 ATOM 23 N LYS 4 -2.425 11.346 0.651 1.00 0.00 ATOM 24 CA LYS 4 -1.211 11.016 -0.107 1.00 0.00 ATOM 25 CB LYS 4 0.036 11.450 0.666 1.00 0.00 ATOM 26 CG LYS 4 1.345 11.091 -0.020 1.00 0.00 ATOM 27 CD LYS 4 2.540 11.460 0.846 1.00 0.00 ATOM 28 CE LYS 4 2.481 12.917 1.275 1.00 0.00 ATOM 29 NZ LYS 4 3.735 13.347 1.953 1.00 0.00 ATOM 30 O LYS 4 -1.325 8.708 0.485 1.00 0.00 ATOM 31 C LYS 4 -1.168 9.515 -0.401 1.00 0.00 ATOM 32 N LYS 5 -1.003 9.171 -1.649 1.00 0.00 ATOM 33 CA LYS 5 -0.954 7.771 -2.073 1.00 0.00 ATOM 34 CB LYS 5 -1.999 7.502 -3.160 1.00 0.00 ATOM 35 CG LYS 5 -3.435 7.694 -2.700 1.00 0.00 ATOM 36 CD LYS 5 -4.416 7.411 -3.825 1.00 0.00 ATOM 37 CE LYS 5 -4.406 8.525 -4.860 1.00 0.00 ATOM 38 NZ LYS 5 -5.438 8.316 -5.912 1.00 0.00 ATOM 39 O LYS 5 0.996 8.122 -3.423 1.00 0.00 ATOM 40 C LYS 5 0.441 7.416 -2.576 1.00 0.00 ATOM 41 N ILE 6 1.002 6.309 -2.056 1.00 0.00 ATOM 42 CA ILE 6 2.276 5.764 -2.521 1.00 0.00 ATOM 43 CB ILE 6 3.112 5.207 -1.353 1.00 0.00 ATOM 44 CG1 ILE 6 3.342 6.290 -0.299 1.00 0.00 ATOM 45 CG2 ILE 6 4.422 4.625 -1.864 1.00 0.00 ATOM 46 CD1 ILE 6 4.070 7.509 -0.825 1.00 0.00 ATOM 47 O ILE 6 1.228 3.716 -3.254 1.00 0.00 ATOM 48 C ILE 6 1.934 4.676 -3.572 1.00 0.00 ATOM 49 N LEU 7 2.378 4.879 -4.786 1.00 0.00 ATOM 50 CA LEU 7 2.116 3.952 -5.885 1.00 0.00 ATOM 51 CB LEU 7 1.574 4.703 -7.103 1.00 0.00 ATOM 52 CG LEU 7 0.269 5.476 -6.897 1.00 0.00 ATOM 53 CD1 LEU 7 -0.104 6.245 -8.156 1.00 0.00 ATOM 54 CD2 LEU 7 -0.856 4.534 -6.500 1.00 0.00 ATOM 55 O LEU 7 4.421 3.867 -6.467 1.00 0.00 ATOM 56 C LEU 7 3.390 3.232 -6.202 1.00 0.00 ATOM 57 N ILE 8 3.318 1.884 -6.233 1.00 0.00 ATOM 58 CA ILE 8 4.515 1.037 -6.397 1.00 0.00 ATOM 59 CB ILE 8 4.929 0.381 -5.066 1.00 0.00 ATOM 60 CG1 ILE 8 5.162 1.449 -3.995 1.00 0.00 ATOM 61 CG2 ILE 8 6.153 -0.499 -5.264 1.00 0.00 ATOM 62 CD1 ILE 8 3.938 1.752 -3.160 1.00 0.00 ATOM 63 O ILE 8 3.486 -0.921 -7.285 1.00 0.00 ATOM 64 C ILE 8 4.322 -0.044 -7.443 1.00 0.00 ATOM 65 N ILE 9 5.040 0.077 -8.565 1.00 0.00 ATOM 66 CA ILE 9 4.990 -0.907 -9.624 1.00 0.00 ATOM 67 CB ILE 9 3.758 -0.707 -10.523 1.00 0.00 ATOM 68 CG1 ILE 9 3.595 -1.893 -11.478 1.00 0.00 ATOM 69 CG2 ILE 9 3.853 0.613 -11.272 1.00 0.00 ATOM 70 CD1 ILE 9 2.246 -1.947 -12.159 1.00 0.00 ATOM 71 O ILE 9 6.817 0.294 -10.523 1.00 0.00 ATOM 72 C ILE 9 6.299 -0.781 -10.396 1.00 0.00 ATOM 73 N ASP 10 6.820 -1.890 -10.894 1.00 0.00 ATOM 74 CA ASP 10 8.040 -1.848 -11.660 1.00 0.00 ATOM 75 CB ASP 10 8.777 -3.186 -11.569 1.00 0.00 ATOM 76 CG ASP 10 7.881 -4.367 -11.890 1.00 0.00 ATOM 77 OD1 ASP 10 8.156 -5.066 -12.887 1.00 0.00 ATOM 78 OD2 ASP 10 6.905 -4.593 -11.144 1.00 0.00 ATOM 79 O ASP 10 8.805 -1.275 -13.869 1.00 0.00 ATOM 80 C ASP 10 7.823 -1.504 -13.137 1.00 0.00 ATOM 81 N GLN 11 6.570 -1.424 -13.568 1.00 0.00 ATOM 82 CA GLN 11 6.243 -1.034 -14.954 1.00 0.00 ATOM 83 CB GLN 11 5.030 -1.818 -15.460 1.00 0.00 ATOM 84 CG GLN 11 4.615 -1.471 -16.881 1.00 0.00 ATOM 85 CD GLN 11 5.646 -1.892 -17.909 1.00 0.00 ATOM 86 OE1 GLN 11 6.020 -3.062 -17.985 1.00 0.00 ATOM 87 NE2 GLN 11 6.113 -0.935 -18.702 1.00 0.00 ATOM 88 O GLN 11 5.030 0.955 -14.348 1.00 0.00 ATOM 89 C GLN 11 5.998 0.461 -14.951 1.00 0.00 ATOM 90 N GLN 12 6.834 1.190 -15.670 1.00 0.00 ATOM 91 CA GLN 12 6.784 2.637 -15.651 1.00 0.00 ATOM 92 CB GLN 12 7.911 3.223 -16.504 1.00 0.00 ATOM 93 CG GLN 12 9.299 3.038 -15.912 1.00 0.00 ATOM 94 CD GLN 12 10.396 3.526 -16.837 1.00 0.00 ATOM 95 OE1 GLN 12 10.189 4.444 -17.631 1.00 0.00 ATOM 96 NE2 GLN 12 11.570 2.914 -16.734 1.00 0.00 ATOM 97 O GLN 12 4.858 4.101 -15.605 1.00 0.00 ATOM 98 C GLN 12 5.433 3.151 -16.145 1.00 0.00 ATOM 99 N ASP 13 4.928 2.511 -17.180 1.00 0.00 ATOM 100 CA ASP 13 3.651 2.872 -17.757 1.00 0.00 ATOM 101 CB ASP 13 3.334 1.979 -18.958 1.00 0.00 ATOM 102 CG ASP 13 4.201 2.291 -20.162 1.00 0.00 ATOM 103 OD1 ASP 13 4.846 3.361 -20.167 1.00 0.00 ATOM 104 OD2 ASP 13 4.235 1.467 -21.099 1.00 0.00 ATOM 105 O ASP 13 1.637 3.621 -16.705 1.00 0.00 ATOM 106 C ASP 13 2.520 2.775 -16.715 1.00 0.00 ATOM 107 N PHE 14 2.547 1.773 -15.835 1.00 0.00 ATOM 108 CA PHE 14 1.507 1.641 -14.796 1.00 0.00 ATOM 109 CB PHE 14 1.616 0.283 -14.098 1.00 0.00 ATOM 110 CG PHE 14 1.145 -0.869 -14.940 1.00 0.00 ATOM 111 CD1 PHE 14 2.053 -1.732 -15.528 1.00 0.00 ATOM 112 CD2 PHE 14 -0.205 -1.091 -15.143 1.00 0.00 ATOM 113 CE1 PHE 14 1.621 -2.792 -16.302 1.00 0.00 ATOM 114 CE2 PHE 14 -0.638 -2.151 -15.916 1.00 0.00 ATOM 115 CZ PHE 14 0.269 -2.999 -16.496 1.00 0.00 ATOM 116 O PHE 14 0.637 3.378 -13.356 1.00 0.00 ATOM 117 C PHE 14 1.624 2.774 -13.780 1.00 0.00 ATOM 118 N SER 15 2.846 3.092 -13.388 1.00 0.00 ATOM 119 CA SER 15 3.035 4.177 -12.442 1.00 0.00 ATOM 120 CB SER 15 4.503 4.269 -12.020 1.00 0.00 ATOM 121 OG SER 15 5.327 4.627 -13.115 1.00 0.00 ATOM 122 O SER 15 1.925 6.256 -12.352 1.00 0.00 ATOM 123 C SER 15 2.578 5.506 -13.023 1.00 0.00 ATOM 124 N ARG 16 2.929 5.774 -14.276 1.00 0.00 ATOM 125 CA ARG 16 2.542 7.024 -14.929 1.00 0.00 ATOM 126 CB ARG 16 3.130 7.094 -16.339 1.00 0.00 ATOM 127 CG ARG 16 4.640 7.269 -16.375 1.00 0.00 ATOM 128 CD ARG 16 5.140 7.467 -17.796 1.00 0.00 ATOM 129 NE ARG 16 6.597 7.528 -17.861 1.00 0.00 ATOM 130 CZ ARG 16 7.377 6.485 -18.126 1.00 0.00 ATOM 131 NH1 ARG 16 8.695 6.635 -18.163 1.00 0.00 ATOM 132 NH2 ARG 16 6.840 5.294 -18.353 1.00 0.00 ATOM 133 O ARG 16 0.498 8.230 -14.674 1.00 0.00 ATOM 134 C ARG 16 1.026 7.160 -14.983 1.00 0.00 ATOM 135 N ILE 17 0.346 6.078 -15.353 1.00 0.00 ATOM 136 CA ILE 17 -1.120 5.994 -15.414 1.00 0.00 ATOM 137 CB ILE 17 -1.586 4.603 -15.886 1.00 0.00 ATOM 138 CG1 ILE 17 -1.201 4.380 -17.350 1.00 0.00 ATOM 139 CG2 ILE 17 -3.081 4.438 -15.662 1.00 0.00 ATOM 140 CD1 ILE 17 -1.351 2.947 -17.810 1.00 0.00 ATOM 141 O ILE 17 -2.669 7.160 -13.971 1.00 0.00 ATOM 142 C ILE 17 -1.767 6.315 -14.071 1.00 0.00 ATOM 143 N GLU 18 -1.275 5.649 -13.038 1.00 0.00 ATOM 144 CA GLU 18 -1.816 5.776 -11.696 1.00 0.00 ATOM 145 CB GLU 18 -1.179 4.744 -10.762 1.00 