PFRMAT TS TARGET T0590 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 T0590 model 1 Tue Jun 15 18:06:19 2010 MODEL 1 PARENT N/A ATOM 1 N MET 1 -18.798 1.881 -9.037 1.00999.00 ATOM 2 CA MET 1 -18.843 0.739 -8.078 1.00999.00 ATOM 3 CB MET 1 -19.995 0.939 -7.086 1.00999.00 ATOM 4 CG MET 1 -20.214 -0.218 -6.152 1.00999.00 ATOM 5 SD MET 1 -21.508 0.059 -4.954 1.00999.00 ATOM 6 CE MET 1 -20.803 1.294 -4.000 1.00999.00 ATOM 7 O MET 1 -19.743 -0.549 -9.889 1.00999.00 ATOM 8 C MET 1 -19.097 -0.557 -8.843 1.00999.00 ATOM 9 N ASN 2 -18.586 -1.667 -8.327 1.00999.00 ATOM 10 CA ASN 2 -18.732 -2.983 -8.942 1.00999.00 ATOM 11 CB ASN 2 -17.987 -3.035 -10.276 1.00999.00 ATOM 12 CG ASN 2 -18.259 -4.312 -11.045 1.00999.00 ATOM 13 ND2 ASN 2 -18.169 -4.237 -12.369 1.00999.00 ATOM 14 OD1 ASN 2 -18.546 -5.354 -10.457 1.00999.00 ATOM 15 O ASN 2 -17.167 -3.845 -7.330 1.00999.00 ATOM 16 C ASN 2 -18.223 -4.020 -7.954 1.00999.00 ATOM 17 N ALA 3 -19.015 -5.060 -7.789 1.00999.00 ATOM 18 CA ALA 3 -18.641 -6.132 -6.867 1.00999.00 ATOM 19 CB ALA 3 -19.779 -7.132 -6.726 1.00999.00 ATOM 20 O ALA 3 -16.439 -7.094 -6.561 1.00999.00 ATOM 21 C ALA 3 -17.368 -6.833 -7.351 1.00999.00 ATOM 22 N ARG 4 -17.350 -7.127 -8.659 1.00999.00 ATOM 23 CA ARG 4 -16.184 -7.719 -9.311 1.00999.00 ATOM 24 CB ARG 4 -16.437 -7.890 -10.810 1.00999.00 ATOM 25 CG ARG 4 -15.280 -8.524 -11.566 1.00999.00 ATOM 26 CD ARG 4 -15.556 -8.571 -13.059 1.00999.00 ATOM 27 NE ARG 4 -15.650 -7.234 -13.642 1.00999.00 ATOM 28 CZ ARG 4 -16.185 -6.973 -14.830 1.00999.00 ATOM 29 NH1 ARG 4 -16.226 -5.725 -15.279 1.00999.00 ATOM 30 NH2 ARG 4 -16.676 -7.958 -15.567 1.00999.00 ATOM 31 O ARG 4 -13.872 -7.419 -8.706 1.00999.00 ATOM 32 C ARG 4 -14.924 -6.886 -9.096 1.00999.00 ATOM 33 N ASP 5 -15.083 -5.538 -9.689 1.00999.00 ATOM 34 CA ASP 5 -14.042 -4.516 -9.700 1.00999.00 ATOM 35 CB ASP 5 -14.578 -3.212 -10.292 1.00999.00 ATOM 36 CG ASP 5 -14.798 -3.299 -11.790 1.00999.00 ATOM 37 OD1 ASP 5 -14.287 -4.256 -12.410 1.00999.00 ATOM 38 OD2 ASP 5 -15.481 -2.413 -12.344 1.00999.00 ATOM 39 O ASP 5 -12.287 -4.046 -8.120 1.00999.00 ATOM 40 C ASP 5 -13.487 -4.256 -8.295 1.00999.00 ATOM 41 N ASN 6 -14.386 -4.290 -7.298 1.00999.00 ATOM 42 CA ASN 6 -13.957 -4.147 -5.909 1.00999.00 ATOM 43 CB ASN 6 -15.168 -4.012 -4.983 1.00999.00 ATOM 44 CG ASN 6 -15.842 -2.659 -5.101 1.00999.00 ATOM 45 ND2 ASN 6 -17.101 -2.589 -4.684 1.00999.00 ATOM 46 OD1 ASN 6 -15.237 -1.691 -5.561 1.00999.00 ATOM 47 O ASN 6 -12.043 -5.118 -4.896 1.00999.00 ATOM 48 C ASN 6 -13.084 -5.321 -5.489 1.00999.00 ATOM 49 N LYS 7 -13.487 -6.545 -5.821 1.00999.00 ATOM 50 CA LYS 7 -12.647 -7.688 -5.504 1.00999.00 ATOM 51 CB LYS 7 -13.379 -8.995 -5.819 1.00999.00 ATOM 52 CG LYS 7 -14.527 -9.305 -4.873 1.00999.00 ATOM 53 CD LYS 7 -15.220 -10.603 -5.254 1.00999.00 ATOM 54 CE LYS 7 -16.377 -10.907 -4.317 1.00999.00 ATOM 55 NZ LYS 7 -17.093 -12.154 -4.704 1.00999.00 ATOM 56 O LYS 7 -10.263 -7.838 -5.736 1.00999.00 ATOM 57 C LYS 7 -11.334 -7.600 -6.288 1.00999.00 ATOM 58 N PHE 8 -11.409 -7.266 -7.576 1.00999.00 ATOM 59 CA PHE 8 -10.190 -7.074 -8.373 1.00999.00 ATOM 60 CB PHE 8 -10.545 -6.787 -9.834 1.00999.00 ATOM 61 CG PHE 8 -9.350 -6.591 -10.721 1.00999.00 ATOM 62 CD1 PHE 8 -8.629 -7.678 -11.183 1.00999.00 ATOM 63 CD2 PHE 8 -8.946 -5.321 -11.094 1.00999.00 ATOM 64 CE1 PHE 8 -7.529 -7.498 -12.000 1.00999.00 ATOM 65 CE2 PHE 8 -7.846 -5.142 -11.911 1.00999.00 ATOM 66 CZ PHE 8 -7.137 -6.223 -12.364 1.00999.00 ATOM 67 O PHE 8 -8.125 -6.024 -7.597 1.00999.00 ATOM 68 C PHE 8 -9.349 -5.921 -7.778 1.00999.00 ATOM 69 N ASN 9 -9.830 -4.736 -7.218 1.00999.00 ATOM 70 CA ASN 9 -9.112 -3.621 -6.601 1.00999.00 ATOM 71 CB ASN 9 -9.974 -2.356 -6.613 1.00999.00 ATOM 72 CG ASN 9 -10.091 -1.744 -7.996 1.00999.00 ATOM 73 ND2 ASN 9 -11.135 -0.953 -8.204 1.00999.00 ATOM 74 OD1 ASN 9 -9.251 -1.984 -8.863 1.00999.00 ATOM 75 O ASN 9 -7.640 -3.381 -4.722 1.00999.00 ATOM 76 C ASN 9 -8.663 -3.898 -5.170 1.00999.00 ATOM 77 N THR 10 -9.430 -4.716 -4.455 1.00999.00 ATOM 78 CA THR 10 -9.094 -5.055 -3.071 1.00999.00 ATOM 79 CB THR 10 -10.206 -4.607 -2.103 1.00999.00 ATOM 80 CG2 THR 10 -10.300 -3.090 -2.066 1.00999.00 ATOM 81 OG1 THR 10 -11.465 -5.135 -2.540 1.00999.00 ATOM 82 O THR 10 -9.824 -7.335 -3.229 1.00999.00 ATOM 83 C THR 10 -8.893 -6.564 -2.988 1.00999.00 ATOM 84 N TRP 11 -7.684 -6.984 -2.632 1.00999.00 ATOM 85 CA TRP 11 -7.385 -8.406 -2.502 1.00999.00 ATOM 86 CB TRP 11 -5.974 -8.682 -3.024 1.00999.00 ATOM 87 CG TRP 11 -5.825 -8.456 -4.497 1.00999.00 ATOM 88 CD1 TRP 11 -5.295 -7.357 -5.108 1.00999.00 ATOM 89 CD2 TRP 11 -6.210 -9.353 -5.546 1.00999.00 ATOM 90 CE2 TRP 11 -5.884 -8.731 -6.765 1.00999.00 ATOM 91 CE3 TRP 11 -6.798 -10.622 -5.573 1.00999.00 ATOM 92 NE1 TRP 11 -5.325 -7.511 -6.473 1.00999.00 ATOM 93 CZ2 TRP 11 -6.127 -9.333 -7.999 1.00999.00 ATOM 94 CZ3 TRP 11 -7.037 -11.213 -6.798 1.00999.00 ATOM 95 CH2 TRP 11 -6.703 -10.573 -7.995 1.00999.00 ATOM 96 O TRP 11 -6.650 -8.418 -0.244 1.00999.00 ATOM 97 C TRP 11 -7.514 -8.769 -1.057 1.00999.00 ATOM 98 N ASN 12 -8.814 -9.411 -0.769 1.00999.00 ATOM 99 CA ASN 12 -9.271 -9.660 0.584 1.00999.00 ATOM 100 CB ASN 12 -10.700 -10.206 0.574 1.00999.00 ATOM 101 CG ASN 12 -10.818 -11.519 -0.175 1.00999.00 ATOM 102 ND2 ASN 12 -11.227 -12.567 0.532 1.00999.00 ATOM 103 OD1 ASN 12 -10.541 -11.590 -1.371 1.00999.00 ATOM 104 O ASN 12 -8.215 -10.462 2.560 1.00999.00 ATOM 105 C ASN 12 -8.368 -10.611 1.348 1.00999.00 ATOM 106 N ASP 13 -7.747 -11.562 0.659 1.00999.00 ATOM 107 CA ASP 13 -6.875 -12.495 1.349 1.00999.00 ATOM 108 CB ASP 13 -6.975 -13.886 0.721 1.00999.00 ATOM 109 CG ASP 13 -6.485 -13.915 -0.714 1.00999.00 ATOM 110 OD1 ASP 13 -6.053 -12.855 -1.216 1.00999.00 ATOM 111 OD2 ASP 13 -6.533 -14.996 -1.338 1.00999.00 ATOM 112 O ASP 13 -4.630 -12.810 2.076 1.00999.00 ATOM 113 C ASP 13 -5.406 -12.118 1.426 1.00999.00 ATOM 114 N SER 14 -5.017 -11.028 0.769 1.00999.00 ATOM 115 CA SER 14 -3.631 -10.575 0.838 1.00999.00 ATOM 116 CB SER 14 -3.031 -10.537 -0.570 1.00999.00 ATOM 117 OG SER 14 -3.729 -9.621 -1.396 1.00999.00 ATOM 118 O SER 14 -2.403 -8.711 1.747 1.00999.00 ATOM 119 C SER 14 -3.503 -9.239 1.568 1.00999.00 ATOM 120 N ARG 15 -4.647 -8.719 2.001 1.00999.00 ATOM 121 CA ARG 15 -4.741 -7.458 2.742 1.00999.00 ATOM 122 CB ARG 15 -4.077 -7.544 4.116 1.00999.00 ATOM 123 CG ARG 15 -4.710 -8.563 5.051 1.00999.00 ATOM 124 CD ARG 15 -4.009 -8.585 6.399 1.00999.00 ATOM 125 NE ARG 15 -4.245 -7.360 7.160 1.00999.00 ATOM 126 CZ ARG 15 -3.571 -7.018 8.253 1.00999.00 ATOM 127 NH1 ARG 15 -3.855 -5.884 8.879 1.00999.00 ATOM 128 NH2 ARG 15 -2.616 -7.811 8.719 1.00999.00 ATOM 129 O ARG 15 -3.231 -5.605 2.543 1.00999.00 ATOM 130 C ARG 15 -4.082 -6.307 1.992 1.00999.00 ATOM 131 N GLY 16 -4.413 -6.157 0.716 1.00999.00 ATOM 132 CA GLY 16 -3.803 -5.105 -0.077 1.00999.00 ATOM 133 O GLY 16 -5.831 -5.219 -1.359 1.00999.00 