0.00 ATOM 146 CG GLU 18 -1.581 3.309 -11.056 1.00 0.00 ATOM 147 CD GLU 18 -0.885 2.310 -10.153 1.00 0.00 ATOM 148 OE1 GLU 18 0.048 2.716 -9.428 1.00 0.00 ATOM 149 OE2 GLU 18 -1.273 1.124 -10.167 1.00 0.00 ATOM 150 O GLU 18 -2.464 7.815 -10.641 1.00 0.00 ATOM 151 C GLU 18 -1.579 7.183 -11.191 1.00 0.00 ATOM 152 N LEU 19 -0.388 7.697 -11.397 1.00 0.00 ATOM 153 CA LEU 19 -0.092 9.038 -10.899 1.00 0.00 ATOM 154 CB LEU 19 1.384 9.376 -11.119 1.00 0.00 ATOM 155 CG LEU 19 1.885 10.674 -10.480 1.00 0.00 ATOM 156 CD1 LEU 19 3.400 10.663 -10.357 1.00 0.00 ATOM 157 CD2 LEU 19 1.427 11.881 -11.283 1.00 0.00 ATOM 158 O LEU 19 -1.545 10.938 -10.923 1.00 0.00 ATOM 159 C LEU 19 -0.985 10.063 -11.589 1.00 0.00 ATOM 160 N LYS 20 -1.103 9.969 -12.910 1.00 0.00 ATOM 161 CA LYS 20 -1.901 10.943 -13.647 1.00 0.00 ATOM 162 CB LYS 20 -1.869 10.640 -15.147 1.00 0.00 ATOM 163 CG LYS 20 -2.663 11.619 -15.995 1.00 0.00 ATOM 164 CD LYS 20 -2.547 11.286 -17.475 1.00 0.00 ATOM 165 CE LYS 20 -3.367 12.244 -18.322 1.00 0.00 ATOM 166 NZ LYS 20 -3.264 11.931 -19.774 1.00 0.00 ATOM 167 O LYS 20 -3.879 12.024 -12.845 1.00 0.00 ATOM 168 C LYS 20 -3.340 10.975 -13.161 1.00 0.00 ATOM 169 N ASN 21 -3.956 9.808 -13.088 1.00 0.00 ATOM 170 CA ASN 21 -5.349 9.703 -12.703 1.00 0.00 ATOM 171 CB ASN 21 -5.884 8.300 -13.002 1.00 0.00 ATOM 172 CG ASN 21 -6.203 8.100 -14.470 1.00 0.00 ATOM 173 ND2 ASN 21 -5.507 7.163 -15.103 1.00 0.00 ATOM 174 OD1 ASN 21 -7.066 8.780 -15.025 1.00 0.00 ATOM 175 O ASN 21 -6.583 10.717 -10.922 1.00 0.00 ATOM 176 C ASN 21 -5.612 10.035 -11.237 1.00 0.00 ATOM 177 N PHE 22 -4.747 9.607 -10.315 1.00 0.00 ATOM 178 CA PHE 22 -4.980 9.894 -8.924 1.00 0.00 ATOM 179 CB PHE 22 -4.084 9.024 -8.039 1.00 0.00 ATOM 180 CG PHE 22 -4.510 7.585 -7.977 1.00 0.00 ATOM 181 CD1 PHE 22 -5.784 7.207 -8.363 1.00 0.00 ATOM 182 CD2 PHE 22 -3.636 6.609 -7.531 1.00 0.00 ATOM 183 CE1 PHE 22 -6.175 5.882 -8.305 1.00 0.00 ATOM 184 CE2 PHE 22 -4.026 5.285 -7.473 1.00 0.00 ATOM 185 CZ PHE 22 -5.290 4.919 -7.858 1.00 0.00 ATOM 186 O PHE 22 -5.408 11.966 -7.823 1.00 0.00 ATOM 187 C PHE 22 -4.737 11.373 -8.637 1.00 0.00 ATOM 188 N LEU 23 -3.764 11.965 -9.290 1.00 0.00 ATOM 189 CA LEU 23 -3.548 13.406 -9.076 1.00 0.00 ATOM 190 CB LEU 23 -2.268 13.866 -9.774 1.00 0.00 ATOM 191 CG LEU 23 -1.895 15.340 -9.605 1.00 0.00 ATOM 192 CD1 LEU 23 -1.707 15.683 -8.135 1.00 0.00 ATOM 193 CD2 LEU 23 -0.634 15.669 -10.391 1.00 0.00 ATOM 194 O LEU 23 -5.232 15.122 -8.952 1.00 0.00 ATOM 195 C LEU 23 -4.769 14.178 -9.594 1.00 0.00 ATOM 196 N ASP 24 -5.297 13.747 -10.726 1.00 0.00 ATOM 197 CA ASP 24 -6.490 14.400 -11.319 1.00 0.00 ATOM 198 CB ASP 24 -6.833 13.765 -12.668 1.00 0.00 ATOM 199 CG ASP 24 -5.837 14.128 -13.752 1.00 0.00 ATOM 200 OD1 ASP 24 -5.049 15.073 -13.543 1.00 0.00 ATOM 201 OD2 ASP 24 -5.844 13.465 -14.812 1.00 0.00 ATOM 202 O ASP 24 -8.518 15.233 -10.273 1.00 0.00 ATOM 203 C ASP 24 -7.671 14.303 -10.371 1.00 0.00 ATOM 204 N SER 25 -7.753 13.192 -9.660 1.00 0.00 ATOM 205 CA SER 25 -8.822 12.970 -8.687 1.00 0.00 ATOM 206 CB SER 25 -8.995 11.474 -8.413 1.00 0.00 ATOM 207 OG SER 25 -9.360 10.778 -9.594 1.00 0.00 ATOM 208 O SER 25 -9.434 13.502 -6.455 1.00 0.00 ATOM 209 C SER 25 -8.623 13.668 -7.371 1.00 0.00 ATOM 210 N GLU 26 -7.516 14.398 -7.246 1.00 0.00 ATOM 211 CA GLU 26 -7.257 15.194 -6.075 1.00 0.00 ATOM 212 CB GLU 26 -8.570 15.634 -5.424 1.00 0.00 ATOM 213 CG GLU 26 -9.505 16.383 -6.358 1.00 0.00 ATOM 214 CD GLU 26 -8.945 17.723 -6.792 1.00 0.00 ATOM 215 OE1 GLU 26 -7.982 18.199 -6.155 1.00 0.00 ATOM 216 OE2 GLU 26 -9.468 18.299 -7.769 1.00 0.00 ATOM 217 O GLU 26 -6.504 15.053 -3.815 1.00 0.00 ATOM 218 C GLU 26 -6.424 14.600 -4.962 1.00 0.00 ATOM 219 N TYR 27 -5.611 13.600 -5.298 1.00 0.00 ATOM 220 CA TYR 27 -4.682 13.042 -4.333 1.00 0.00 ATOM 221 CB TYR 27 -4.724 11.513 -4.370 1.00 0.00 ATOM 222 CG TYR 27 -6.079 10.930 -4.038 1.00 0.00 ATOM 223 CD1 TYR 27 -6.863 10.345 -5.026 1.00 0.00 ATOM 224 CD2 TYR 27 -6.570 10.967 -2.741 1.00 0.00 ATOM 225 CE1 TYR 27 -8.102 9.810 -4.730 1.00 0.00 ATOM 226 CE2 TYR 27 -7.807 10.437 -2.427 1.00 0.00 ATOM 227 CZ TYR 27 -8.574 9.855 -3.437 1.00 0.00 ATOM 228 OH TYR 27 -9.808 9.322 -3.142 1.00 0.00 ATOM 229 O TYR 27 -2.953 13.918 -5.724 1.00 0.00 ATOM 230 C TYR 27 -3.271 13.534 -4.597 1.00 0.00 ATOM 231 N LEU 28 -2.432 13.550 -3.571 1.00 0.00 ATOM 232 CA LEU 28 -0.999 13.750 -3.775 1.00 0.00 ATOM 233 CB LEU 28 -0.381 14.465 -2.572 1.00 0.00 ATOM 234 CG LEU 28 -0.922 15.863 -2.263 1.00 0.00 ATOM 235 CD1 LEU 28 -0.290 16.416 -0.995 1.00 0.00 ATOM 236 CD2 LEU 28 -0.678 16.806 -3.431 1.00 0.00 ATOM 237 O LEU 28 -0.930 11.386 -3.336 1.00 0.00 ATOM 238 C LEU 28 -0.465 12.336 -3.998 1.00 0.00 ATOM 239 N VAL 29 0.482 12.206 -4.904 1.00 0.00 ATOM 240 CA VAL 29 1.048 10.900 -5.235 1.00 0.00 ATOM 241 CB VAL 29 0.615 10.438 -6.638 1.00 0.00 ATOM 242 CG1 VAL 29 1.314 9.138 -7.010 1.00 0.00 ATOM 243 CG2 VAL 29 -0.896 10.270 -6.701 1.00 0.00 ATOM 244 O VAL 29 3.216 11.850 -5.657 1.00 0.00 ATOM 245 C VAL 29 2.562 10.933 -5.145 1.00 0.00 ATOM 246 N ILE 30 3.093 9.902 -4.502 1.00 0.00 ATOM 247 CA ILE 30 4.520 9.599 -4.533 1.00 0.00 ATOM 248 CB ILE 30 5.158 9.743 -3.138 1.00 0.00 ATOM 249 CG1 ILE 30 4.434 8.852 -2.128 1.00 0.00 ATOM 250 CG2 ILE 30 5.168 11.200 -2.706 1.00 0.00 ATOM 251 CD1 ILE 30 5.175 8.689 -0.818 1.00 0.00 ATOM 252 O ILE 30 3.709 7.393 -5.035 1.00 0.00 ATOM 253 C ILE 30 4.664 8.179 -5.089 1.00 0.00 ATOM 254 N GLU 31 5.826 7.880 -5.652 1.00 0.00 ATOM 255 CA GLU 31 6.012 6.618 -6.370 1.00 0.00 ATOM 256 CB GLU 31 5.983 6.853 -7.882 1.00 0.00 ATOM 257 CG GLU 31 4.658 7.386 -8.402 1.00 0.00 ATOM 258 CD GLU 31 4.661 7.588 -9.904 1.00 0.00 ATOM 259 OE1 GLU 31 5.693 8.040 -10.442 1.00 0.00 ATOM 260 OE2 GLU 31 3.631 7.293 -10.545 1.00 0.00 ATOM 261 O GLU 31 8.262 6.484 -5.588 1.00 0.00 ATOM 262 C GLU 31 7.274 5.888 -6.038 1.00 0.00 ATOM 263 N SER 32 7.226 4.586 -6.268 1.00 0.00 ATOM 264 CA SER 32 8.408 3.714 -6.155 1.00 0.00 ATOM 265 CB SER 32 8.485 3.095 -4.758 1.00 0.00 ATOM 266 OG SER 32 9.601 2.227 -4.645 1.00 0.00 ATOM 267 O SER 32 7.289 2.219 -7.673 1.00 0.00 ATOM 268 C SER 32 8.357 2.636 -7.214 1.00 0.00 ATOM 269 N LYS 33 9.535 2.184 -7.644 1.00 0.00 ATOM 270 CA LYS 33 9.608 1.217 -8.717 1.00 0.00 ATOM 271 CB LYS 33 10.460 1.758 -9.868 1.00 0.00 ATOM 272 CG LYS 33 9.872 2.979 -10.555 1.00 0.00 ATOM 273 CD LYS 33 10.751 3.442 -11.706 1.00 0.00 ATOM 274 CE LYS 33 10.150 4.650 -12.407 1.00 0.00 ATOM 275 NZ LYS 33 11.014 5.130 -13.522 1.00 0.00 ATOM 276 O LYS 33 10.303 -1.046 -9.079 1.00 0.00 ATOM 277 C LYS 33 10.175 -0.135 -8.262 1.00 0.00 ATOM 278 N ASN 34 10.485 -0.269 -6.987 1.00 0.00 ATOM 279 CA ASN 34 10.951 -1.544 -6.411 1.00 0.00 ATOM 280 CB ASN 34 12.455 -1.715 -6.636 1.00 0.00 ATOM 281 CG ASN 34 13.274 -0.642 -5.948 1.00 0.00 ATOM 282 ND2 ASN 34 14.114 0.043 -6.714 1.00 0.00 ATOM 283 OD1 ASN 34 13.151 -0.434 -4.740 1.00 0.00 ATOM 284 O ASN 34 10.207 -0.529 -4.375 1.00 0.00 ATOM 285 C ASN 34 10.589 -1.561 -4.942 1.00 0.00 ATOM 286 N GLU 35 10.678 -2.724 -4.308 1.00 0.00 ATOM 287 CA GLU 35 10.223 -2.853 -2.954 1.00 0.00 ATOM 288 CB GLU 35 10.075 -4.328 -2.576 1.00 0.00 ATOM 289 CG GLU 35 8.952 -5.046 -3.305 1.00 0.00 ATOM 290 CD GLU 35 7.588 -4.468 -2.987 1.00 0.00 ATOM 291 OE1 GLU 35 7.528 -3.439 -2.281 1.00 0.00 ATOM 292 OE2 GLU 35 6.578 -5.043 -3.444 1.00 0.00 ATOM 293 O GLU 35 10.569 -1.873 -0.807 1.00 0.00 ATOM 294 C GLU 35 11.072 -2.208 -1.890 1.00 0.00 ATOM 295 N LYS 36 12.375 -2.057 -2.158 1.00 0.00 ATOM 296 CA LYS 36 13.269 -1.420 -1.211 1.00 0.00 ATOM 297 CB LYS 36 14.725 -1.590 -1.649 1.00 0.00 ATOM 298 CG LYS 36 15.737 -0.984 -0.690 1.00 0.00 ATOM 299 CD LYS 36 17.161 -1.246 -1.153 1.00 0.00 ATOM 300 CE LYS 36 18.173 -0.721 -0.148 1.00 0.00 ATOM 301 NZ LYS 36 18.144 0.766 -0.054 1.00 0.00 ATOM 302 O LYS 36 12.736 0.595 -0.006 1.00 0.00 ATOM 303 C LYS 36 12.885 0.071 -1.098 1.00 0.00 ATOM 304 N GLU 37 12.730 0.710 -2.247 1.00 0.00 ATOM 305 CA GLU 37 12.278 2.099 -2.336 1.00 0.00 ATOM 306 CB GLU 37 12.261 2.567 -3.791 1.00 0.00 ATOM 307 CG GLU 37 11.978 4.050 -3.964 1.00 0.00 ATOM 308 CD GLU 37 11.842 4.452 -5.420 1.00 0.00 ATOM 309 OE1 GLU 37 11.783 3.551 -6.281 1.00 0.00 ATOM 310 OE2 GLU 37 11.795 5.669 -5.697 1.00 0.00 ATOM 311 O GLU 37 10.580 3.192 -0.992 1.00 0.00 ATOM 312 C GLU 37 10.881 2.229 -1.701 1.00 0.00 ATOM 313 N ALA 38 10.004 1.288 -1.997 1.00 0.00 ATOM 314 CA ALA 38 8.663 1.365 -1.442 1.00 0.00 ATOM 315 CB ALA 38 7.805 0.224 -1.966 1.00 0.00 ATOM 316 O ALA 38 7.971 2.098 0.696 1.00 0.00 ATOM 317 C ALA 38 8.666 1.340 0.063 1.00 0.00 ATOM 318 N LEU 39 9.427 0.425 0.655 1.00 0.00 ATOM 319 CA LEU 39 9.443 0.279 2.086 1.00 0.00 ATOM 320 CB LEU 39 10.265 -0.947 2.490 1.00 0.00 ATOM 321 CG LEU 39 10.282 -1.289 3.981 1.00 0.00 ATOM 322 CD1 LEU 39 8.876 -1.585 4.481 1.00 0.00 ATOM 323 CD2 LEU 39 11.198 -2.473 4.251 1.00 0.00 ATOM 324 O LEU 39 9.503 1.936 3.784 1.00 0.00 ATOM 325 C LEU 39 9.996 1.518 2.755 1.00 0.00 ATOM 326 N GLU 40 11.013 2.110 2.146 1.00 0.00 ATOM 327 CA GLU 40 11.635 3.299 2.673 1.00 0.00 ATOM 328 CB GLU 40 12.908 3.630 1.890 1.00 0.00 ATOM 329 CG GLU 40 14.045 2.646 2.109 1.00 0.00 ATOM 330 CD GLU 40 15.259 2.961 1.257 1.00 0.00 ATOM 331 OE1 GLU 40 15.151 3.830 0.365 1.00 0.00 ATOM 332 OE2 GLU 40 16.318 2.339 1.481 1.00 0.00 ATOM 333 O GLU 40 10.490 5.132 3.624 1.00 0.00 ATOM 334 C GLU 40 10.658 4.454 2.623 1.00 0.00 ATOM 335 N GLN 41 9.997 4.641 1.481 1.00 0.00 ATOM 336 CA GLN 41 8.998 5.727 1.364 1.00 0.00 ATOM 337 CB GLN 41 8.472 5.820 -0.070 1.00 0.00 ATOM 338 CG GLN 41 9.488 6.341 -1.072 1.00 0.00 ATOM 339 CD GLN 41 8.970 6.309 -2.497 1.00 0.00 ATOM 340 OE1 GLN 41 7.852 5.864 -2.751 1.00 0.00 ATOM 341 NE2 GLN 41 9.786 6.782 -3.432 1.00 0.00 ATOM 342 O GLN 41 7.339 6.542 2.811 1.00 0.00 ATOM 343 C GLN 41 7.834 5.547 2.314 1.00 0.00 ATOM 344 N ILE 42 7.384 4.316 2.569 1.00 0.00 ATOM 345 CA ILE 42 6.262 4.063 3.463 1.00 0.00 ATOM 346 CB ILE 42 5.823 2.588 3.416 1.00 0.00 ATOM 347 CG1 ILE 42 5.237 2.249 2.044 1.00 0.00 ATOM 348 CG2 ILE 42 4.846 2.286 4.541 1.00 0.00 ATOM 349 CD1 ILE 42 5.039 0.766 1.814 1.00 0.00 ATOM 350 O ILE 42 5.950 5.211 5.535 1.00 0.00 ATOM 351 C ILE 42 6.672 4.476 4.857 1.00 0.00 ATOM 352 N ASP 43 7.841 4.017 5.269 1.00 0.00 ATOM 353 CA ASP 43 8.345 4.258 6.612 1.00 0.00 ATOM 354 CB ASP 43 9.649 3.491 6.841 1.00 0.00 ATOM 355 CG ASP 43 9.433 1.996 6.965 1.00 0.00 ATOM 356 OD1 ASP 43 8.272 1.577 7.150 1.00 0.00 ATOM 357 OD2 ASP 43 10.425 1.244 6.877 1.00 0.00 ATOM 358 O ASP 43 8.277 6.246 7.937 1.00 0.00 ATOM 359 C ASP 43 8.557 5.753 6.843 1.00 0.00 ATOM 360 N HIS 44 9.009 6.471 5.823 1.00 0.00 ATOM 361 CA HIS 44 9.363 7.891 5.950 1.00 0.00 ATOM 362 CB HIS 44 10.555 8.228 5.052 1.00 0.00 ATOM 363 CG HIS 44 11.829 7.559 5.463 1.00 0.00 ATOM 364 CD2 HIS 44 12.991 7.936 6.257 1.00 0.00 ATOM 365 ND1 HIS 44 12.148 6.272 5.092 1.00 0.00 ATOM 366 CE1 HIS 44 13.348 5.951 5.609 1.00 0.00 ATOM 367 NE2 HIS 44 13.859 6.946 6.310 1.00 0.00 ATOM 368 O HIS 44 8.137 9.915 6.388 1.00 0.00 ATOM 369 C HIS 44 8.283 8.939 5.640 1.00 0.00 ATOM 370 N HIS 45 7.546 8.745 4.547 1.00 0.00 ATOM 371 CA HIS 45 6.585 9.738 4.066 1.00 0.00 ATOM 372 CB HIS 45 6.534 9.738 2.537 1.00 0.00 ATOM 373 CG HIS 45 7.804 10.194 1.890 1.00 0.00 ATOM 374 CD2 HIS 45 8.860 9.560 1.114 1.00 0.00 ATOM 375 ND1 HIS 45 8.239 11.501 1.943 1.00 0.00 ATOM 376 CE1 HIS 45 9.402 11.602 1.276 1.00 0.00 ATOM 377 NE2 HIS 45 9.781 10.442 0.777 1.00 0.00 ATOM 378 O HIS 45 4.291 10.349 4.465 1.00 0.00 ATOM 379 C HIS 45 5.167 9.499 4.626 1.00 0.00 ATOM 380 N HIS 46 4.954 8.374 5.290 1.00 0.00 ATOM 381 CA HIS 46 3.679 7.996 5.877 1.00 0.00 ATOM 382 CB HIS 46 3.485 8.685 7.228 1.00 0.00 ATOM 383 CG HIS 46 4.539 8.343 8.236 1.00 0.00 ATOM 384 CD2 HIS 46 5.610 9.069 8.904 1.00 0.00 ATOM 385 ND1 HIS 46 4.676 7.081 8.772 1.00 0.00 ATOM 386 CE1 HIS 46 5.702 7.084 9.642 1.00 0.00 ATOM 