ATOM 134 C GLY 16 -4.761 -4.637 -1.157 1.00999.00 ATOM 135 N ASN 17 -2.566 -3.240 -0.225 1.00999.00 ATOM 136 CA ASN 17 -2.036 -3.179 1.148 1.00999.00 ATOM 137 CB ASN 17 -0.627 -3.841 1.226 1.00999.00 ATOM 138 CG ASN 17 -0.513 -4.892 2.367 1.00999.00 ATOM 139 ND2 ASN 17 0.009 -6.081 2.028 1.00999.00 ATOM 140 OD1 ASN 17 -0.952 -4.655 3.516 1.00999.00 ATOM 141 O ASN 17 -2.025 -0.824 1.086 1.00999.00 ATOM 142 C ASN 17 -2.271 -1.819 1.760 1.00999.00 ATOM 143 N TYR 18 -2.635 -1.744 3.044 1.00999.00 ATOM 144 CA TYR 18 -2.699 -0.460 3.755 1.00999.00 ATOM 145 CB TYR 18 -4.140 0.050 3.808 1.00999.00 ATOM 146 CG TYR 18 -4.772 0.246 2.448 1.00999.00 ATOM 147 CD1 TYR 18 -5.293 -0.833 1.744 1.00999.00 ATOM 148 CD2 TYR 18 -4.846 1.508 1.872 1.00999.00 ATOM 149 CE1 TYR 18 -5.872 -0.664 0.501 1.00999.00 ATOM 150 CE2 TYR 18 -5.421 1.695 0.630 1.00999.00 ATOM 151 CZ TYR 18 -5.936 0.595 -0.056 1.00999.00 ATOM 152 OH TYR 18 -6.513 0.765 -1.293 1.00999.00 ATOM 153 O TYR 18 -2.251 -1.730 5.714 1.00999.00 ATOM 154 C TYR 18 -2.126 -0.654 5.142 1.00999.00 ATOM 155 N TRP 19 -5.802 -1.832 6.407 1.00999.00 ATOM 156 CA TRP 19 -6.364 -2.460 7.624 1.00999.00 ATOM 157 CB TRP 19 -7.743 -1.879 7.939 1.00999.00 ATOM 158 CG TRP 19 -7.706 -0.447 8.378 1.00999.00 ATOM 159 CD1 TRP 19 -8.060 0.646 7.640 1.00999.00 ATOM 160 CD2 TRP 19 -7.290 0.049 9.657 1.00999.00 ATOM 161 CE2 TRP 19 -7.419 1.449 9.621 1.00999.00 ATOM 162 CE3 TRP 19 -6.823 -0.556 10.827 1.00999.00 ATOM 163 NE1 TRP 19 -7.890 1.792 8.378 1.00999.00 ATOM 164 CZ2 TRP 19 -7.096 2.256 10.712 1.00999.00 ATOM 165 CZ3 TRP 19 -6.504 0.248 11.905 1.00999.00 ATOM 166 CH2 TRP 19 -6.642 1.639 11.842 1.00999.00 ATOM 167 O TRP 19 -5.731 -4.602 6.655 1.00999.00 ATOM 168 C TRP 19 -6.453 -3.993 7.456 1.00999.00 ATOM 169 N SER 20 -7.627 -4.818 7.581 1.00999.00 ATOM 170 CA SER 20 -7.817 -6.290 7.632 1.00999.00 ATOM 171 CB SER 20 -7.936 -6.764 9.083 1.00999.00 ATOM 172 OG SER 20 -8.172 -8.159 9.146 1.00999.00 ATOM 173 O SER 20 -10.066 -5.997 6.882 1.00999.00 ATOM 174 C SER 20 -9.039 -6.666 6.815 1.00999.00 ATOM 175 N ASP 21 -8.793 -7.613 5.849 1.00999.00 ATOM 176 CA ASP 21 -9.873 -8.146 5.028 1.00999.00 ATOM 177 CB ASP 21 -10.890 -8.934 5.856 1.00999.00 ATOM 178 CG ASP 21 -11.794 -9.798 5.001 1.00999.00 ATOM 179 OD1 ASP 21 -11.378 -10.168 3.884 1.00999.00 ATOM 180 OD2 ASP 21 -12.919 -10.103 5.449 1.00999.00 ATOM 181 O ASP 21 -11.763 -6.767 4.541 1.00999.00 ATOM 182 C ASP 21 -10.586 -7.039 4.281 1.00999.00 ATOM 183 N TYR 22 -9.789 -6.320 3.335 1.00999.00 ATOM 184 CA TYR 22 -10.445 -5.242 2.587 1.00999.00 ATOM 185 CB TYR 22 -9.554 -4.621 1.655 1.00999.00 ATOM 186 CG TYR 22 -8.979 -3.492 2.472 1.00999.00 ATOM 187 CD1 TYR 22 -9.782 -2.400 2.845 1.00999.00 ATOM 188 CD2 TYR 22 -7.680 -3.525 2.970 1.00999.00 ATOM 189 CE1 TYR 22 -9.325 -1.368 3.670 1.00999.00 ATOM 190 CE2 TYR 22 -7.201 -2.502 3.828 1.00999.00 ATOM 191 CZ TYR 22 -8.035 -1.474 4.140 1.00999.00 ATOM 192 OH TYR 22 -7.500 -0.420 4.945 1.00999.00 ATOM 193 O TYR 22 -11.025 -6.737 0.792 1.00999.00 ATOM 194 C TYR 22 -11.418 -5.903 1.610 1.00999.00 ATOM 195 N GLU 23 -12.695 -5.554 1.720 1.00999.00 ATOM 196 CA GLU 23 -13.725 -6.150 0.876 1.00999.00 ATOM 197 CB GLU 23 -14.903 -6.616 1.734 1.00999.00 ATOM 198 CG GLU 23 -16.001 -7.319 0.954 1.00999.00 ATOM 199 CD GLU 23 -15.536 -8.628 0.349 1.00999.00 ATOM 200 OE1 GLU 23 -14.511 -9.168 0.813 1.00999.00 ATOM 201 OE2 GLU 23 -16.199 -9.115 -0.592 1.00999.00 ATOM 202 O GLU 23 -15.086 -5.608 -1.019 1.00999.00 ATOM 203 C GLU 23 -14.245 -5.220 -0.211 1.00999.00 ATOM 204 N GLY 24 -13.710 -3.930 -0.189 1.00999.00 ATOM 205 CA GLY 24 -14.156 -2.985 -1.187 1.00999.00 ATOM 206 O GLY 24 -12.921 -1.189 -0.204 1.00999.00 ATOM 207 C GLY 24 -13.368 -1.697 -1.232 1.00999.00 ATOM 208 N SER 25 -13.172 -1.186 -2.490 1.00999.00 ATOM 209 CA SER 25 -12.458 0.059 -2.683 1.00999.00 ATOM 210 CB SER 25 -11.020 -0.238 -3.109 1.00999.00 ATOM 211 OG SER 25 -10.300 0.960 -3.344 1.00999.00 ATOM 212 O SER 25 -13.649 0.263 -4.745 1.00999.00 ATOM 213 C SER 25 -13.187 0.839 -3.761 1.00999.00 ATOM 214 N ASP 26 -13.325 2.142 -3.563 1.00999.00 ATOM 215 CA ASP 26 -13.981 2.989 -4.548 1.00999.00 ATOM 216 CB ASP 26 -15.426 3.219 -4.104 1.00999.00 ATOM 217 CG ASP 26 -16.272 3.863 -5.186 1.00999.00 ATOM 218 OD1 ASP 26 -16.132 5.085 -5.401 1.00999.00 ATOM 219 OD2 ASP 26 -17.075 3.144 -5.818 1.00999.00 ATOM 220 O ASP 26 -12.743 4.862 -3.691 1.00999.00 ATOM 221 C ASP 26 -13.219 4.290 -4.675 1.00999.00 ATOM 222 N GLU 27 -13.190 4.847 -5.891 1.00999.00 ATOM 223 CA GLU 27 -12.530 6.125 -6.108 1.00999.00 ATOM 224 CB GLU 27 -11.640 6.064 -7.350 1.00999.00 ATOM 225 CG GLU 27 -10.475 5.094 -7.234 1.00999.00 ATOM 226 CD GLU 27 -9.604 5.078 -8.474 1.00999.00 ATOM 227 OE1 GLU 27 -10.029 5.639 -9.506 1.00999.00 ATOM 228 OE2 GLU 27 -8.497 4.503 -8.414 1.00999.00 ATOM 229 O GLU 27 -14.617 7.092 -6.813 1.00999.00 ATOM 230 C GLU 27 -13.538 7.263 -6.249 1.00999.00 ATOM 231 N ASN 28 -12.932 8.435 -5.729 1.00999.00 ATOM 232 CA ASN 28 -13.796 9.605 -5.857 1.00999.00 ATOM 233 CB ASN 28 -13.306 10.735 -4.948 1.00999.00 ATOM 234 CG ASN 28 -13.496 10.423 -3.477 1.00999.00 ATOM 235 ND2 ASN 28 -12.624 10.974 -2.639 1.00999.00 ATOM 236 OD1 ASN 28 -14.414 9.696 -3.100 1.00999.00 ATOM 237 O ASN 28 -12.911 9.763 -8.061 1.00999.00 ATOM 238 C ASN 28 -13.849 10.050 -7.319 1.00999.00 ATOM 239 N GLY 29 -14.941 10.758 -7.674 1.00999.00 ATOM 240 CA GLY 29 -15.120 11.166 -9.066 1.00999.00 ATOM 241 O GLY 29 -13.441 11.676 -10.682 1.00999.00 ATOM 242 C GLY 29 -13.917 11.952 -9.582 1.00999.00 ATOM 243 N ASP 30 -13.190 12.897 -8.603 1.00999.00 ATOM 244 CA ASP 30 -12.017 13.623 -9.078 1.00999.00 ATOM 245 CB ASP 30 -11.760 14.854 -8.207 1.00999.00 ATOM 246 CG ASP 30 -12.797 15.941 -8.413 1.00999.00 ATOM 247 OD1 ASP 30 -13.537 15.872 -9.416 1.00999.00 ATOM 248 OD2 ASP 30 -12.868 16.861 -7.573 1.00999.00 ATOM 249 O ASP 30 -9.719 13.164 -9.608 1.00999.00 ATOM 250 C ASP 30 -10.757 12.757 -9.089 1.00999.00 ATOM 251 N GLY 31 -10.856 11.575 -8.504 1.00999.00 ATOM 252 CA GLY 31 -9.725 10.664 -8.477 1.00999.00 ATOM 253 O GLY 31 -7.497 10.465 -7.654 1.00999.00 ATOM 254 C GLY 31 -8.606 10.985 -7.505 1.00999.00 ATOM 255 N ILE 32 -9.148 11.882 -6.588 1.00999.00 ATOM 256 CA ILE 32 -8.122 12.261 -5.618 1.00999.00 ATOM 257 CB ILE 32 -8.309 13.711 -5.134 1.00999.00 ATOM 258 CG1 ILE 32 -8.065 14.692 -6.283 1.00999.00 ATOM 259 CG2 ILE 32 -7.408 13.997 -3.943 1.00999.00 ATOM 260 CD1 ILE 32 -8.483 16.112 -5.972 1.00999.00 ATOM 261 O ILE 32 -7.035 11.105 -3.820 1.00999.00 ATOM 262 C ILE 32 -8.085 11.313 -4.419 1.00999.00 ATOM 263 N GLY 33 -9.225 10.731 -4.067 1.00999.00 ATOM 264 CA GLY 33 -9.250 9.820 -2.930 1.00999.00 ATOM 265 O GLY 33 -10.752 8.335 -4.087 1.00999.00 ATOM 266 C GLY 33 -9.886 8.459 -3.220 1.00999.00 ATOM 267 N ASP 34 -9.433 7.445 -2.488 1.00999.00 ATOM 268 CA ASP 34 -9.976 6.093 -2.596 1.00999.00 ATOM 269 CB ASP 34 -8.930 5.153 -3.197 1.00999.00 ATOM 270 CG ASP 34 -9.497 3.787 -3.527 1.00999.00 ATOM 271 OD1 ASP 34 -10.538 3.419 -2.945 1.00999.00 ATOM 272 OD2 ASP 34 -8.899 3.084 -4.369 1.00999.00 ATOM 273 O ASP 34 -9.671 5.856 -0.222 1.00999.00 ATOM 274 C ASP 34 -10.406 5.665 -1.195 1.00999.00 ATOM 275 N SER 35 -11.698 5.114 -1.079 1.00999.00 ATOM 276 CA SER 35 -12.197 4.647 0.202 1.00999.00 ATOM 277 CB SER 35 -13.568 5.260 0.498 1.00999.00 ATOM 278 OG SER 35 -14.111 4.738 1.697 1.00999.00 ATOM 279 O SER 35 -12.717 2.512 -0.756 1.00999.00 ATOM 280 C SER 35 -12.263 3.130 0.211 1.00999.00 ATOM 281 N ALA 36 -11.809 2.536 1.314 1.00999.00 ATOM 282 CA ALA 36 -11.761 1.081 1.443 1.00999.00 ATOM 283 CB ALA 36 -10.324 0.589 1.500 1.00999.00 ATOM 284 O ALA 36 -12.421 1.067 3.751 1.00999.00 ATOM 285 C ALA 36 -12.564 0.569 2.634 1.00999.00 ATOM 286 N TYR 37 -13.386 -0.448 2.391 1.00999.00 ATOM 287 CA TYR 37 -14.204 -1.051 3.431 1.00999.00 ATOM 288 CB TYR 37 -15.572 -1.486 2.902 1.00999.00 ATOM 289 CG TYR 37 -16.494 -0.333 2.571 1.00999.00 ATOM 290 CD1 TYR 37 -16.478 0.252 1.311 1.00999.00 ATOM 291 CD2 TYR 37 -17.377 0.165 3.519 1.00999.00 ATOM 292 CE1 TYR 37 -17.317 1.305 1.000 1.00999.00 ATOM 293 CE2 TYR 37 -18.223 1.218 3.226 1.00999.00 ATOM 294 CZ TYR 37 -18.187 1.786 1.953 1.00999.00 ATOM 295 OH TYR 37 -19.023 2.835 1.645 1.00999.00 ATOM 296 O TYR 37 -13.267 -3.265 3.311 1.00999.00 ATOM 297 C TYR 37 -13.451 -2.257 3.995 1.00999.00 ATOM 298 N ALA 38 -13.004 -2.141 5.243 1.00999.00 ATOM 299 CA ALA 38 -12.290 -3.234 5.907 1.00999.00 ATOM 300 CB ALA 38 -11.020 -2.724 6.563 1.00999.00 ATOM 301 O ALA 38 -13.644 -3.401 7.933 1.00999.00 ATOM 302 C ALA 38 -13.327 -3.874 6.830 1.00999.00 ATOM 303 N VAL 39 -13.811 -5.028 6.449 1.00999.00 ATOM 304 CA VAL 39 -14.870 -5.782 7.101 1.00999.00 ATOM 305 CB VAL 39 -15.255 -7.032 6.288 1.00999.00 ATOM 306 CG1 VAL 39 -16.204 -7.915 7.087 1.00999.00 ATOM 307 CG2 VAL 39 -15.885 -6.633 4.963 1.00999.00 ATOM 308 O VAL 39 -15.266 -6.045 9.472 1.00999.00 ATOM 309 C VAL 39 -14.485 -6.203 8.525 1.00999.00 ATOM 310 N ASN 40 -13.254 -6.954 8.471 1.00999.00 ATOM 311 CA ASN 40 -12.958 -7.523 9.800 1.00999.00 ATOM 312 CB ASN 40 -11.882 -8.605 9.691 1.00999.00 ATOM 313 CG ASN 40 -12.383 -9.860 9.006 1.00999.00 ATOM 314 ND2 ASN 40 -11.465 -10.622 8.424 1.00999.00 ATOM 315 OD1 ASN 40 -13.583 -10.139 8.999 1.00999.00 ATOM 316 O ASN 40 -12.777 -6.642 12.048 1.00999.00 ATOM 317 C ASN 40 -12.599 -6.446 10.838 1.00999.00 ATOM 318 N PRO 41 -12.103 -5.309 10.403 1.00999.00 ATOM 319 CA PRO 41 -11.728 -4.246 11.359 1.00999.00 ATOM 320 CB PRO 41 -10.390 -3.773 10.800 1.00999.00 ATOM 321 CG PRO 41 -10.579 -3.919 9.329 1.00999.00 ATOM 322 CD PRO 41 -11.304 -5.272 9.203 1.00999.00 ATOM 323 O PRO 41 -12.609 -2.232 12.321 1.00999.00 ATOM 324 C PRO 41 -12.802 -3.185 11.573 1.00999.00 ATOM 325 N GLU 42 -13.938 -3.357 10.911 1.00999.00 ATOM 326 CA GLU 42 -15.065 -2.442 11.030 1.00999.00 ATOM 327 CB GLU 42 -15.775 -2.575 12.378 1.00999.00 ATOM 328 CG GLU 42 -16.375 -3.949 12.631 1.00999.00 ATOM 329 CD GLU 42 -17.138 -4.019 13.939 1.00999.00 ATOM 330 OE1 GLU 42 -17.160 -3.006 14.670 1.00999.00 ATOM 331 OE2 GLU 42 -17.712 -5.088 14.235 1.00999.00 ATOM 332 O GLU 42 -14.846 -0.166 11.761 1.00999.00 ATOM 333 C GLU 42 -14.623 -0.996 10.873 1.00999.00 ATOM 334 N ALA 43 -13.996 -0.689 9.741 1.00999.00 ATOM 335 CA ALA 43 -13.563 0.669 9.464 1.00999.00 ATOM 336 CB ALA 43 -12.312 1.052 10.241 1.00999.00 ATOM 337 O ALA 43 -13.462 -0.058 7.177 1.00999.00 ATOM 338 C ALA 43 -13.325 0.870 7.974 1.00999.00 ATOM 339 N GLY 44 -12.956 2.095 7.626 1.00999.00 ATOM 340 CA GLY 44 -12.712 2.499 6.253 1.00999.00 ATOM 341 O GLY 44 -10.905 3.867 7.005 1.00999.00 ATOM 342 C GLY 44 -11.343 3.120 6.130 1.00999.00 ATOM 343 N SER 45 -10.565 2.722 5.120 1.00999.00 ATOM 344 CA SER 45 -9.267 3.331 4.914 1.00999.00 ATOM 345 CB SER 45 -8.221 2.266 4.612 1.00999.00 ATOM 346 OG SER 45 -8.437 1.747 3.292 1.00999.00 ATOM 347 O SER 45 -10.213 4.268 2.935 1.00999.00 ATOM 348 C SER 45 -9.439 4.430 3.872 1.00999.00 ATOM 349 N MET 46 -8.727 5.540 4.031 1.00999.00 ATOM 350 CA MET 46 -8.786 6.626 3.054 1.00999.00 ATOM 351 CB MET 46 -9.262 7.919 3.717 1.00999.00 ATOM 352 CG MET 46 -9.404 9.093 2.761 1.00999.00 ATOM 353 SD MET 46 -10.065 10.566 3.562 1.00999.00 ATOM 354 CE MET 46 -8.668 11.062 4.568 1.00999.00 ATOM 355 O MET 46 -6.451 7.165 3.167 1.00999.00 ATOM 356 C MET 46 -7.398 6.827 2.455 1.00999.00 ATOM 357 N ASP 47 -7.278 6.620 1.148 1.00999.00 ATOM 358 CA ASP 47 -6.009 6.786 0.480 1.00999.00 ATOM 359 CB ASP 47 -5.687 5.514 -0.308 1.00999.00 ATOM 360 CG ASP 47 -4.295 5.536 -0.907 1.00999.00 ATOM 361 OD1 ASP 47 -3.315 5.501 -0.132 1.00999.00 ATOM 362 OD2 ASP 47 -4.182 5.586 -2.150 1.00999.00 ATOM 363 O ASP 47 -6.856 8.119 -1.331 1.00999.00 ATOM 364 C ASP 47 -5.937 7.923 -0.536 1.00999.00 ATOM 365 N TYR 48 -4.787 8.636 -0.482 1.00999.00 ATOM 366 CA TYR 48 -4.585 9.787 -1.360 1.00999.00 ATOM 367 CB TYR 48 -3.669 10.780 -0.641 1.00999.00 ATOM 368 CG TYR 48 -3.467 12.078 -1.389 1.00999.00 ATOM 369 CD1 TYR 48 -4.478 13.030 -1.446 1.00999.00 ATOM 370 CD2 TYR 48 -2.267 12.349 -2.035 1.00999.00 ATOM 371 CE1 TYR 48 -4.301 14.220 -2.128 1.00999.00 ATOM 372 CE2 TYR 48 -2.074 13.533 -2.721 1.00999.00 ATOM 373 CZ TYR 48 -3.104 14.470 -2.762 1.00999.00 ATOM 374 OH TYR 48 -2.927 15.655 -3.442 1.00999.00 ATOM 375 O TYR 48 -2.875 8.763 -2.718 1.00999.00 ATOM 376 C TYR 48 -4.010 9.250 -2.673 1.00999.00 ATOM 377 N MET 49 -4.795 9.343 -3.741 1.00999.00 ATOM 378 CA MET 49 -4.383 8.833 -5.038 1.00999.00 ATOM 379 CB MET 49 -5.516 8.981 -6.057 1.00999.00 ATOM 380 CG MET 49 -6.699 8.061 -5.806 1.00999.00 ATOM 381 SD MET 49 -6.273 6.317 -5.971 1.00999.00 ATOM 382 CE MET 49 -5.957 6.211 -7.731 1.00999.00 ATOM 383 O MET 49 -2.448 8.918 -6.489 1.00999.00 ATOM 384 C MET 49 -3.131 9.493 -5.634 1.00999.00 ATOM 385 N PRO 50 -3.221 10.886 -5.460 1.00999.00 ATOM 386 CA PRO 50 -2.044 11.562 -5.998 1.00999.00 ATOM 387 CB PRO 50 -2.251 13.028 -5.609 1.00999.00 ATOM 388 CG PRO 50 -3.730 13.176 -5.485 1.00999.00 ATOM 389 CD PRO 50 -4.232 11.886 -4.902 1.00999.00 ATOM 390 O PRO 50 0.319 11.146 -6.069 1.00999.00 ATOM 391 C PRO 50 -0.735 11.037 -5.426 1.00999.00 ATOM 392 N LEU 51 -0.802 10.464 -4.226 1.00999.00 ATOM 393 CA LEU 51 0.381 9.946 -3.537 1.00999.00 ATOM 394 CB LEU 51 0.714 10.813 -2.321 1.00999.00 ATOM 395 CG LEU 51 1.083 12.269 -2.607 1.00999.00 ATOM 396 CD1 LEU 51 1.255 13.045 -1.310 1.00999.00 ATOM 397 CD2 LEU 51 2.351 12.349 -3.444 1.00999.00 ATOM 398 O LEU 51 1.244 7.979 -2.499 1.00999.00 ATOM 399 C LEU 51 0.288 8.499 -3.061 1.00999.00 ATOM 400 N MET 52 -0.646 7.330 -3.195 1.00999.00 ATOM 401 CA MET 52 -0.832 5.947 -2.766 1.00999.00 ATOM 402 CB MET 52 0.107 5.016 -3.537 1.00999.00 ATOM 403 CG MET 52 -0.161 4.963 -5.031 