387 NE2 HIS 46 6.267 8.273 9.726 1.00 0.00 ATOM 388 O HIS 46 1.636 9.167 5.284 1.00 0.00 ATOM 389 C HIS 46 2.467 8.308 4.999 1.00 0.00 ATOM 390 N PRO 47 2.380 7.604 3.892 1.00 0.00 ATOM 391 CA PRO 47 1.263 7.795 2.983 1.00 0.00 ATOM 392 CB PRO 47 1.625 6.940 1.766 1.00 0.00 ATOM 393 CG PRO 47 2.514 5.874 2.310 1.00 0.00 ATOM 394 CD PRO 47 3.396 6.543 3.326 1.00 0.00 ATOM 395 O PRO 47 -0.034 6.539 4.587 1.00 0.00 ATOM 396 C PRO 47 -0.020 7.334 3.641 1.00 0.00 ATOM 397 N ASP 48 -1.138 7.844 3.146 1.00 0.00 ATOM 398 CA ASP 48 -2.435 7.444 3.637 1.00 0.00 ATOM 399 CB ASP 48 -3.479 8.519 3.330 1.00 0.00 ATOM 400 CG ASP 48 -3.151 9.850 3.974 1.00 0.00 ATOM 401 OD1 ASP 48 -3.155 9.924 5.222 1.00 0.00 ATOM 402 OD2 ASP 48 -2.891 10.822 3.234 1.00 0.00 ATOM 403 O ASP 48 -3.785 5.476 3.574 1.00 0.00 ATOM 404 C ASP 48 -2.893 6.100 3.045 1.00 0.00 ATOM 405 N LEU 49 -2.328 5.698 1.900 1.00 0.00 ATOM 406 CA LEU 49 -2.689 4.446 1.259 1.00 0.00 ATOM 407 CB LEU 49 -3.998 4.600 0.481 1.00 0.00 ATOM 408 CG LEU 49 -4.517 3.346 -0.227 1.00 0.00 ATOM 409 CD1 LEU 49 -6.035 3.278 -0.155 1.00 0.00 ATOM 410 CD2 LEU 49 -4.054 3.317 -1.675 1.00 0.00 ATOM 411 O LEU 49 -0.836 4.932 -0.198 1.00 0.00 ATOM 412 C LEU 49 -1.523 4.061 0.362 1.00 0.00 ATOM 413 N VAL 50 -1.273 2.752 0.258 1.00 0.00 ATOM 414 CA VAL 50 -0.267 2.209 -0.615 1.00 0.00 ATOM 415 CB VAL 50 0.803 1.432 0.174 1.00 0.00 ATOM 416 CG1 VAL 50 1.826 0.824 -0.775 1.00 0.00 ATOM 417 CG2 VAL 50 1.484 2.338 1.187 1.00 0.00 ATOM 418 O VAL 50 -1.694 0.433 -1.328 1.00 0.00 ATOM 419 C VAL 50 -0.918 1.299 -1.673 1.00 0.00 ATOM 420 N ILE 51 -0.643 1.580 -2.939 1.00 0.00 ATOM 421 CA ILE 51 -1.039 0.735 -4.062 1.00 0.00 ATOM 422 CB ILE 51 -1.603 1.571 -5.226 1.00 0.00 ATOM 423 CG1 ILE 51 -2.870 2.309 -4.789 1.00 0.00 ATOM 424 CG2 ILE 51 -1.850 0.692 -6.441 1.00 0.00 ATOM 425 CD1 ILE 51 -2.599 3.599 -4.044 1.00 0.00 ATOM 426 O ILE 51 1.217 0.582 -4.835 1.00 0.00 ATOM 427 C ILE 51 0.224 -0.020 -4.412 1.00 0.00 ATOM 428 N LEU 52 0.193 -1.335 -4.232 1.00 0.00 ATOM 429 CA LEU 52 1.394 -2.160 -4.240 1.00 0.00 ATOM 430 CB LEU 52 1.703 -2.670 -2.831 1.00 0.00 ATOM 431 CG LEU 52 2.952 -3.541 -2.685 1.00 0.00 ATOM 432 CD1 LEU 52 4.191 -2.786 -3.142 1.00 0.00 ATOM 433 CD2 LEU 52 3.117 -4.004 -1.246 1.00 0.00 ATOM 434 O LEU 52 0.485 -4.227 -4.993 1.00 0.00 ATOM 435 C LEU 52 1.301 -3.356 -5.189 1.00 0.00 ATOM 436 N ASP 53 2.178 -3.404 -6.175 1.00 0.00 ATOM 437 CA ASP 53 2.303 -4.542 -7.097 1.00 0.00 ATOM 438 CB ASP 53 3.225 -4.188 -8.265 1.00 0.00 ATOM 439 CG ASP 53 3.162 -5.205 -9.387 1.00 0.00 ATOM 440 OD1 ASP 53 2.214 -6.017 -9.399 1.00 0.00 ATOM 441 OD2 ASP 53 4.061 -5.189 -10.254 1.00 0.00 ATOM 442 O ASP 53 3.784 -5.653 -5.548 1.00 0.00 ATOM 443 C ASP 53 2.832 -5.764 -6.323 1.00 0.00 ATOM 444 N MET 54 2.224 -6.922 -6.564 1.00 0.00 ATOM 445 CA MET 54 2.613 -8.158 -5.910 1.00 0.00 ATOM 446 CB MET 54 1.585 -9.257 -6.188 1.00 0.00 ATOM 447 CG MET 54 1.892 -10.580 -5.506 1.00 0.00 ATOM 448 SD MET 54 3.060 -11.589 -6.438 1.00 0.00 ATOM 449 CE MET 54 2.037 -12.104 -7.815 1.00 0.00 ATOM 450 O MET 54 4.856 -8.979 -5.600 1.00 0.00 ATOM 451 C MET 54 4.012 -8.584 -6.392 1.00 0.00 ATOM 452 N ASP 55 4.235 -8.659 -7.714 1.00 0.00 ATOM 453 CA ASP 55 5.524 -9.023 -8.323 1.00 0.00 ATOM 454 CB ASP 55 5.303 -9.787 -9.630 1.00 0.00 ATOM 455 CG ASP 55 6.601 -10.239 -10.268 1.00 0.00 ATOM 456 OD1 ASP 55 7.676 -9.821 -9.788 1.00 0.00 ATOM 457 OD2 ASP 55 6.545 -11.010 -11.248 1.00 0.00 ATOM 458 O ASP 55 6.078 -6.995 -9.515 1.00 0.00 ATOM 459 C ASP 55 6.327 -7.738 -8.551 1.00 0.00 ATOM 460 N ILE 56 7.258 -7.566 -7.625 1.00 0.00 ATOM 461 CA ILE 56 8.143 -6.394 -7.525 1.00 0.00 ATOM 462 CB ILE 56 7.765 -5.502 -6.328 1.00 0.00 ATOM 463 CG1 ILE 56 6.315 -5.029 -6.452 1.00 0.00 ATOM 464 CG2 ILE 56 8.734 -4.335 -6.206 1.00 0.00 ATOM 465 CD1 ILE 56 6.068 -4.122 -7.638 1.00 0.00 ATOM 466 O ILE 56 9.929 -7.729 -6.631 1.00 0.00 ATOM 467 C ILE 56 9.656 -6.822 -7.410 1.00 0.00 ATOM 468 N ILE 57 10.586 -6.124 -8.023 1.00 0.00 ATOM 469 CA ILE 57 12.003 -6.374 -7.760 1.00 0.00 ATOM 470 CB ILE 57 12.900 -5.723 -8.829 1.00 0.00 ATOM 471 CG1 ILE 57 12.735 -4.202 -8.810 1.00 0.00 ATOM 472 CG2 ILE 57 12.600 -6.306 -10.202 1.00 0.00 ATOM 473 CD1 ILE 57 13.746 -3.466 -9.660 1.00 0.00 ATOM 474 O ILE 57 11.872 -5.057 -5.768 1.00 0.00 ATOM 475 C ILE 57 12.497 -5.904 -6.390 1.00 0.00 ATOM 476 N GLY 58 13.600 -6.517 -5.950 1.00 0.00 ATOM 477 CA GLY 58 14.352 -6.249 -4.718 1.00 0.00 ATOM 478 O GLY 58 14.248 -7.590 -2.744 1.00 0.00 ATOM 479 C GLY 58 13.651 -6.826 -3.492 1.00 0.00 ATOM 480 N GLU 59 12.421 -6.384 -3.253 1.00 0.00 ATOM 481 CA GLU 59 11.556 -6.928 -2.216 1.00 0.00 ATOM 482 CB GLU 59 11.564 -6.024 -0.983 1.00 0.00 ATOM 483 CG GLU 59 12.918 -5.916 -0.301 1.00 0.00 ATOM 484 CD GLU 59 13.322 -7.198 0.400 1.00 0.00 ATOM 485 OE1 GLU 59 12.429 -8.018 0.699 1.00 0.00 ATOM 486 OE2 GLU 59 14.532 -7.383 0.649 1.00 0.00 ATOM 487 O GLU 59 9.733 -6.013 -3.461 1.00 0.00 ATOM 488 C GLU 59 10.221 -7.023 -2.908 1.00 0.00 ATOM 489 N ASN 60 9.591 -8.196 -2.913 1.00 0.00 ATOM 490 CA ASN 60 8.297 -8.277 -3.580 1.00 0.00 ATOM 491 CB ASN 60 8.000 -9.718 -4.000 1.00 0.00 ATOM 492 CG ASN 60 7.798 -10.641 -2.814 1.00 0.00 ATOM 493 ND2 ASN 60 7.845 -11.944 -3.066 1.00 0.00 ATOM 494 OD1 ASN 60 7.602 -10.186 -1.688 1.00 0.00 ATOM 495 O ASN 60 7.446 -7.331 -1.537 1.00 0.00 ATOM 496 C ASN 60 7.192 -7.736 -2.681 1.00 0.00 ATOM 497 N SER 61 5.985 -7.717 -3.202 1.00 0.00 ATOM 498 CA SER 61 4.876 -7.124 -2.478 1.00 0.00 ATOM 499 CB SER 61 3.599 -7.175 -3.319 1.00 0.00 ATOM 500 OG SER 61 2.510 -6.591 -2.627 1.00 0.00 ATOM 501 O SER 61 4.380 -7.209 -0.092 1.00 0.00 ATOM 502 C SER 61 4.659 -7.844 -1.128 1.00 0.00 ATOM 503 N PRO 62 4.761 -9.164 -1.121 1.00 0.00 ATOM 504 CA PRO 62 4.576 -9.937 0.117 1.00 0.00 ATOM 505 CB PRO 62 4.783 -11.389 -0.318 1.00 0.00 ATOM 506 CG PRO 62 4.402 -11.404 -1.761 1.00 0.00 ATOM 507 CD PRO 62 4.885 -10.100 -2.333 1.00 0.00 ATOM 508 O PRO 62 5.312 -9.253 2.306 1.00 0.00 ATOM 509 C PRO 62 5.609 -9.480 1.130 1.00 0.00 ATOM 510 N ASN 63 6.833 -9.307 0.673 1.00 0.00 ATOM 511 CA ASN 63 7.922 -8.982 1.583 1.00 0.00 ATOM 512 CB ASN 63 9.273 -9.142 0.882 1.00 0.00 ATOM 513 CG ASN 63 9.650 -10.595 0.668 1.00 0.00 ATOM 514 ND2 ASN 63 10.552 -10.838 -0.274 1.00 0.00 ATOM 515 OD1 ASN 63 9.132 -11.485 1.342 1.00 0.00 ATOM 516 O ASN 63 8.036 -7.345 3.305 1.00 0.00 ATOM 517 C ASN 63 7.767 -7.568 2.138 1.00 0.00 ATOM 518 N LEU 64 7.380 -6.627 1.293 1.00 0.00 ATOM 519 CA LEU 64 7.088 -5.276 1.747 1.00 0.00 ATOM 520 CB LEU 64 6.627 -4.405 0.578 1.00 0.00 ATOM 521 CG LEU 64 6.240 -2.965 0.917 1.00 0.00 ATOM 522 CD1 LEU 64 7.428 -2.210 1.494 1.00 0.00 ATOM 523 CD2 LEU 64 5.706 -2.247 -0.313 1.00 0.00 ATOM 524 O LEU 64 6.232 -4.707 3.912 1.00 0.00 ATOM 525 C LEU 64 6.029 -5.302 2.843 1.00 0.00 ATOM 526 N CYS 65 4.913 -5.986 2.621 1.00 0.00 ATOM 527 CA CYS 65 3.878 -6.065 3.633 1.00 0.00 ATOM 528 CB CYS 65 2.670 -6.838 3.103 1.00 0.00 ATOM 529 SG CYS 65 1.772 -6.002 1.775 1.00 0.00 ATOM 530 O CYS 65 4.070 -6.292 6.005 1.00 0.00 ATOM 531 C CYS 65 4.395 -6.717 4.898 1.00 0.00 ATOM 532 N LEU 66 5.163 -7.787 4.739 1.00 0.00 ATOM 533 CA LEU 66 5.665 -8.505 5.885 1.00 0.00 ATOM 534 CB LEU 66 6.446 -9.743 5.441 1.00 0.00 ATOM 535 CG LEU 66 5.628 -10.873 4.813 1.00 0.00 ATOM 536 CD1 LEU 66 6.542 -11.954 4.257 1.00 0.00 ATOM 537 CD2 LEU 66 4.664 -11.467 5.830 1.00 0.00 ATOM 538 O LEU 66 6.412 -7.644 7.968 1.00 0.00 ATOM 539 C LEU 66 6.537 -7.612 6.735 1.00 0.00 ATOM 540 N LYS 67 7.418 -6.821 6.113 1.00 0.00 ATOM 541 CA LYS 67 8.307 -5.963 6.868 1.00 0.00 ATOM 542 CB LYS 67 9.391 -5.382 5.958 1.00 0.00 ATOM 543 CG LYS 67 10.413 -6.402 5.483 1.00 0.00 ATOM 544 CD LYS 67 11.452 -5.762 4.576 1.00 0.00 ATOM 545 CE LYS 67 12.474 -6.782 4.101 1.00 0.00 ATOM 546 NZ LYS 67 13.474 -6.178 3.178 1.00 0.00 ATOM 547 O LYS 67 7.884 -4.453 8.666 1.00 0.00 ATOM 548 C LYS 67 7.540 -4.844 7.542 1.00 0.00 ATOM 549 N LEU 68 6.533 -4.310 6.870 1.00 0.00 ATOM 550 CA LEU 68 5.722 -3.278 7.517 1.00 0.00 ATOM 551 CB LEU 68 4.685 -2.719 6.540 1.00 0.00 ATOM 552 CG LEU 68 5.227 -1.871 5.388 1.00 0.00 ATOM 553 CD1 LEU 68 4.133 -1.580 4.373 1.00 0.00 ATOM 554 CD2 LEU 68 5.823 -0.573 5.910 1.00 0.00 ATOM 555 O LEU 68 5.035 -3.215 9.809 1.00 0.00 ATOM 556 C LEU 68 5.042 -3.846 8.750 1.00 0.00 ATOM 557 N LYS 69 4.487 -5.050 8.625 1.00 0.00 ATOM 558 CA LYS 69 3.810 -5.695 9.748 1.00 0.00 ATOM 559 CB LYS 69 3.173 -7.013 9.306 1.00 0.00 ATOM 560 CG LYS 69 2.402 -7.730 10.403 1.00 0.00 ATOM 561 CD LYS 69 1.733 -8.988 9.875 1.00 0.00 ATOM 562 CE LYS 69 0.980 -9.716 10.978 1.00 0.00 ATOM 563 NZ LYS 69 0.321 -10.954 10.476 1.00 0.00 ATOM 564 O LYS 69 4.410 -5.749 12.114 1.00 0.00 ATOM 565 C LYS 69 4.758 -5.956 10.928 1.00 0.00 ATOM 566 N ARG 70 5.976 -6.384 10.611 1.00 0.00 ATOM 567 CA ARG 70 6.973 -6.634 11.639 1.00 0.00 ATOM 568 CB ARG 70 8.251 -7.204 11.020 1.00 0.00 ATOM 569 CG ARG 70 8.111 -8.627 10.506 1.00 0.00 ATOM 570 CD ARG 70 9.398 -9.110 9.858 1.00 0.00 ATOM 571 NE ARG 70 9.288 -10.485 9.380 1.00 0.00 ATOM 572 CZ ARG 70 10.212 -11.097 8.646 1.00 0.00 ATOM 573 NH1 ARG 70 10.025 -12.351 8.256 1.00 0.00 ATOM 574 NH2 ARG 70 11.319 -10.455 8.303 1.00 0.00 ATOM 575 O ARG 70 7.581 -5.434 13.643 1.00 0.00 ATOM 576 C ARG 70 7.300 -5.359 12.430 1.00 0.00 ATOM 577 N SER 71 7.252 -4.207 11.761 1.00 0.00 ATOM 578 CA SER 71 7.492 -2.896 12.371 1.00 0.00 ATOM 579 CB SER 71 7.962 -1.892 11.316 1.00 0.00 ATOM 580 OG SER 71 6.939 -1.628 10.372 1.00 0.00 ATOM 581 O SER 71 6.284 -1.232 13.642 1.00 0.00 ATOM 582 C SER 71 6.252 -2.336 13.084 1.00 0.00 ATOM 583 N LYS 72 5.173 -3.098 13.053 1.00 0.00 ATOM 584 CA LYS 72 3.884 -2.719 13.643 1.00 0.00 ATOM 585 CB LYS 72 4.063 -2.324 15.110 1.00 0.00 ATOM 586 CG LYS 72 4.849 -3.331 15.934 1.00 0.00 ATOM 587 CD LYS 72 3.967 -4.485 16.382 1.00 0.00 ATOM 588 CE LYS 72 4.196 -4.817 17.848 1.00 0.00 ATOM 589 NZ LYS 72 5.300 -5.800 18.029 1.00 0.00 ATOM 590 O LYS 72 2.329 -0.936 13.450 1.00 0.00 ATOM 591 C LYS 72 3.217 -1.590 12.903 1.00 0.00 ATOM 595 N LYS 75 3.585 -1.396 11.636 1.00 0.00 ATOM 596 CA LYS 75 3.035 -0.300 10.841 1.00 0.00 ATOM 597 CB LYS 75 4.074 0.209 9.840 1.00 0.00 ATOM 598 CG LYS 75 5.289 0.858 10.483 1.00 0.00 ATOM 599 CD LYS 75 6.263 1.369 9.433 1.00 0.00 ATOM 600 CE LYS 75 7.442 2.082 10.075 1.00 0.00 ATOM 601 NZ LYS 75 8.296 1.149 10.861 1.00 0.00 ATOM 602 O LYS 75 1.779 -1.915 9.607 1.00 0.00 ATOM 603 C LYS 75 1.785 -0.801 10.144 1.00 0.00 ATOM 604 N ASN 76 0.739 0.019 10.160 1.00 0.00 ATOM 605 CA ASN 76 -0.525 -0.326 9.545 1.00 0.00 ATOM 606 CB ASN 76 -1.615 -0.474 10.608 1.00 0.00 ATOM 607 CG ASN 76 -1.358 -1.637 11.547 1.00 0.00 ATOM 608 ND2 ASN 76 -1.110 -1.328 12.815 1.00 0.00 ATOM 609 OD1 ASN 76 -1.384 -2.796 11.136 1.00 0.00 ATOM 610 O ASN 76 -1.103 1.907 8.832 1.00 0.00 ATOM 611 C ASN 76 -0.880 0.733 8.519 1.00 0.00 ATOM 612 N VAL 77 -0.954 0.284 7.264 1.00 0.00 ATOM 613 CA VAL 77 -1.324 1.127 6.148 1.00 0.00 ATOM 614 CB VAL 77 -0.132 1.371 5.204 1.00 0.00 ATOM 615 CG1 VAL 77 -0.561 2.207 4.009 1.00 0.00 ATOM 616 CG2 VAL 77 1.007 2.048 5.951 1.00 0.00 ATOM 617 O VAL 77 -2.508 -0.766 5.307 1.00 0.00 ATOM 618 C VAL 77 -2.469 0.466 5.431 1.00 0.00 ATOM 619 N PRO 78 -3.372 1.262 4.900 1.00 0.00 ATOM 620 CA PRO 78 -4.337 0.738 3.927 1.00 0.00 ATOM 621 CB PRO 78 -5.312 1.897 3.714 1.00 0.00 ATOM 622 CG PRO 78 -5.157 2.746 4.932 1.00 0.00 ATOM 623 CD PRO 78 -3.693 2.721 5.273 1.00 0.00 ATOM 624 O PRO 78 -2.776 1.182 2.144 1.00 0.00 ATOM 625 C PRO 78 -3.566 0.368 2.655 1.00 0.00 ATOM 626 N LEU 79 -3.748 -0.855 2.180 1.00 0.00 ATOM 627 CA LEU 79 -2.943 -1.387 1.093 1.00 0.00 ATOM 628 CB LEU 79 -1.961 -2.437 1.617 1.00 0.00 ATOM 629 CG LEU 79 -0.939 -1.954 2.647 1.00 0.00 ATOM 630 CD1 LEU 79 -0.132 -3.123 3.191 1.00 0.00 ATOM 631 CD2 LEU 79 -0.013 -0.912 2.039 1.00 0.00 ATOM 632 O LEU 79 -4.703 -2.839 0.366 1.00 0.00 