1.00999.00 ATOM 404 SD MET 52 -1.795 4.308 -5.424 1.00999.00 ATOM 405 CE MET 52 -1.560 2.571 -5.060 1.00999.00 ATOM 406 O MET 52 -0.257 4.689 -0.811 1.00999.00 ATOM 407 C MET 52 -0.607 5.781 -1.274 1.00999.00 ATOM 408 N GLU 53 -0.789 6.857 -0.523 1.00999.00 ATOM 409 CA GLU 53 -0.601 6.799 0.920 1.00999.00 ATOM 410 CB GLU 53 0.308 7.937 1.389 1.00999.00 ATOM 411 CG GLU 53 0.633 7.899 2.874 1.00999.00 ATOM 412 CD GLU 53 1.574 9.011 3.292 1.00999.00 ATOM 413 OE1 GLU 53 1.688 10.006 2.545 1.00999.00 ATOM 414 OE2 GLU 53 2.197 8.890 4.367 1.00999.00 ATOM 415 O GLU 53 -2.831 7.618 1.302 1.00999.00 ATOM 416 C GLU 53 -1.925 6.859 1.668 1.00999.00 ATOM 417 N TYR 54 -2.200 5.792 2.518 1.00999.00 ATOM 418 CA TYR 54 -3.318 5.864 3.468 1.00999.00 ATOM 419 CB TYR 54 -3.707 4.475 3.954 1.00999.00 ATOM 420 CG TYR 54 -4.724 4.490 5.071 1.00999.00 ATOM 421 CD1 TYR 54 -5.846 5.299 5.033 1.00999.00 ATOM 422 CD2 TYR 54 -4.576 3.689 6.189 1.00999.00 ATOM 423 CE1 TYR 54 -6.777 5.311 6.045 1.00999.00 ATOM 424 CE2 TYR 54 -5.492 3.680 7.224 1.00999.00 ATOM 425 CZ TYR 54 -6.598 4.498 7.142 1.00999.00 ATOM 426 OH TYR 54 -7.529 4.541 8.152 1.00999.00 ATOM 427 O TYR 54 -1.988 6.463 5.339 1.00999.00 ATOM 428 C TYR 54 -2.890 6.797 4.567 1.00999.00 ATOM 429 N LEU 55 -3.461 7.976 4.626 1.00999.00 ATOM 430 CA LEU 55 -2.983 9.010 5.515 1.00999.00 ATOM 431 CB LEU 55 -3.338 10.393 4.967 1.00999.00 ATOM 432 CG LEU 55 -2.664 10.796 3.653 1.00999.00 ATOM 433 CD1 LEU 55 -3.203 12.131 3.159 1.00999.00 ATOM 434 CD2 LEU 55 -1.155 10.862 3.821 1.00999.00 ATOM 435 O LEU 55 -2.935 9.533 7.858 1.00999.00 ATOM 436 C LEU 55 -3.493 8.942 6.925 1.00999.00 ATOM 437 N HIS 56 -4.699 8.234 7.088 1.00999.00 ATOM 438 CA HIS 56 -5.338 8.285 8.394 1.00999.00 ATOM 439 CB HIS 56 -6.511 7.306 8.454 1.00999.00 ATOM 440 CG HIS 56 -7.263 7.341 9.747 1.00999.00 ATOM 441 CD2 HIS 56 -7.395 6.460 10.898 1.00999.00 ATOM 442 ND1 HIS 56 -8.081 8.392 10.104 1.00999.00 ATOM 443 CE1 HIS 56 -8.616 8.141 11.313 1.00999.00 ATOM 444 NE2 HIS 56 -8.208 6.983 11.795 1.00999.00 ATOM 445 O HIS 56 -4.773 8.218 10.725 1.00999.00 ATOM 446 C HIS 56 -4.415 7.989 9.573 1.00999.00 ATOM 447 N SER 57 -3.222 7.489 9.281 1.00999.00 ATOM 448 CA SER 57 -2.233 7.218 10.312 1.00999.00 ATOM 449 CB SER 57 -1.698 5.790 10.179 1.00999.00 ATOM 450 OG SER 57 -2.719 4.838 10.424 1.00999.00 ATOM 451 O SER 57 -0.549 8.378 9.065 1.00999.00 ATOM 452 C SER 57 -1.097 8.229 10.157 1.00999.00 ATOM 453 N SER 58 -0.742 8.922 11.232 1.00999.00 ATOM 454 CA SER 58 0.330 9.907 11.157 1.00999.00 ATOM 455 CB SER 58 0.509 10.602 12.508 1.00999.00 ATOM 456 OG SER 58 1.011 9.703 13.482 1.00999.00 ATOM 457 O SER 58 2.486 10.053 10.122 1.00999.00 ATOM 458 C SER 58 1.676 9.337 10.703 1.00999.00 ATOM 459 N PRO 59 1.901 8.046 10.943 1.00999.00 ATOM 460 CA PRO 59 3.124 7.378 10.550 1.00999.00 ATOM 461 CB PRO 59 2.909 5.926 10.983 1.00999.00 ATOM 462 CG PRO 59 1.888 6.008 12.068 1.00999.00 ATOM 463 CD PRO 59 0.964 7.130 11.687 1.00999.00 ATOM 464 O PRO 59 2.276 7.531 8.304 1.00999.00 ATOM 465 C PRO 59 3.304 7.509 9.051 1.00999.00 ATOM 466 N VAL 60 4.574 7.604 8.634 1.00999.00 ATOM 467 CA VAL 60 4.951 7.739 7.233 1.00999.00 ATOM 468 CB VAL 60 6.411 8.207 7.083 1.00999.00 ATOM 469 CG1 VAL 60 6.804 8.266 5.615 1.00999.00 ATOM 470 CG2 VAL 60 6.605 9.562 7.745 1.00999.00 ATOM 471 O VAL 60 5.447 5.405 6.771 1.00999.00 ATOM 472 C VAL 60 4.716 6.361 6.524 1.00999.00 ATOM 473 N LEU 61 3.704 6.318 5.700 1.00999.00 ATOM 474 CA LEU 61 3.322 5.058 5.082 1.00999.00 ATOM 475 CB LEU 61 1.814 4.952 4.980 1.00999.00 ATOM 476 CG LEU 61 1.099 5.035 6.345 1.00999.00 ATOM 477 CD1 LEU 61 -0.418 4.961 6.140 1.00999.00 ATOM 478 CD2 LEU 61 1.582 3.911 7.272 1.00999.00 ATOM 479 O LEU 61 3.988 6.033 2.993 1.00999.00 ATOM 480 C LEU 61 3.908 5.014 3.678 1.00999.00 ATOM 481 N PRO 62 4.310 3.818 3.228 1.00999.00 ATOM 482 CA PRO 62 4.875 3.666 1.889 1.00999.00 ATOM 483 CB PRO 62 5.437 2.243 1.882 1.00999.00 ATOM 484 CG PRO 62 4.619 1.514 2.895 1.00999.00 ATOM 485 CD PRO 62 4.292 2.516 3.967 1.00999.00 ATOM 486 O PRO 62 2.574 3.662 1.209 1.00999.00 ATOM 487 C PRO 62 3.742 3.864 0.888 1.00999.00 ATOM 488 N THR 63 4.045 4.339 -0.312 1.00999.00 ATOM 489 CA THR 63 3.019 4.462 -1.335 1.00999.00 ATOM 490 CB THR 63 2.786 5.932 -1.728 1.00999.00 ATOM 491 CG2 THR 63 2.272 6.727 -0.537 1.00999.00 ATOM 492 OG1 THR 63 4.019 6.514 -2.168 1.00999.00 ATOM 493 O THR 63 4.390 3.947 -3.237 1.00999.00 ATOM 494 C THR 63 3.424 3.631 -2.547 1.00999.00 ATOM 495 N ALA 64 2.671 2.566 -2.790 1.00999.00 ATOM 496 CA ALA 64 2.930 1.655 -3.895 1.00999.00 ATOM 497 CB ALA 64 2.168 0.353 -3.706 1.00999.00 ATOM 498 O ALA 64 1.525 2.855 -5.436 1.00999.00 ATOM 499 C ALA 64 2.565 2.222 -5.263 1.00999.00 ATOM 500 N ARG 65 3.455 2.002 -6.223 1.00999.00 ATOM 501 CA ARG 65 3.272 2.474 -7.588 1.00999.00 ATOM 502 CB ARG 65 3.268 4.004 -7.630 1.00999.00 ATOM 503 CG ARG 65 2.969 4.586 -9.001 1.00999.00 ATOM 504 CD ARG 65 2.879 6.101 -8.950 1.00999.00 ATOM 505 NE ARG 65 2.626 6.681 -10.268 1.00999.00 ATOM 506 CZ ARG 65 2.540 7.985 -10.506 1.00999.00 ATOM 507 NH1 ARG 65 2.309 8.421 -11.738 1.00999.00 ATOM 508 NH2 ARG 65 2.689 8.852 -9.514 1.00999.00 ATOM 509 O ARG 65 5.497 1.678 -7.978 1.00999.00 ATOM 510 C ARG 65 4.381 1.894 -8.452 1.00999.00 ATOM 511 N PHE 66 4.104 1.543 -9.785 1.00999.00 ATOM 512 CA PHE 66 5.108 0.974 -10.668 1.00999.00 ATOM 513 CB PHE 66 5.385 -0.484 -10.298 1.00999.00 ATOM 514 CG PHE 66 4.187 -1.381 -10.432 1.00999.00 ATOM 515 CD1 PHE 66 3.951 -2.071 -11.610 1.00999.00 ATOM 516 CD2 PHE 66 3.298 -1.536 -9.383 1.00999.00 ATOM 517 CE1 PHE 66 2.850 -2.896 -11.734 1.00999.00 ATOM 518 CE2 PHE 66 2.197 -2.362 -9.508 1.00999.00 ATOM 519 CZ PHE 66 1.971 -3.040 -10.677 1.00999.00 ATOM 520 O PHE 66 3.556 1.453 -12.442 1.00999.00 ATOM 521 C PHE 66 4.683 1.066 -12.127 1.00999.00 ATOM 522 N THR 67 5.607 0.706 -13.010 1.00999.00 ATOM 523 CA THR 67 5.373 0.713 -14.446 1.00999.00 ATOM 524 CB THR 67 5.783 2.055 -15.079 1.00999.00 ATOM 525 CG2 THR 67 7.299 2.197 -15.090 1.00999.00 ATOM 526 OG1 THR 67 5.306 2.116 -16.430 1.00999.00 ATOM 527 O THR 67 6.867 -1.164 -14.432 1.00999.00 ATOM 528 C THR 67 6.093 -0.467 -15.090 1.00999.00 ATOM 529 N SER 68 5.840 -0.688 -16.375 1.00999.00 ATOM 530 CA SER 68 6.470 -1.775 -17.080 1.00999.00 ATOM 531 CB SER 68 5.597 -3.031 -17.085 1.00999.00 ATOM 532 OG SER 68 4.388 -2.809 -17.791 1.00999.00 ATOM 533 O SER 68 6.159 -0.479 -19.074 1.00999.00 ATOM 534 C SER 68 6.778 -1.389 -18.522 1.00999.00 ATOM 535 N ASP 69 7.735 -2.083 -19.131 1.00999.00 ATOM 536 CA ASP 69 8.105 -1.802 -20.503 1.00999.00 ATOM 537 CB ASP 69 9.383 -2.577 -20.833 1.00999.00 ATOM 538 CG ASP 69 9.172 -4.078 -20.821 1.00999.00 ATOM 539 OD1 ASP 69 8.022 -4.515 -20.605 1.00999.00 ATOM 540 OD2 ASP 69 10.157 -4.817 -21.025 1.00999.00 ATOM 541 O ASP 69 7.237 -2.016 -22.744 1.00999.00 