ATOM 633 C LEU 79 -3.864 -1.967 0.050 1.00 0.00 ATOM 634 N ILE 80 -3.718 -1.482 -1.183 1.00 0.00 ATOM 635 CA ILE 80 -4.419 -2.052 -2.355 1.00 0.00 ATOM 636 CB ILE 80 -5.087 -0.953 -3.203 1.00 0.00 ATOM 637 CG1 ILE 80 -6.101 -0.174 -2.363 1.00 0.00 ATOM 638 CG2 ILE 80 -5.724 -1.553 -4.446 1.00 0.00 ATOM 639 CD1 ILE 80 -6.648 1.057 -3.052 1.00 0.00 ATOM 640 O ILE 80 -2.434 -2.248 -3.671 1.00 0.00 ATOM 641 C ILE 80 -3.371 -2.836 -3.132 1.00 0.00 ATOM 642 N LEU 81 -3.499 -4.176 -3.183 1.00 0.00 ATOM 643 CA LEU 81 -2.530 -4.998 -3.902 1.00 0.00 ATOM 644 CB LEU 81 -2.439 -6.389 -3.274 1.00 0.00 ATOM 645 CG LEU 81 -1.980 -6.447 -1.815 1.00 0.00 ATOM 646 CD1 LEU 81 -2.023 -7.874 -1.292 1.00 0.00 ATOM 647 CD2 LEU 81 -0.580 -5.872 -1.668 1.00 0.00 ATOM 648 O LEU 81 -4.069 -5.281 -5.672 1.00 0.00 ATOM 649 C LEU 81 -2.900 -5.109 -5.374 1.00 0.00 ATOM 650 N LEU 82 -1.921 -5.030 -6.270 1.00 0.00 ATOM 651 CA LEU 82 -2.167 -5.160 -7.716 1.00 0.00 ATOM 652 CB LEU 82 -1.522 -3.999 -8.477 1.00 0.00 ATOM 653 CG LEU 82 -1.900 -2.592 -8.010 1.00 0.00 ATOM 654 CD1 LEU 82 -1.199 -1.539 -8.856 1.00 0.00 ATOM 655 CD2 LEU 82 -3.406 -2.394 -8.061 1.00 0.00 ATOM 656 O LEU 82 -0.478 -6.806 -7.934 1.00 0.00 ATOM 657 C LEU 82 -1.632 -6.482 -8.188 1.00 0.00 ATOM 658 N PHE 83 -2.465 -7.248 -8.882 1.00 0.00 ATOM 659 CA PHE 83 -2.024 -8.550 -9.404 1.00 0.00 ATOM 660 CB PHE 83 -2.869 -9.679 -8.810 1.00 0.00 ATOM 661 CG PHE 83 -2.715 -9.834 -7.324 1.00 0.00 ATOM 662 CD1 PHE 83 -3.807 -10.133 -6.529 1.00 0.00 ATOM 663 CD2 PHE 83 -1.480 -9.681 -6.722 1.00 0.00 ATOM 664 CE1 PHE 83 -3.668 -10.276 -5.162 1.00 0.00 ATOM 665 CE2 PHE 83 -1.338 -9.825 -5.355 1.00 0.00 ATOM 666 CZ PHE 83 -2.425 -10.120 -4.576 1.00 0.00 ATOM 667 O PHE 83 -2.908 -7.895 -11.544 1.00 0.00 ATOM 668 C PHE 83 -2.100 -8.581 -10.929 1.00 0.00 ATOM 669 N SER 84 -1.266 -9.407 -11.526 1.00 0.00 ATOM 670 CA SER 84 -1.205 -9.522 -12.975 1.00 0.00 ATOM 671 CB SER 84 0.183 -9.989 -13.418 1.00 0.00 ATOM 672 OG SER 84 1.175 -9.036 -13.078 1.00 0.00 ATOM 673 O SER 84 -2.805 -11.245 -12.696 1.00 0.00 ATOM 674 C SER 84 -2.263 -10.469 -13.464 1.00 0.00 ATOM 675 N SER 85 -2.499 -10.453 -14.772 1.00 0.00 ATOM 676 CA SER 85 -3.470 -11.363 -15.373 1.00 0.00 ATOM 677 CB SER 85 -3.617 -11.080 -16.869 1.00 0.00 ATOM 678 OG SER 85 -4.491 -12.011 -17.481 1.00 0.00 ATOM 679 O SER 85 -1.862 -13.129 -15.286 1.00 0.00 ATOM 680 C SER 85 -3.036 -12.791 -15.132 1.00 0.00 ATOM 681 N GLU 86 -3.976 -13.633 -14.731 1.00 0.00 ATOM 682 CA GLU 86 -3.682 -15.041 -14.446 1.00 0.00 ATOM 683 CB GLU 86 -3.339 -15.789 -15.736 1.00 0.00 ATOM 684 CG GLU 86 -4.459 -15.803 -16.762 1.00 0.00 ATOM 685 CD GLU 86 -4.109 -16.607 -17.998 1.00 0.00 ATOM 686 OE1 GLU 86 -2.967 -17.107 -18.077 1.00 0.00 ATOM 687 OE2 GLU 86 -4.974 -16.737 -18.889 1.00 0.00 ATOM 688 O GLU 86 -1.809 -16.285 -13.588 1.00 0.00 ATOM 689 C GLU 86 -2.543 -15.308 -13.447 1.00 0.00 ATOM 690 N HIS 87 -2.353 -14.412 -12.478 1.00 0.00 ATOM 691 CA HIS 87 -1.471 -14.675 -11.344 1.00 0.00 ATOM 692 CB HIS 87 -0.281 -13.714 -11.357 1.00 0.00 ATOM 693 CG HIS 87 0.589 -13.846 -12.567 1.00 0.00 ATOM 694 CD2 HIS 87 1.848 -14.511 -12.874 1.00 0.00 ATOM 695 ND1 HIS 87 0.279 -13.260 -13.775 1.00 0.00 ATOM 696 CE1 HIS 87 1.243 -13.555 -14.665 1.00 0.00 ATOM 697 NE2 HIS 87 2.188 -14.305 -14.131 1.00 0.00 ATOM 698 O HIS 87 -2.435 -13.443 -9.536 1.00 0.00 ATOM 699 C HIS 87 -2.371 -14.517 -10.139 1.00 0.00 ATOM 700 N LYS 88 -3.088 -15.581 -9.794 1.00 0.00 ATOM 701 CA LYS 88 -3.987 -15.537 -8.665 1.00 0.00 ATOM 702 CB LYS 88 -4.854 -16.796 -8.621 1.00 0.00 ATOM 703 CG LYS 88 -5.842 -16.911 -9.769 1.00 0.00 ATOM 704 CD LYS 88 -6.694 -18.163 -9.642 1.00 0.00 ATOM 705 CE LYS 88 -7.674 -18.285 -10.797 1.00 0.00 ATOM 706 NZ LYS 88 -8.506 -19.516 -10.692 1.00 0.00 ATOM 707 O LYS 88 -2.101 -15.943 -7.241 1.00 0.00 ATOM 708 C LYS 88 -3.184 -15.382 -7.381 1.00 0.00 ATOM 709 N GLU 89 -3.743 -14.597 -6.469 1.00 0.00 ATOM 710 CA GLU 89 -3.139 -14.345 -5.166 1.00 0.00 ATOM 711 CB GLU 89 -2.920 -12.845 -4.958 1.00 0.00 ATOM 712 CG GLU 89 -2.255 -12.491 -3.638 1.00 0.00 ATOM 713 CD GLU 89 -0.816 -12.963 -3.565 1.00 0.00 ATOM 714 OE1 GLU 89 -0.265 -13.355 -4.616 1.00 0.00 ATOM 715 OE2 GLU 89 -0.238 -12.941 -2.458 1.00 0.00 ATOM 716 O GLU 89 -5.212 -14.826 -4.084 1.00 0.00 ATOM 717 C GLU 89 -3.986 -14.898 -4.050 1.00 0.00 ATOM 718 N ALA 90 -3.327 -15.407 -3.020 1.00 0.00 ATOM 719 CA ALA 90 -4.015 -15.975 -1.876 1.00 0.00 ATOM 720 CB ALA 90 -3.118 -16.972 -1.159 1.00 0.00 ATOM 721 O ALA 90 -3.631 -14.275 -0.240 1.00 0.00 ATOM 722 C ALA 90 -4.445 -14.841 -0.940 1.00 0.00 ATOM 723 N ILE 91 -5.734 -14.515 -0.935 1.00 0.00 ATOM 724 CA ILE 91 -6.252 -13.420 -0.108 1.00 0.00 ATOM 725 CB ILE 91 -7.671 -13.008 -0.541 1.00 0.00 ATOM 726 CG1 ILE 91 -8.654 -14.157 -0.304 1.00 0.00 ATOM 727 CG2 ILE 91 -7.674 -12.549 -1.992 1.00 0.00 ATOM 728 CD1 ILE 91 -10.104 -13.771 -0.504 1.00 0.00 ATOM 729 O ILE 91 -6.360 -12.779 2.185 1.00 0.00 ATOM 730 C ILE 91 -6.289 -13.703 1.383 1.00 0.00 ATOM 731 N VAL 92 -6.224 -14.967 1.766 1.00 0.00 ATOM 732 CA VAL 92 -6.129 -15.290 3.168 1.00 0.00 ATOM 733 CB VAL 92 -6.448 -16.773 3.429 1.00 0.00 ATOM 734 CG1 VAL 92 -6.291 -17.100 4.906 1.00 0.00 ATOM 735 CG2 VAL 92 -7.854 -17.107 2.952 1.00 0.00 ATOM 736 O VAL 92 -4.531 -14.359 4.722 1.00 0.00 ATOM 737 C VAL 92 -4.707 -14.922 3.636 1.00 0.00 ATOM 738 N ASN 93 -3.706 -15.201 2.803 1.00 0.00 ATOM 739 CA ASN 93 -2.340 -14.737 3.064 1.00 0.00 ATOM 740 CB ASN 93 -1.374 -15.302 2.020 1.00 0.00 ATOM 741 CG ASN 93 -1.099 -16.780 2.220 1.00 0.00 ATOM 742 ND2 ASN 93 -0.617 -17.438 1.171 1.00 0.00 ATOM 743 OD1 ASN 93 -1.319 -17.321 3.303 1.00 0.00 ATOM 744 O ASN 93 -1.750 -12.580 3.931 1.00 0.00 ATOM 745 C ASN 93 -2.348 -13.216 3.077 1.00 0.00 ATOM 746 N GLY 94 -3.032 -12.619 2.099 1.00 0.00 ATOM 747 CA GLY 94 -3.119 -11.173 2.039 1.00 0.00 ATOM 748 O GLY 94 -3.051 -9.557 3.788 1.00 0.00 ATOM 749 C GLY 94 -3.611 -10.542 3.330 1.00 0.00 ATOM 750 N LEU 95 -4.612 -11.148 3.954 1.00 0.00 ATOM 751 CA LEU 95 -5.112 -10.615 5.209 1.00 0.00 ATOM 752 CB LEU 95 -6.378 -11.358 5.641 1.00 0.00 ATOM 753 CG LEU 95 -7.118 -10.789 6.853 1.00 0.00 ATOM 754 CD1 LEU 95 -7.597 -9.373 6.573 1.00 0.00 ATOM 755 CD2 LEU 95 -8.289 -11.679 7.233 1.00 0.00 ATOM 756 O LEU 95 -3.892 -9.794 7.102 1.00 0.00 ATOM 757 C LEU 95 -4.041 -10.710 6.301 1.00 0.00 ATOM 758 N HIS 96 -3.293 -11.804 6.340 1.00 0.00 ATOM 759 CA HIS 96 -2.172 -11.944 7.280 1.00 0.00 ATOM 760 CB HIS 96 -1.458 -13.281 7.068 1.00 0.00 ATOM 761 CG HIS 96 -0.326 -13.519 8.019 1.00 0.00 ATOM 762 CD2 HIS 96 1.125 -13.547 7.919 1.00 0.00 ATOM 763 ND1 HIS 96 -0.521 -13.792 9.355 1.00 0.00 ATOM 764 CE1 HIS 96 0.674 -13.958 9.948 1.00 0.00 ATOM 765 NE2 HIS 96 1.668 -13.812 9.092 1.00 0.00 ATOM 766 O HIS 96 -0.615 -10.335 8.081 1.00 0.00 ATOM 767 C HIS 96 -1.214 -10.800 7.113 1.00 0.00 ATOM 768 N SER 97 -1.032 -10.376 5.872 1.00 0.00 ATOM 769 CA SER 97 -0.040 -9.358 5.510 1.00 0.00 ATOM 770 CB SER 97 0.446 -9.570 4.074 1.00 0.00 ATOM 771 OG SER 97 -0.600 -9.350 3.145 1.00 0.00 ATOM 772 O SER 97 0.224 -6.975 5.433 1.00 0.00 ATOM 773 C SER 97 -0.536 -7.916 5.641 1.00 0.00 ATOM 774 N GLY 98 -1.797 -7.735 5.972 1.00 0.00 ATOM 775 CA GLY 98 -2.335 -6.395 6.038 1.00 0.00 ATOM 776 O GLY 98 -3.239 -4.657 4.697 1.00 0.00 ATOM 777 C GLY 98 -2.925 -5.834 4.759 1.00 0.00 ATOM 778 N ALA 99 -3.075 -6.626 3.703 1.00 0.00 ATOM 779 CA ALA 99 -3.712 -6.077 2.506 1.00 0.00 ATOM 780 CB ALA 99 -3.537 -7.025 1.329 1.00 0.00 ATOM 781 O ALA 99 -5.850 -6.553 3.528 1.00 0.00 ATOM 782 C ALA 99 -5.206 -5.814 2.775 1.00 0.00 ATOM 783 N ASP 100 -5.733 -4.736 2.218 1.00 0.00 ATOM 784 CA ASP 100 -7.116 -4.357 2.411 1.00 0.00 ATOM 785 CB ASP 100 -7.219 -2.871 2.759 1.00 0.00 ATOM 786 CG ASP 100 -6.517 -2.525 4.057 1.00 0.00 ATOM 787 OD1 ASP 100 -7.108 -2.752 5.132 1.00 0.00 ATOM 788 OD2 ASP 100 -5.372 -2.028 3.997 1.00 0.00 ATOM 789 O ASP 100 -9.245 -4.789 1.416 1.00 0.00 ATOM 790 C ASP 100 -8.020 -4.620 1.242 1.00 0.00 ATOM 791 N ASP 101 -7.441 -4.674 0.048 1.00 0.00 ATOM 792 CA ASP 101 -8.192 -4.879 -1.161 1.00 0.00 ATOM 793 CB ASP 101 -8.963 -3.612 -1.535 1.00 0.00 ATOM 794 CG ASP 101 -10.041 -3.868 -2.570 1.00 0.00 ATOM 795 OD1 ASP 101 -10.486 -5.030 -2.688 1.00 0.00 ATOM 796 OD2 ASP 101 -10.441 -2.910 -3.263 1.00 0.00 ATOM 797 O ASP 101 -6.024 -5.207 -2.097 1.00 0.00 ATOM 798 C ASP 101 -7.226 -5.295 -2.270 1.00 0.00 ATOM 799 N TYR 102 -7.795 -5.720 -3.398 1.00 0.00 ATOM 800 CA TYR 102 -7.075 -6.298 -4.513 1.00 0.00 ATOM 801 CB TYR 102 -7.158 -7.825 -4.470 1.00 0.00 ATOM 802 CG TYR 102 -6.682 -8.429 -3.168 1.00 0.00 ATOM 803 CD1 TYR 102 -7.515 -8.467 -2.056 1.00 0.00 ATOM 804 CD2 TYR 102 -5.403 -8.957 -3.054 1.00 0.00 ATOM 805 CE1 TYR 102 -7.088 -9.017 -0.861 1.00 0.00 ATOM 806 CE2 TYR 102 -4.960 -9.509 -1.868 1.00 0.00 ATOM 807 CZ TYR 102 -5.816 -9.536 -0.768 1.00 0.00 ATOM 808 OH TYR 102 -5.390 -10.084 0.420 1.00 0.00 ATOM 809 O TYR 102 -8.848 -5.642 -5.958 1.00 0.00 ATOM 810 C TYR 102 -7.617 -5.780 -5.805 1.00 0.00 ATOM 811 N LEU 103 -6.727 -5.528 -6.756 1.00 0.00 ATOM 812 CA LEU 103 -7.138 -5.069 -8.091 1.00 0.00 ATOM 813 CB LEU 103 -6.996 -3.549 -8.202 1.00 0.00 ATOM 814 CG LEU 103 -7.355 -2.932 -9.555 1.00 0.00 ATOM 815 CD1 LEU 103 -8.842 -3.089 -9.840 1.00 0.00 ATOM 816 CD2 LEU 103 -6.962 -1.463 -9.596 1.00 0.00 ATOM 817 O LEU 103 -5.075 -5.910 -8.931 1.00 0.00 ATOM 818 C LEU 103 -6.271 -5.802 -9.100 1.00 0.00 ATOM 819 N THR 104 -6.873 -6.275 -10.168 1.00 0.00 ATOM 820 CA THR 104 -6.116 -6.942 -11.219 1.00 0.00 ATOM 821 CB THR 104 -6.883 -8.150 -11.786 1.00 0.00 ATOM 822 CG2 THR 104 -7.302 -9.090 -10.665 1.00 0.00 ATOM 823 OG1 THR 104 -8.060 -7.696 -12.468 1.00 0.00 ATOM 824 O THR 104 -6.484 -5.024 -12.587 1.00 0.00 ATOM 825 C THR 104 -5.784 -5.993 -12.339 1.00 0.00 ATOM 826 N LYS 105 -4.716 -6.331 -13.044 1.00 0.00 ATOM 827 CA LYS 105 -4.232 -5.567 -14.186 1.00 0.00 ATOM 828 CB LYS 105 -2.730 -5.305 -14.058 1.00 0.00 ATOM 829 CG LYS 105 -2.361 -4.345 -12.938 1.00 0.00 ATOM 830 CD LYS 105 -0.876 -4.021 -12.955 1.00 0.00 ATOM 831 CE LYS 105 -0.075 -5.067 -12.195 1.00 0.00 ATOM 832 NZ LYS 105 1.375 -4.732 -12.154 1.00 0.00 ATOM 833 O LYS 105 -4.306 -7.545 -15.449 1.00 0.00 ATOM 834 C LYS 105 -4.562 -6.349 -15.424 1.00 0.00 ATOM 835 N PRO 106 -5.073 -5.715 -16.471 1.00 0.00 ATOM 836 CA PRO 106 -5.351 -4.289 -16.563 1.00 0.00 ATOM 837 CB PRO 106 -5.531 -4.043 -18.062 1.00 0.00 ATOM 838 CG PRO 106 -6.061 -5.334 -18.592 1.00 0.00 ATOM 839 CD PRO 106 -5.282 -6.418 -17.901 1.00 0.00 ATOM 840 O PRO 106 -7.520 -4.560 -15.569 1.00 0.00 ATOM 841 C PRO 106 -6.590 -3.816 -15.814 1.00 0.00 ATOM 842 N PHE 107 -6.588 -2.527 -15.527 1.00 0.00 ATOM 843 CA PHE 107 -7.668 -1.868 -14.824 1.00 0.00 ATOM 844 CB PHE 107 -7.337 -1.737 -13.337 1.00 0.00 ATOM 845 CG PHE 107 -6.059 -0.996 -13.062 1.00 0.00 ATOM 846 CD1 PHE 107 -6.048 0.385 -12.974 1.00 0.00 ATOM 847 CD2 PHE 107 -4.868 -1.680 -12.893 1.00 0.00 ATOM 848 CE1 PHE 107 -4.873 1.066 -12.723 1.00 0.00 ATOM 849 CE2 PHE 107 -3.694 -0.999 -12.641 1.00 0.00 ATOM 850 CZ PHE 107 -3.692 0.369 -12.556 1.00 0.00 ATOM 851 O PHE 107 -7.016 0.144 -15.964 1.00 0.00 ATOM 852 C PHE 107 -7.925 -0.502 -15.445 1.00 0.00 ATOM 853 N ASN 108 -9.132 -0.015 -15.287 1.00 0.00 ATOM 854 CA ASN 108 -9.498 1.261 -15.816 1.00 0.00 ATOM 855 CB ASN 108 -10.947 1.243 -16.305 1.00 0.00 ATOM 856 CG ASN 108 -11.140 0.357 -17.520 1.00 0.00 ATOM 857 ND2 ASN 108 -12.168 -0.485 -17.479 1.00 0.00 ATOM 858 OD1 ASN 108 -10.374 0.427 -18.480 1.00 0.00 ATOM 859 O ASN 108 -9.252 2.103 -13.601 1.00 0.00 ATOM 860 C ASN 108 -9.302 2.369 -14.800 1.00 0.00 ATOM 861 N ARG 109 -9.208 3.620 -15.251 1.00 0.00 ATOM 862 CA ARG 109 -9.133 4.743 -14.321 1.00 0.00 ATOM 863 CB ARG 109 -9.115 6.069 -15.084 1.00 0.00 ATOM 864 CG ARG 109 -10.382 6.348 -15.876 1.00 0.00 ATOM 865 CD ARG 109 -10.230 7.585 -16.747 1.00 0.00 ATOM 866 NE ARG 109 -11.434 7.857 -17.527 1.00 0.00 ATOM 867 CZ ARG 109 -11.535 8.824 -18.433 1.00 0.00 ATOM 868 NH1 ARG 109 -12.671 8.998 -19.094 1.00 0.00 ATOM 869 NH2 ARG 109 -10.498 9.616 -18.676 1.00 0.00 ATOM 870 O ARG 109 -10.059 5.042 -12.167 1.00 0.00 ATOM 871 C ARG 109 -10.272 4.765 -13.322 1.00 0.00 ATOM 872 N ASN 110 -11.492 4.499 -13.763 1.00 0.00 ATOM 873 CA ASN 110 -12.579 4.558 -12.810 1.00 0.00 ATOM 874 CB ASN 110 -13.927 4.529 -13.533 1.00 0.00 ATOM 875 CG ASN 110 -14.239 5.835 -14.236 1.00 0.00 ATOM 876 ND2 ASN 110 -15.119 5.776 -15.230 1.00 0.00 ATOM 877 OD1 ASN 110 -13.696 6.884 -13.888 1.00 0.00 ATOM 878 O ASN 110 -12.944 3.605 -10.634 1.00 0.00 ATOM 879 C ASN 110 -12.518 3.429 -11.779 1.00 0.00 ATOM 880 N ASP 111 -12.001 2.273 -12.176 1.00 0.00 ATOM 881 CA ASP 111 -11.898 1.188 -11.217 1.00 0.00 ATOM 882 CB ASP 111 -11.453 -0.101 -11.911 1.00 0.00 ATOM 883 CG ASP 111 -12.535 -0.691 -12.795 1.00 0.00 ATOM 884 OD1 ASP 111 -13.704 -0.268 -12.664 1.00 0.00 ATOM 885 OD2 ASP 111 -12.215 -1.574 -13.617 1.00 0.00 ATOM 886 O ASP 111 -11.220 1.411 -8.959 1.00 0.00 ATOM 887 C ASP 111 -10.932 1.567 -10.116 1.00 0.00 ATOM 888 N LEU 112 -9.749 2.032 -10.471 1.00 0.00 ATOM 889 CA LEU 112 -8.811 2.353 -9.415 1.00 0.00 ATOM 890 CB LEU 112 -7.445 2.714 -10.003 1.00 0.00 ATOM 891 CG LEU 112 -6.345 3.061 -8.996 1.00 0.00 ATOM 892 CD1 LEU 112 -6.072 1.884 -8.071 1.00 0.00 ATOM 893 CD2 LEU 112 -5.070 3.475 -9.715 1.00 0.00 ATOM 894 O LEU 112 -9.177 3.440 -7.326 1.00 0.00 ATOM 895 C LEU 112 -9.315 3.496 -8.541 1.00 0.00 ATOM 896 N LEU 113 -9.918 4.509 -9.152 1.00 0.00 ATOM 897 CA LEU 113 -10.446 5.623 -8.370 1.00 0.00 ATOM 898 CB LEU 113 -11.049 6.686 -9.292 1.00 0.00 ATOM 899 CG LEU 113 -11.629 7.926 -8.609 1.00 0.00 ATOM 900 CD1 LEU 113 -10.552 8.657 -7.821 1.00 0.00 ATOM 901 CD2 LEU 113 -12.261 8.857 -9.631 1.00 0.00 ATOM 902 O LEU 113 -11.503 5.460 -6.211 1.00 0.00 ATOM 903 C LEU 113 -11.494 5.100 -7.376 1.00 0.00 ATOM 904 N SER 114 -12.341 4.189 -7.820 1.00 0.00 ATOM 905 CA SER 114 -13.355 3.631 -6.947 1.00 0.00 ATOM 906 CB SER 114 -14.321 2.752 -7.743 1.00 0.00 ATOM 907 OG SER 114 -13.660 1.617 -8.273 1.00 0.00 ATOM 908 O SER 114 -13.262 2.886 -4.685 1.00 0.00 ATOM 909 C SER 114 -12.775 2.826 -5.812 1.00 0.00 ATOM 910 N ARG 115 -11.779 2.004 -6.106 1.00 0.00 ATOM 911 CA ARG 115 -11.214 1.205 -5.058 1.00 0.00 ATOM 912 CB ARG 115 -10.252 0.165 -5.636 1.00 0.00 ATOM 913 CG ARG 115 -10.930 -0.914 -6.463 1.00 0.00 ATOM 914 CD ARG 115 -9.934 -1.972 -6.913 1.00 0.00 ATOM 915 NE ARG 115 -10.579 -3.044 -7.668 1.00 0.00 ATOM 916 CZ ARG 115 -11.335 -3.990 -7.122 1.00 0.00 ATOM 917 NH1 ARG 115 -11.881 -4.925 -7.888 1.00 0.00 ATOM 918 NH2 ARG 115 -11.546 -3.999 -5.815 1.00 0.00 ATOM 919 O ARG 115 -10.587 1.771 -2.841 1.00 0.00 ATOM 920 C ARG 115 -10.489 2.043 -4.023 1.00 0.00 ATOM 921 N ILE 116 -9.752 3.042 -4.470 1.00 0.00 ATOM 922 CA ILE 116 -9.002 3.874 -3.524 1.00 0.00 ATOM 923 CB ILE 116 -8.048 4.838 -4.253 1.00 0.00 ATOM 924 CG1 ILE 116 -6.933 4.058 -4.952 1.00 0.00 ATOM 925 CG2 ILE 116 -7.496 5.873 -3.285 1.00 0.00 ATOM 926 CD1 ILE 116 -6.108 4.894 -5.905 1.00 0.00 ATOM 927 O ILE 116 -9.841 4.714 -1.416 1.00 0.00 ATOM 928 C ILE 116 -9.992 4.648 -2.635 1.00 0.00 ATOM 929 N GLU 117 -11.041 5.161 -3.257 1.00 0.00 ATOM 930 CA GLU 117 -12.064 5.917 -2.522 1.00 0.00 ATOM 931 CB GLU 117 -13.127 6.455 -3.483 1.00 0.00 ATOM 932 CG GLU 117 -14.209 7.283 -2.810 1.00 0.00 ATOM 933 CD GLU 117 -15.226 7.825 -3.797 1.00 0.00 ATOM 934 OE1 GLU 117 -15.096 7.534 -5.003 1.00 0.00 ATOM 935 OE2 GLU 117 -16.153 8.541 -3.361 1.00 0.00 ATOM 936 O GLU 117 -12.889 5.463 -0.304 1.00 0.00 ATOM 937 C GLU 117 -12.709 5.041 -1.450 1.00 0.00 ATOM 938 N ILE 118 -13.081 3.815 -1.817 1.00 0.00 ATOM 939 CA ILE 118 -13.704 2.911 -0.860 1.00 0.00 ATOM 940 CB ILE 118 -14.160 1.604 -1.535 1.00 0.00 ATOM 941 CG1 ILE 118 -15.319 1.874 -2.495 1.00 0.00 ATOM 942 CG2 ILE 118 -14.524 0.562 -0.487 1.00 0.00 ATOM 943 CD1 ILE 118 -15.643 0.710 -3.407 1.00 0.00 ATOM 944 O ILE 118 -13.241 2.517 1.451 1.00 0.00 ATOM 945 C ILE 118 -12.788 2.577 0.303 1.00 0.00 ATOM 946 N HIS 119 -11.513 2.329 0.019 1.00 0.00 ATOM 947 CA HIS 119 -10.587 1.985 1.071 1.00 0.00 ATOM 948 CB HIS 119 -9.247 1.543 0.484 1.00 0.00 ATOM 949 CG HIS 119 -9.300 0.221 -0.217 1.00 0.00 ATOM 950 CD2 HIS 119 -10.311 -0.808 -0.413 1.00 0.00 ATOM 951 ND1 HIS 119 -8.222 -0.309 -0.892 1.00 0.00 ATOM 952 CE1 HIS 119 -8.574 -1.498 -1.413 1.00 0.00 ATOM 953 NE2 HIS 119 -9.824 -1.804 -1.130 1.00 0.00 ATOM 954 O HIS 119 -10.394 3.023 3.215 1.00 0.00 ATOM 955 C HIS 119 -10.414 3.207 2.007 1.00 0.00 ATOM 956 N LEU 120 -10.282 4.407 1.448 1.00 0.00 ATOM 957 CA LEU 120 -10.075 5.630 2.249 1.00 0.00 ATOM 958 CB LEU 120 -9.769 6.822 1.339 1.00 0.00 ATOM 959 CG LEU 120 -8.373 6.856 0.714 1.00 0.00 ATOM 960 CD1 LEU 120 -8.297 7.920 -0.370 1.00 0.00 ATOM 961 CD2 LEU 120 -7.314 7.108 1.778 1.00 0.00 ATOM 962 O LEU 120 -11.180 6.500 4.195 1.00 0.00 ATOM 963 C LEU 120 -11.309 5.921 3.115 1.00 0.00 ATOM 964 N ARG 121 -12.476 5.493 2.646 1.00 0.00 ATOM 965 CA ARG 121 -13.726 5.675 3.380 1.00 0.00 ATOM 966 CB ARG 121 -14.926 5.486 2.451 1.00 0.00 ATOM 967 CG ARG 121 -16.233 6.027 3.007 1.00 0.00 ATOM 968 CD ARG 121 -17.238 6.287 1.898 1.00 0.00 ATOM 969 NE ARG 121 -18.402 7.030 2.377 1.00 0.00 ATOM 970 CZ ARG 121 -19.521 7.196 1.679 1.00 0.00 ATOM 971 NH1 ARG 121 -20.528 7.888 2.196 1.00 0.00 ATOM 972 NH2 ARG 121 -19.631 6.672 0.467 1.00 0.00 ATOM 973 O ARG 121 -14.243 5.085 5.651 1.00 0.00 ATOM 974 C ARG 121 -13.809 4.706 4.556 1.00 0.00 ATOM 975 N THR 122 -13.375 3.471 4.344 1.00 0.00 ATOM 976 CA THR 122 -13.352 2.443 5.381 1.00 0.00 ATOM 977 CB THR 122 -12.819 1.104 4.837 1.00 0.00 ATOM 978 CG2 THR 122 -12.799 0.054 5.936 1.00 0.00 ATOM 979 OG1 THR 122 -13.667 0.645 3.778 1.00 0.00 ATOM 980 O THR 122 -12.444 2.251 7.616 1.00 0.00 ATOM 981 C THR 122 -12.488 2.906 6.569 1.00 0.00 TER END