ATOM 542 C ASP 69 7.019 -2.159 -21.540 1.00999.00 ATOM 543 N ILE 70 5.865 -2.616 -21.066 1.00999.00 ATOM 544 CA ILE 70 4.771 -2.980 -21.959 1.00999.00 ATOM 545 CB ILE 70 3.699 -3.769 -21.186 1.00999.00 ATOM 546 CG1 ILE 70 4.283 -5.079 -20.652 1.00999.00 ATOM 547 CG2 ILE 70 2.478 -4.006 -22.061 1.00999.00 ATOM 548 CD1 ILE 70 3.369 -5.806 -19.690 1.00999.00 ATOM 549 O ILE 70 4.165 -0.641 -21.942 1.00999.00 ATOM 550 C ILE 70 4.301 -1.670 -22.620 1.00999.00 ATOM 551 N THR 71 4.036 -1.653 -24.030 1.00999.00 ATOM 552 CA THR 71 3.630 -0.473 -24.797 1.00999.00 ATOM 553 CB THR 71 4.653 0.028 -25.833 1.00999.00 ATOM 554 CG2 THR 71 4.098 1.221 -26.596 1.00999.00 ATOM 555 OG1 THR 71 5.855 0.429 -25.167 1.00999.00 ATOM 556 O THR 71 1.357 0.012 -25.381 1.00999.00 ATOM 557 C THR 71 2.317 -0.748 -25.523 1.00999.00 ATOM 558 N GLU 72 2.283 -1.823 -26.303 1.00999.00 ATOM 559 CA GLU 72 1.101 -2.181 -27.070 1.00999.00 ATOM 560 CB GLU 72 1.409 -3.342 -28.020 1.00999.00 ATOM 561 CG GLU 72 2.387 -2.993 -29.128 1.00999.00 ATOM 562 CD GLU 72 2.686 -4.171 -30.036 1.00999.00 ATOM 563 OE1 GLU 72 2.173 -5.276 -29.760 1.00999.00 ATOM 564 OE2 GLU 72 3.431 -3.989 -31.021 1.00999.00 ATOM 565 O GLU 72 -1.070 -3.166 -26.825 1.00999.00 ATOM 566 C GLU 72 -0.110 -2.642 -26.256 1.00999.00 ATOM 567 N GLY 73 -0.049 -2.501 -24.935 1.00999.00 ATOM 568 CA GLY 73 -1.128 -2.992 -24.089 1.00999.00 ATOM 569 O GLY 73 -1.566 -4.955 -22.770 1.00999.00 ATOM 570 C GLY 73 -0.967 -4.455 -23.728 1.00999.00 ATOM 571 N PHE 74 -0.074 -5.126 -24.438 1.00999.00 ATOM 572 CA PHE 74 0.309 -6.505 -24.202 1.00999.00 ATOM 573 CB PHE 74 -0.186 -7.401 -25.338 1.00999.00 ATOM 574 CG PHE 74 -1.682 -7.424 -25.484 1.00999.00 ATOM 575 CD1 PHE 74 -2.374 -6.284 -25.853 1.00999.00 ATOM 576 CD2 PHE 74 -2.396 -8.586 -25.253 1.00999.00 ATOM 577 CE1 PHE 74 -3.749 -6.305 -25.987 1.00999.00 ATOM 578 CE2 PHE 74 -3.771 -8.608 -25.385 1.00999.00 ATOM 579 CZ PHE 74 -4.449 -7.473 -25.752 1.00999.00 ATOM 580 O PHE 74 2.538 -5.808 -24.656 1.00999.00 ATOM 581 C PHE 74 1.818 -6.585 -24.032 1.00999.00 ATOM 582 N ALA 75 2.093 -7.757 -23.309 1.00999.00 ATOM 583 CA ALA 75 3.516 -8.013 -23.052 1.00999.00 ATOM 584 CB ALA 75 3.840 -7.884 -21.572 1.00999.00 ATOM 585 O ALA 75 3.234 -10.411 -23.331 1.00999.00 ATOM 586 C ALA 75 3.926 -9.403 -23.549 1.00999.00 ATOM 587 N PRO 76 5.133 -9.425 -24.135 1.00999.00 ATOM 588 CA PRO 76 5.739 -10.670 -24.583 1.00999.00 ATOM 589 CB PRO 76 6.798 -10.223 -25.592 1.00999.00 ATOM 590 CG PRO 76 7.218 -8.871 -25.121 1.00999.00 ATOM 591 CD PRO 76 5.983 -8.224 -24.560 1.00999.00 ATOM 592 O PRO 76 6.705 -10.931 -22.393 1.00999.00 ATOM 593 C PRO 76 6.357 -11.471 -23.444 1.00999.00 ATOM 594 N LEU 77 6.475 -12.776 -23.664 1.00999.00 ATOM 595 CA LEU 77 7.038 -13.691 -22.684 1.00999.00 ATOM 596 CB LEU 77 6.990 -15.119 -23.200 1.00999.00 ATOM 597 CG LEU 77 5.606 -15.728 -23.447 1.00999.00 ATOM 598 CD1 LEU 77 5.765 -17.149 -23.971 1.00999.00 ATOM 599 CD2 LEU 77 4.805 -15.726 -22.158 1.00999.00 ATOM 600 O LEU 77 9.265 -13.015 -23.262 1.00999.00 ATOM 601 C LEU 77 8.481 -13.320 -22.366 1.00999.00 ATOM 602 N SER 78 9.206 -11.077 -22.401 1.00999.00 ATOM 603 CA SER 78 9.505 -10.574 -21.060 1.00999.00 ATOM 604 CB SER 78 11.015 -10.440 -20.863 1.00999.00 ATOM 605 OG SER 78 11.552 -9.428 -21.700 1.00999.00 ATOM 606 O SER 78 8.563 -8.378 -21.493 1.00999.00 ATOM 607 C SER 78 8.889 -9.233 -20.661 1.00999.00 ATOM 608 N VAL 79 8.558 -9.075 -19.413 1.00999.00 ATOM 609 CA VAL 79 7.966 -7.857 -18.885 1.00999.00 ATOM 610 CB VAL 79 6.568 -8.118 -18.294 1.00999.00 ATOM 611 CG1 VAL 79 5.983 -6.835 -17.724 1.00999.00 ATOM 612 CG2 VAL 79 5.646 -8.706 -19.349 1.00999.00 ATOM 613 O VAL 79 9.369 -7.996 -16.942 1.00999.00 ATOM 614 C VAL 79 8.935 -7.290 -17.855 1.00999.00 ATOM 615 N ARG 80 9.285 -6.030 -18.032 1.00999.00 ATOM 616 CA ARG 80 10.198 -5.353 -17.121 1.00999.00 ATOM 617 CB ARG 80 11.293 -4.581 -17.885 1.00999.00 ATOM 618 CG ARG 80 12.202 -3.723 -17.001 1.00999.00 ATOM 619 CD ARG 80 13.507 -3.362 -17.704 1.00999.00 ATOM 620 NE ARG 80 14.413 -4.507 -17.781 1.00999.00 ATOM 621 CZ ARG 80 15.505 -4.566 -18.539 1.00999.00 ATOM 622 NH1 ARG 80 15.855 -3.545 -19.308 1.00999.00 ATOM 623 NH2 ARG 80 16.264 -5.651 -18.508 1.00999.00 ATOM 624 O ARG 80 8.729 -3.515 -16.666 1.00999.00 ATOM 625 C ARG 80 9.416 -4.426 -16.199 1.00999.00 ATOM 626 N PHE 81 9.446 -4.747 -14.919 1.00999.00 ATOM 627 CA PHE 81 8.721 -3.959 -13.926 1.00999.00 ATOM 628 CB PHE 81 8.008 -4.864 -12.918 1.00999.00 ATOM 629 CG PHE 81 6.886 -5.666 -13.511 1.00999.00 ATOM 630 CD1 PHE 81 7.134 -6.884 -14.120 1.00999.00 ATOM 631 CD2 PHE 81 5.582 -5.205 -13.460 1.00999.00 ATOM 632 CE1 PHE 81 6.102 -7.623 -14.666 1.00999.00 ATOM 633 CE2 PHE 81 4.550 -5.944 -14.005 1.00999.00 ATOM 634 CZ PHE 81 4.805 -7.149 -14.607 1.00999.00 ATOM 635 O PHE 81 10.744 -3.435 -12.728 1.00999.00 ATOM 636 C PHE 81 9.690 -3.022 -13.224 1.00999.00 ATOM 637 N LYS 82 9.307 -1.752 -13.182 1.00999.00 ATOM 638 CA LYS 82 10.092 -0.719 -12.530 1.00999.00 ATOM 639 CB LYS 82 10.525 0.344 -13.540 1.00999.00 ATOM 640 CG LYS 82 11.462 -0.171 -14.620 1.00999.00 ATOM 641 CD LYS 82 11.884 0.945 -15.565 1.00999.00 ATOM 642 CE LYS 82 12.783 0.420 -16.672 1.00999.00 ATOM 643 NZ LYS 82 13.177 1.496 -17.623 1.00999.00 ATOM 644 O LYS 82 8.240 0.500 -11.624 1.00999.00 ATOM 645 C LYS 82 9.297 -0.086 -11.397 1.00999.00 ATOM 646 N ASP 83 9.812 -0.218 -10.180 1.00999.00 ATOM 647 CA ASP 83 9.162 0.352 -9.015 1.00999.00 ATOM 648 CB ASP 83 9.810 -0.169 -7.731 1.00999.00 ATOM 649 CG ASP 83 9.097 0.310 -6.483 1.00999.00 ATOM 650 OD1 ASP 83 8.201 1.169 -6.604 1.00999.00 ATOM 651 OD2 ASP 83 9.436 -0.176 -5.383 1.00999.00 ATOM 652 O ASP 83 10.279 2.472 -9.178 1.00999.00 ATOM 653 C ASP 83 9.212 1.871 -9.045 1.00999.00 ATOM 654 N PHE 84 8.055 2.678 -8.863 1.00999.00 ATOM 655 CA PHE 84 7.908 4.132 -8.779 1.00999.00 ATOM 656 CB PHE 84 7.644 4.734 -10.208 1.00999.00 ATOM 657 CG PHE 84 8.756 4.653 -11.217 1.00999.00 ATOM 658 CD1 PHE 84 10.059 4.346 -10.909 1.00999.00 ATOM 659 CD2 PHE 84 8.427 4.854 -12.542 1.00999.00 ATOM 660 CE1 PHE 84 11.017 4.292 -11.909 1.00999.00 ATOM 661 CE2 PHE 84 9.365 4.795 -13.522 1.00999.00 ATOM 662 CZ PHE 84 10.661 4.513 -13.212 1.00999.00 ATOM 663 O PHE 84 6.846 5.582 -7.207 1.00999.00 ATOM 664 C PHE 84 7.322 4.473 -7.393 1.00999.00 ATOM 665 N SER 85 7.400 3.510 -6.512 1.00999.00 ATOM 666 CA SER 85 6.821 3.693 -5.171 1.00999.00 ATOM 667 CB SER 85 6.775 2.359 -4.422 1.00999.00 ATOM 668 OG SER 85 5.923 1.436 -5.075 1.00999.00 ATOM 669 O SER 85 8.725 5.082 -4.739 1.00999.00 ATOM 670 C SER 85 7.588 4.754 -4.410 1.00999.00 ATOM 671 N GLU 86 6.950 5.285 -3.380 1.00999.00 ATOM 672 CA GLU 86 7.564 6.303 -2.551 1.00999.00 ATOM 673 CB GLU 86 6.769 7.611 -2.572 1.00999.00 ATOM 674 CG GLU 86 6.748 8.302 -3.926 1.00999.00 ATOM 675 CD GLU 86 5.959 9.596 -3.908 1.00999.00 ATOM 676 OE1 GLU 86 4.976 9.682 -3.141 1.00999.00 ATOM 677 OE2 GLU 86 6.323 10.525 -4.659 1.00999.00 ATOM 678 O GLU 86 6.668 5.367 -0.499 1.00999.00 ATOM 679 C GLU 86 7.664 5.820 -1.101 1.00999.00 ATOM 680 N ASN 87 8.882 5.925 -0.552 1.00999.00 ATOM 681 CA ASN 87 9.128 5.528 0.835 1.00999.00 ATOM 682 CB ASN 87 8.230 6.287 1.815 1.00999.00 ATOM 683 CG ASN 87 8.505 7.778 1.821 1.00999.00 ATOM 684 ND2 ASN 87 7.456 8.573 1.649 1.00999.00 ATOM 685 OD1 ASN 87 9.649 8.208 1.979 1.00999.00 ATOM 686 O ASN 87 8.471 3.595 2.088 1.00999.00 ATOM 687 C ASN 87 8.978 4.031 1.055 1.00999.00 ATOM 688 N ALA 88 9.420 3.243 0.080 1.00999.00 ATOM 689 CA ALA 88 9.330 1.792 0.183 1.00999.00 ATOM 690 CB ALA 88 8.646 1.212 -1.045 1.00999.00 ATOM 691 O ALA 88 11.674 1.638 -0.305 1.00999.00 ATOM 692 C ALA 88 10.730 1.202 0.352 1.00999.00 ATOM 693 N THR 89 10.848 0.266 1.413 1.00999.00 ATOM 694 CA THR 89 12.099 -0.394 1.755 1.00999.00 ATOM 695 CB THR 89 12.481 -0.151 3.228 1.00999.00 ATOM 696 CG2 THR 89 12.626 1.337 3.501 1.00999.00 ATOM 697 OG1 THR 89 11.457 -0.676 4.083 1.00999.00 ATOM 698 O THR 89 13.016 -2.591 1.450 1.00999.00 ATOM 699 C THR 89 12.004 -1.889 1.471 1.00999.00 ATOM 700 N SER 90 10.786 -2.376 1.253 1.00999.00 ATOM 701 CA SER 90 10.574 -3.800 0.966 1.00999.00 ATOM 702 CB SER 90 10.077 -4.541 2.210 1.00999.00 ATOM 703 OG SER 90 9.820 -5.905 1.922 1.00999.00 ATOM 704 O SER 90 8.645 -3.219 -0.322 1.00999.00 ATOM 705 C SER 90 9.607 -3.975 -0.186 1.00999.00 ATOM 706 N ARG 91 9.860 -4.977 -1.023 1.00999.00 ATOM 707 CA ARG 91 8.995 -5.242 -2.167 1.00999.00 ATOM 708 CB ARG 91 9.754 -4.932 -3.459 1.00999.00 ATOM 709 CG ARG 91 9.798 -3.455 -3.815 1.00999.00 ATOM 710 CD ARG 91 10.838 -2.718 -2.986 1.00999.00 ATOM 711 NE ARG 91 11.071 -1.363 -3.480 1.00999.00 ATOM 712 CZ ARG 91 11.837 -0.466 -2.869 1.00999.00 ATOM 713 NH1 ARG 91 11.991 0.742 -3.392 1.00999.00 ATOM 714 NH2 ARG 91 12.447 -0.780 -1.734 1.00999.00 ATOM 715 O ARG 91 9.322 -7.620 -2.200 1.00999.00 ATOM 716 C ARG 91 8.534 -6.682 -2.336 1.00999.00 ATOM 717 N LEU 92 7.241 -6.861 -2.621 1.00999.00 ATOM 718 CA LEU 92 6.686 -8.182 -2.832 1.00999.00 ATOM 719 CB LEU 92 5.844 -8.525 -1.600 1.00999.00 ATOM 720 CG LEU 92 5.148 -9.887 -1.613 1.00999.00 ATOM 721 CD1 LEU 92 6.169 -11.013 -1.641 1.00999.00 ATOM 722 CD2 LEU 92 4.232 -10.035 -0.406 1.00999.00 ATOM 723 O LEU 92 4.868 -7.439 -4.214 1.00999.00 ATOM 724 C LEU 92 5.894 -8.123 -4.133 1.00999.00 ATOM 725 N TRP 93 6.384 -8.830 -5.150 1.00999.00 ATOM 726 CA TRP 93 5.731 -8.856 -6.457 1.00999.00 ATOM 727 CB TRP 93 6.769 -8.736 -7.558 1.00999.00 ATOM 728 CG TRP 93 7.463 -7.413 -7.590 1.00999.00 ATOM 729 CD1 TRP 93 8.553 -7.042 -6.853 1.00999.00 ATOM 730 CD2 TRP 93 7.137 -6.294 -8.432 1.00999.00 ATOM 731 CE2 TRP 93 8.078 -5.275 -8.149 1.00999.00 ATOM 732 CE3 TRP 93 6.161 -6.061 -9.413 1.00999.00 ATOM 733 NE1 TRP 93 8.925 -5.763 -7.185 1.00999.00 ATOM 734 CZ2 TRP 93 8.069 -4.031 -8.816 1.00999.00 ATOM 735 CZ3 TRP 93 6.154 -4.833 -10.083 1.00999.00 ATOM 736 CH2 TRP 93 7.104 -3.832 -9.778 1.00999.00 ATOM 737 O TRP 93 5.648 -11.243 -6.709 1.00999.00 ATOM 738 C TRP 93 5.037 -10.178 -6.761 1.00999.00 ATOM 739 N MET 94 3.751 -10.091 -7.072 1.00999.00 ATOM 740 CA MET 94 2.964 -11.251 -7.449 1.00999.00 ATOM 741 CB MET 94 1.741 -11.365 -6.535 1.00999.00 ATOM 742 CG MET 94 0.881 -12.590 -6.801 1.00999.00 ATOM 743 SD MET 94 -0.540 -12.694 -5.695 1.00999.00 ATOM 744 CE MET 94 -1.567 -11.377 -6.341 1.00999.00 ATOM 745 O MET 94 1.885 -10.119 -9.254 1.00999.00 ATOM 746 C MET 94 2.604 -11.056 -8.905 1.00999.00 ATOM 747 N PHE 95 3.117 -11.937 -9.756 1.00999.00 ATOM 748 CA PHE 95 2.880 -11.836 -11.188 1.00999.00 ATOM 749 CB PHE 95 3.985 -12.555 -11.965 1.00999.00 ATOM 750 CG PHE 95 5.321 -11.870 -11.893 1.00999.00 ATOM 751 CD1 PHE 95 6.437 -12.546 -11.434 1.00999.00 ATOM 752 CD2 PHE 95 5.460 -10.552 -12.287 1.00999.00 ATOM 753 CE1 PHE 95 7.665 -11.918 -11.370 1.00999.00 ATOM 754 CE2 PHE 95 6.689 -9.922 -12.221 1.00999.00 ATOM 755 CZ PHE 95 7.788 -10.599 -11.765 1.00999.00 ATOM 756 O PHE 95 1.225 -12.291 -12.866 1.00999.00 ATOM 757 C PHE 95 1.551 -12.404 -11.683 1.00999.00 ATOM 758 N GLY 96 0.778 -12.997 -10.778 1.00999.00 ATOM 759 CA GLY 96 -0.516 -13.548 -11.148 1.00999.00 ATOM 760 O GLY 96 -1.520 -15.425 -12.233 1.00999.00 ATOM 761 C GLY 96 -0.486 -14.920 -11.793 1.00999.00 ATOM 762 N ASP 97 0.691 -15.540 -11.821 1.00999.00 ATOM 763 CA ASP 97 0.845 -16.867 -12.402 1.00999.00 ATOM 764 CB ASP 97 1.679 -16.778 -13.683 1.00999.00 ATOM 765 CG ASP 97 3.098 -16.313 -13.423 1.00999.00 ATOM 766 OD1 ASP 97 3.420 -16.011 -12.254 1.00999.00 ATOM 767 OD2 ASP 97 3.888 -16.251 -14.388 1.00999.00 ATOM 768 O ASP 97 1.976 -18.902 -11.832 1.00999.00 ATOM 769 C ASP 97 1.493 -17.846 -11.428 1.00999.00 ATOM 770 N GLY 98 1.341 -17.517 -10.124 1.00999.00 ATOM 771 CA GLY 98 1.863 -18.425 -9.118 1.00999.00 ATOM 772 O GLY 98 3.803 -18.749 -7.761 1.00999.00 ATOM 773 C GLY 98 3.298 -18.158 -8.715 1.00999.00 ATOM 774 N ASN 99 4.048 -17.184 -9.678 1.00999.00 ATOM 775 CA ASN 99 5.421 -16.846 -9.346 1.00999.00 ATOM 776 CB ASN 99 6.307 -16.918 -10.591 1.00999.00 ATOM 777 CG ASN 99 6.510 -18.340 -11.080 1.00999.00 ATOM 778 ND2 ASN 99 6.886 -18.480 -12.346 1.00999.00 ATOM 779 OD1 ASN 99 6.330 -19.296 -10.327 1.00999.00 ATOM 780 O ASN 99 4.538 -14.655 -8.910 1.00999.00 ATOM 781 C ASN 99 5.462 -15.451 -8.730 1.00999.00 ATOM 782 N THR 100 6.533 -15.160 -8.001 1.00999.00 ATOM 783 CA THR 100 6.681 -13.865 -7.357 1.00999.00 ATOM 784 CB THR 100 6.076 -13.884 -5.941 1.00999.00 ATOM 785 CG2 THR 100 4.641 -14.385 -5.983 1.00999.00 ATOM 786 OG1 THR 100 6.843 -14.758 -5.103 1.00999.00 ATOM 787 O THR 100 9.033 -14.193 -7.672 1.00999.00 ATOM 788 C THR 100 8.145 -13.452 -7.246 1.00999.00 ATOM 789 N SER 101 8.355 -12.226 -6.683 1.00999.00 ATOM 790 CA SER 101 9.715 -11.726 -6.523 1.00999.00 ATOM 791 CB SER 101 10.139 -10.975 -7.788 1.00999.00 ATOM 792 OG SER 101 11.459 -10.475 -7.664 1.00999.00 ATOM 793 O SER 101 8.769 -10.333 -4.824 1.00999.00 ATOM 794 C SER 101 9.790 -10.824 -5.301 1.00999.00 ATOM 795 N ASP 102 10.987 -10.527 -4.649 1.00999.00 ATOM 796 CA ASP 102 11.169 -9.591 -3.549 1.00999.00 ATOM 797 CB ASP 102 11.703 -10.315 -2.312 1.00999.00 ATOM 798 CG ASP 102 13.070 -10.929 -2.541 1.00999.00 ATOM 799 OD1 ASP 102 13.654 -10.694 -3.620 1.00999.00 ATOM 800 OD2 ASP 102 13.557 -11.647 -1.643 1.00999.00 ATOM 801 O ASP 102 12.361 -7.538 -3.211 1.00999.00 ATOM 802 C ASP 102 12.088 -8.456 -3.979 1.00999.00 ATOM 803 N SER 103 12.550 -8.529 -5.224 1.00999.00 ATOM 804 CA SER 103 13.422 -7.504 -5.780 1.00999.00 ATOM 805 CB SER 103 14.153 -8.044 -7.011 1.00999.00 ATOM 806 OG SER 103 13.249 -8.290 -8.074 1.00999.00 ATOM 807 O SER 103 11.460 -6.323 -6.487 1.00999.00 ATOM 808 C SER 103 12.632 -6.249 -6.132 1.00999.00 ATOM 809 N PRO 104 13.290 -5.100 -6.053 1.00999.00 ATOM 810 CA PRO 104 12.661 -3.823 -6.367 1.00999.00 ATOM 811 CB PRO 104 13.734 -2.788 -6.027 1.00999.00 ATOM 812 CG PRO 104 14.545 -3.432 -4.951 1.00999.00 ATOM 813 CD PRO 104 14.647 -4.885 -5.318 1.00999.00 ATOM 814 O PRO 104 11.158 -3.268 -8.137 1.00999.00 ATOM 815 C PRO 104 12.253 -3.720 -7.826 1.00999.00 ATOM 816 N SER 105 13.166 -4.091 -8.716 1.00999.00 ATOM 817 CA SER 105 12.921 -3.998 -10.152 1.00999.00 ATOM 818 CB SER 105 13.864 -2.977 -10.791 1.00999.00 ATOM 819 OG SER 105 13.637 -2.879 -12.186 1.00999.00 ATOM 820 O SER 105 14.106 -5.644 -11.438 1.00999.00 ATOM 821 C SER 105 13.092 -5.376 -10.796 1.00999.00 ATOM 822 N PRO 106 12.018 -6.255 -10.677 1.00999.00 ATOM 823 CA PRO 106 12.095 -7.598 -11.258 1.00999.00 ATOM 824 CB PRO 106 11.108 -8.420 -10.426 1.00999.00 ATOM 825 CG PRO 106 10.060 -7.440 -10.016 1.00999.00 ATOM 826 CD PRO 106 10.775 -6.141 -9.774 1.00999.00 ATOM 827 O PRO 106 10.994 -6.862 -13.311 1.00999.00 ATOM 828 C PRO 106 11.708 -7.717 -12.748 1.00999.00 ATOM 829 N LEU 107 12.213 -8.788 -13.357 1.00999.00 ATOM 830 CA LEU 107 11.952 -9.115 -14.753 1.00999.00 ATOM 831 CB LEU 107 13.266 -9.163 -15.536 1.00999.00 ATOM 832 CG LEU 107 14.086 -7.873 -15.565 1.00999.00 ATOM 833 CD1 LEU 107 15.417 -8.098 -16.264 1.00999.00 ATOM 834 CD2 LEU 107 13.311 -6.757 -16.249 1.00999.00 ATOM 835 O LEU 107 11.487 -11.314 -13.970 1.00999.00 ATOM 836 C LEU 107 11.208 -10.434 -14.765 1.00999.00 ATOM 837 N HIS 108 10.205 -10.574 -15.632 1.00999.00 ATOM 838 CA HIS 108 9.490 -11.847 -15.644 1.00999.00 ATOM 839 CB HIS 108 8.262 -11.736 -14.738 1.00999.00 ATOM 840 CG HIS 108 7.537 -13.029 -14.542 1.00999.00 ATOM 841 CD2 HIS 108 6.280 -13.597 -15.009 1.00999.00 ATOM 842 ND1 HIS 108 8.031 -14.048 -13.758 1.00999.00 ATOM 843 CE1 HIS 108 7.164 -15.076 -13.774 1.00999.00 ATOM 844 NE2 HIS 108 6.110 -14.811 -14.523 1.00999.00 ATOM 845 O HIS 108 8.625 -11.381 -17.852 1.00999.00 ATOM 846 C HIS 108 9.010 -12.218 -17.022 1.00999.00 ATOM 847 N THR 109 8.958 -13.567 -17.261 1.00999.00 ATOM 848 CA THR 109 8.494 -14.103 -18.523 1.00999.00 ATOM 849 CB THR 109 9.662 -14.731 -19.306 1.00999.00 ATOM 850 CG2 THR 109 10.735 -13.689 -19.586 1.00999.00 ATOM 851 OG1 THR 109 10.243 -15.790 -18.537 1.00999.00 ATOM 852 O THR 109 7.612 -16.002 -17.363 1.00999.00 ATOM 853 C THR 109 7.418 -15.126 -18.209 1.00999.00 ATOM 854 N PHE 110 6.277 -14.996 -18.877 1.00999.00 ATOM 855 CA PHE 110 5.172 -15.917 -18.678 1.00999.00 ATOM 856 CB PHE 110 3.836 -15.205 -18.889 1.00999.00 ATOM 857 CG PHE 110 3.514 -14.190 -17.830 1.00999.00 ATOM 858 CD1 PHE 110 3.864 -12.861 -17.994 1.00999.00 ATOM 859 CD2 PHE 110 2.863 -14.565 -16.668 1.00999.00 ATOM 860 CE1 PHE 110 3.569 -11.929 -17.018 1.00999.00 ATOM 861 CE2 PHE 110 2.567 -13.632 -15.692 1.00999.00 ATOM 862 CZ PHE 110 2.916 -12.318 -15.864 1.00999.00 ATOM 863 O PHE 110 5.752 -16.945 -20.771 1.00999.00 ATOM 864 C PHE 110 5.317 -17.102 -19.631 1.00999.00 ATOM 865 N PHE 111 4.960 -18.287 -19.148 1.00999.00 ATOM 866 CA PHE 111 5.069 -19.516 -19.929 1.00999.00 ATOM 867 CB PHE 111 5.469 -20.688 -19.031 1.00999.00 ATOM 868 CG PHE 111 6.860 -20.579 -18.475 1.00999.00 ATOM 869 CD1 PHE 111 7.074 -20.124 -17.186 1.00999.00 ATOM 870 CD2 PHE 111 7.956 -20.932 -19.243 1.00999.00 ATOM 871 CE1 PHE 111 8.354 -20.024 -16.675 1.00999.00 ATOM 872 CE2 PHE 111 9.237 -20.831 -18.734 1.00999.00 ATOM 873 CZ PHE 111 9.438 -20.380 -17.456 1.00999.00 ATOM 874 O PHE 111 3.784 -20.858 -21.443 1.00999.00 ATOM 875 C PHE 111 3.794 -19.897 -20.677 1.00999.00 ATOM 876 N ASN 112 2.716 -19.157 -20.444 1.00999.00 ATOM 877 CA ASN 112 1.451 -19.420 -21.121 1.00999.00 ATOM 878 CB ASN 112 0.588 -20.377 -20.295 1.00999.00 ATOM 879 CG ASN 112 1.201 -21.759 -20.176 1.00999.00 ATOM 880 ND2 ASN 112 1.850 -22.022 -19.047 1.00999.00 ATOM 881 OD1 ASN 112 1.091 -22.578 -21.089 1.00999.00 ATOM 882 O ASN 112 0.757 -17.183 -20.628 1.00999.00 ATOM 883 C ASN 112 0.694 -18.134 -21.404 1.00999.00 ATOM 884 N GLU 113 -0.032 -18.113 -22.515 1.00999.00 ATOM 885 CA GLU 113 -0.818 -16.947 -22.874 1.00999.00 ATOM 886 CB GLU 113 -1.374 -17.094 -24.292 1.00999.00 ATOM 887 CG GLU 113 -0.312 -17.099 -25.379 1.00999.00 ATOM 888 CD GLU 113 -0.903 -17.210 -26.770 1.00999.00 ATOM 889 OE1 GLU 113 -2.126 -17.443 -26.881 1.00999.00 ATOM 890 OE2 GLU 113 -0.144 -17.065 -27.752 1.00999.00 ATOM 891 O GLU 113 -2.299 -17.748 -21.165 1.00999.00 ATOM 892 C GLU 113 -1.929 -16.791 -21.846 1.00999.00 ATOM 893 N GLY 114 -2.449 -15.576 -21.730 1.00999.00 ATOM 894 CA GLY 114 -3.514 -15.322 -20.781 1.00999.00 ATOM 895 O GLY 114 -2.588 -13.127 -20.478 1.00999.00 ATOM 896 C GLY 114 -3.476 -13.929 -20.181 1.00999.00 ATOM 897 N GLU 115 -4.460 -13.638 -19.336 1.00999.00 ATOM 898 CA GLU 115 -4.552 -12.351 -18.662 1.00999.00 ATOM 899 CB GLU 115 -5.967 -11.781 -18.787 1.00999.00 ATOM 900 CG GLU 115 -6.142 -10.413 -18.149 1.00999.00 ATOM 901 CD GLU 115 -7.543 -9.863 -18.327 1.00999.00 ATOM 902 OE1 GLU 115 -8.331 -10.475 -19.079 1.00999.00 ATOM 903 OE2 GLU 115 -7.855 -8.820 -17.714 1.00999.00 ATOM 904 O GLU 115 -4.802 -13.272 -16.461 1.00999.00 ATOM 905 C GLU 115 -4.154 -12.532 -17.202 1.00999.00 ATOM 906 N TYR 116 -3.082 -11.868 -16.789 1.00999.00 ATOM 907 CA TYR 116 -2.615 -12.009 -15.418 1.00999.00 ATOM 908 CB TYR 116 -1.163 -12.490 -15.394 1.00999.00 ATOM 909 CG TYR 116 -0.975 -13.899 -15.911 1.00999.00 ATOM 910 CD1 TYR 116 -0.298 -14.135 -17.099 1.00999.00 ATOM 911 CD2 TYR 116 -1.477 -14.986 -15.209 1.00999.00 ATOM 912 CE1 TYR 116 -0.123 -15.419 -17.581 1.00999.00 ATOM 913 CE2 TYR 116 -1.311 -16.276 -15.673 1.00999.00 ATOM 914 CZ TYR 116 -0.627 -16.487 -16.869 1.00999.00 ATOM 915 OH TYR 116 -0.454 -17.766 -17.345 1.00999.00 ATOM 916 O TYR 116 -2.588 -9.626 -15.120 1.00999.00 ATOM 917 C TYR 116 -2.713 -10.735 -14.597 1.00999.00 ATOM 918 N ILE 117 -2.936 -10.893 -13.301 1.00999.00 ATOM 919 CA ILE 117 -3.011 -9.739 -12.424 1.00999.00 ATOM 920 CB ILE 117 -4.179 -9.863 -11.428 1.00999.00 ATOM 921 CG1 ILE 117 -5.510 -9.960 -12.175 1.00999.00 ATOM 922 CG2 ILE 117 -4.165 -8.704 -10.442 1.00999.00 ATOM 923 CD1 ILE 117 -6.683 -10.323 -11.290 1.00999.00 ATOM 924 O ILE 117 -1.246 -10.508 -10.992 1.00999.00 ATOM 925 C ILE 117 -1.668 -9.605 -11.716 1.00999.00 ATOM 926 N VAL 118 -0.996 -8.476 -11.925 1.00999.00 ATOM 927 CA VAL 118 0.292 -8.243 -11.299 1.00999.00 ATOM 928 CB VAL 118 1.313 -7.670 -12.299 1.00999.00 ATOM 929 CG1 VAL 118 2.631 -7.371 -11.601 1.00999.00 ATOM 930 CG2 VAL 118 1.525 -8.635 -13.456 1.00999.00 ATOM 931 O VAL 118 -0.448 -6.192 -10.314 1.00999.00 ATOM 932 C VAL 118 0.067 -7.296 -10.137 1.00999.00 ATOM 933 N SER 119 0.457 -7.726 -8.941 1.00999.00 ATOM 934 CA SER 119 0.292 -6.899 -7.750 1.00999.00 ATOM 935 CB SER 119 -0.630 -7.587 -6.742 1.00999.00 ATOM 936 OG SER 119 -1.935 -7.747 -7.273 1.00999.00 ATOM 937 O SER 119 2.414 -7.538 -6.853 1.00999.00 ATOM 938 C SER 119 1.632 -6.628 -7.081 1.00999.00 ATOM 939 N LEU 120 1.847 -5.375 -6.751 1.00999.00 ATOM 940 CA LEU 120 3.044 -4.931 -6.051 1.00999.00 ATOM 941 CB LEU 120 3.682 -3.723 -6.763 1.00999.00 ATOM 942 CG LEU 120 4.736 -2.955 -5.972 1.00999.00 ATOM 943 CD1 LEU 120 5.964 -3.786 -5.845 1.00999.00 ATOM 944 CD2 LEU 120 5.044 -1.603 -6.662 1.00999.00 ATOM 945 O LEU 120 1.893 -3.499 -4.508 1.00999.00 ATOM 946 C LEU 120 2.678 -4.439 -4.657 1.00999.00 ATOM 947 N ILE 121 3.225 -5.093 -3.641 1.00999.00 ATOM 948 CA ILE 121 2.972 -4.702 -2.263 1.00999.00 ATOM 949 CB ILE 121 2.420 -5.897 -1.465 1.00999.00 ATOM 950 CG1 ILE 121 1.126 -6.411 -2.098 1.00999.00 ATOM 951 CG2 ILE 121 2.225 -5.519 -0.004 1.00999.00 ATOM 952 CD1 ILE 121 0.629 -7.711 -1.506 1.00999.00 ATOM 953 O ILE 121 5.336 -4.836 -1.779 1.00999.00 ATOM 954 C ILE 121 4.308 -4.140 -1.746 1.00999.00 ATOM 955 N VAL 122 4.273 -2.922 -1.321 1.00999.00 ATOM 956 CA VAL 122 5.459 -2.221 -0.824 1.00999.00 ATOM 957 CB VAL 122 5.671 -0.892 -1.572 1.00999.00 ATOM 958 CG1 VAL 122 5.934 -1.147 -3.049 1.00999.00 ATOM 959 CG2 VAL 122 4.466 0.020 -1.393 1.00999.00 ATOM 960 O VAL 122 4.160 -1.866 1.143 1.00999.00 ATOM 961 C VAL 122 5.280 -1.989 0.656 1.00999.00 ATOM 962 N SER 123 6.396 -1.902 1.359 1.00999.00 ATOM 963 CA SER 123 6.340 -1.722 2.789 1.00999.00 ATOM 964 CB SER 123 6.191 -3.073 3.493 1.00999.00 ATOM 965 OG SER 123 7.345 -3.873 3.309 1.00999.00 ATOM 966 O SER 123 8.608 -0.913 2.750 1.00999.00 ATOM 967 C SER 123 7.553 -1.001 3.377 1.00999.00 ATOM 968 N ASN 124 7.361 -0.436 4.563 1.00999.00 ATOM 969 CA ASN 124 8.428 0.222 5.299 1.00999.00 ATOM 970 CB ASN 124 8.470 1.714 4.964 1.00999.00 ATOM 971 CG ASN 124 7.198 2.437 5.361 1.00999.00 ATOM 972 ND2 ASN 124 6.732 3.331 4.499 1.00999.00 ATOM 973 OD1 ASN 124 6.642 2.191 6.432 1.00999.00 ATOM 974 O ASN 124 7.253 -0.840 7.130 1.00999.00 ATOM 975 C ASN 124 8.152 -0.062 6.798 1.00999.00 ATOM 976 N GLU 125 8.924 0.473 7.614 1.00999.00 ATOM 977 CA GLU 125 8.848 0.257 9.079 1.00999.00 ATOM 978 CB GLU 125 9.957 0.982 9.835 1.00999.00 ATOM 979 CG GLU 125 11.370 0.556 9.449 1.00999.00 ATOM 980 CD GLU 125 11.541 -0.948 9.319 1.00999.00 ATOM 981 OE1 GLU 125 12.232 -1.389 8.355 1.00999.00 ATOM 982 OE2 GLU 125 10.974 -1.689 10.156 1.00999.00 ATOM 983 O GLU 125 7.141 0.247 10.764 1.00999.00 ATOM 984 C GLU 125 7.488 0.652 9.654 1.00999.00 ATOM 985 N ASN 126 6.717 1.426 8.896 1.00999.00 ATOM 986 CA ASN 126 5.412 1.904 9.355 1.00999.00 ATOM 987 CB ASN 126 5.213 3.386 9.033 1.00999.00 ATOM 988 CG ASN 126 6.116 4.288 9.851 1.00999.00 ATOM 989 ND2 ASN 126 6.667 5.311 9.210 1.00999.00 ATOM 990 OD1 ASN 126 6.313 4.064 11.046 1.00999.00 ATOM 991 O ASN 126 3.076 1.383 9.280 1.00999.00 ATOM 992 C ASN 126 4.179 1.239 8.753 1.00999.00 ATOM 993 N ASP 127 4.332 0.555 7.626 1.00999.00 ATOM 994 CA ASP 127 3.154 -0.030 7.015 1.00999.00 ATOM 995 CB ASP 127 1.978 0.940 6.895 1.00999.00 ATOM 996 CG ASP 127 0.636 0.233 6.889 1.00999.00 ATOM 997 OD1 ASP 127 0.609 -0.984 6.616 1.00999.00 ATOM 998 OD2 ASP 127 -0.387 0.898 7.157 1.00999.00 ATOM 999 O ASP 127 4.428 -0.990 5.226 1.00999.00 ATOM 1000 C ASP 127 3.320 -0.682 5.661 1.00999.00 ATOM 1001 N SER 128 1.983 -0.785 4.879 1.00999.00 ATOM 1002 CA SER 128 1.984 -1.403 3.567 1.00999.00 ATOM 1003 CB SER 128 1.609 -2.883 3.672 1.00999.00 ATOM 1004 OG SER 128 0.279 -3.041 4.131 1.00999.00 ATOM 1005 O SER 128 0.124 -0.014 3.013 1.00999.00 ATOM 1006 C SER 128 1.040 -0.714 2.601 1.00999.00 ATOM 1007 N ASP 129 1.289 -0.902 1.311 1.00999.00 ATOM 1008 CA ASP 129 0.435 -0.340 0.274 1.00999.00 ATOM 1009 CB ASP 129 0.838 1.105 -0.027 1.00999.00 ATOM 1010 CG ASP 129 -0.216 1.851 -0.819 1.00999.00 ATOM 1011 OD1 ASP 129 -1.357 1.974 -0.323 1.00999.00 ATOM 1012 OD2 ASP 129 0.096 2.313 -1.937 1.00999.00 ATOM 1013 O ASP 129 1.393 -2.189 -0.958 1.00999.00 ATOM 1014 C ASP 129 0.480 -1.357 -0.886 1.00999.00 ATOM 1015 N SER 130 -0.528 -1.243 -1.784 1.00999.00 ATOM 1016 CA SER 130 -0.553 -2.122 -2.937 1.00999.00 ATOM 1017 CB SER 130 -1.521 -3.293 -2.760 1.00999.00 ATOM 1018 OG SER 130 -1.588 -4.082 -3.935 1.00999.00 ATOM 1019 O SER 130 -1.829 -0.526 -4.207 1.00999.00 ATOM 1020 C SER 130 -1.001 -1.442 -4.215 1.00999.00 ATOM 1021 N ALA 131 -0.375 -1.950 -5.393 1.00999.00 ATOM 1022 CA ALA 131 -0.769 -1.444 -6.705 1.00999.00 ATOM 1023 CB ALA 131 0.343 -0.540 -7.215 1.00999.00 ATOM 1024 O ALA 131 -0.274 -3.641 -7.565 1.00999.00 ATOM 1025 C ALA 131 -1.012 -2.648 -7.610 1.00999.00 ATOM 1026 N SER 132 -2.047 -2.554 -8.431 1.00999.00 ATOM 1027 CA SER 132 -2.412 -3.630 -9.335 1.00999.00 ATOM 1028 CB SER 132 -3.844 -4.098 -9.060 1.00999.00 ATOM 1029 OG SER 132 -3.962 -4.640 -7.757 1.00999.00 ATOM 1030 O SER 132 -2.414 -2.088 -11.185 1.00999.00 ATOM 1031 C SER 132 -2.307 -3.243 -10.804 1.00999.00 ATOM 1032 N VAL 133 -2.030 -4.224 -11.665 1.00999.00 ATOM 1033 CA VAL 133 -1.976 -3.947 -13.080 1.00999.00 ATOM 1034 CB VAL 133 -0.585 -3.425 -13.487 1.00999.00 ATOM 1035 CG1 VAL 133 0.474 -4.490 -13.250 1.00999.00 ATOM 1036 CG2 VAL 133 -0.587 -2.984 -14.944 1.00999.00 ATOM 1037 O VAL 133 -2.234 -6.325 -13.281 1.00999.00 ATOM 1038 C VAL 133 -2.395 -5.222 -13.803 1.00999.00 ATOM 1039 N THR 134 -2.948 -5.065 -14.996 1.00999.00 ATOM 1040 CA THR 134 -3.380 -6.208 -15.783 1.00999.00 ATOM 1041 CB THR 134 -4.816 -6.060 -16.319 1.00999.00 ATOM 1042 CG2 THR 134 -5.186 -7.251 -17.189 1.00999.00 ATOM 1043 OG1 THR 134 -5.735 -5.992 -15.221 1.00999.00 ATOM 1044 O THR 134 -2.088 -5.454 -17.635 1.00999.00 ATOM 1045 C THR 134 -2.380 -6.420 -16.899 1.00999.00 ATOM 1046 N ILE 135 -1.744 -7.651 -17.072 1.00999.00 ATOM 1047 CA ILE 135 -0.754 -7.918 -18.139 1.00999.00 ATOM 1048 CB ILE 135 0.602 -8.401 -17.591 1.00999.00 ATOM 1049 CG1 ILE 135 1.190 -7.364 -16.632 1.00999.00 ATOM 1050 CG2 ILE 135 1.555 -8.718 -18.734 1.00999.00 ATOM 1051 CD1 ILE 135 1.496 -6.033 -17.283 1.00999.00 ATOM 1052 O ILE 135 -1.782 -10.020 -18.667 1.00999.00 ATOM 1053 C ILE 135 -1.369 -8.942 -19.090 1.00999.00 ATOM 1054 N ARG 136 -1.448 -8.577 -20.361 1.00999.00 ATOM 1055 CA ARG 136 -2.004 -9.462 -21.379 1.00999.00 ATOM 1056 CB ARG 136 -3.100 -9.317 -22.072 1.00999.00 ATOM 1057 CG ARG 136 -4.214 -9.868 -21.202 1.00999.00 ATOM 1058 CD ARG 136 -5.513 -10.050 -21.992 1.00999.00 ATOM 1059 NE ARG 136 -5.381 -11.175 -22.917 1.00999.00 ATOM 1060 CZ ARG 136 -6.376 -11.617 -23.687 1.00999.00 ATOM 1061 NH1 ARG 136 -7.548 -11.001 -23.625 1.00999.00 ATOM 1062 NH2 ARG 136 -6.210 -12.651 -24.522 1.00999.00 ATOM 1063 O ARG 136 -0.105 -9.503 -22.835 1.00999.00 ATOM 1064 C ARG 136 -0.890 -10.153 -22.148 1.00999.00 ATOM 1065 N ALA 137 -0.814 -11.472 -22.018 1.00999.00 ATOM 1066 CA ALA 137 0.199 -12.233 -22.731 1.00999.00 ATOM 1067 CB ALA 137 0.893 -13.204 -21.788 1.00999.00 ATOM 1068 O ALA 137 -1.375 -13.780 -23.662 1.00999.00 ATOM 1069 C ALA 137 -0.494 -12.948 -23.879 1.00999.00 TER END