PFRMAT TS TARGET T0632 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 T0632 model 4 Wed Jul 14 07:11:11 2010 MODEL 4 PARENT N/A ATOM 2 N GLY 35 6.873 7.178 8.392 1.00 0.00 ATOM 3 CA GLY 35 6.784 6.415 7.153 1.00 0.00 ATOM 4 O GLY 35 4.900 6.232 5.674 1.00 0.00 ATOM 5 C GLY 35 5.303 6.250 6.838 1.00 0.00 ATOM 6 N LEU 36 4.497 6.139 7.890 1.00 0.00 ATOM 7 CA LEU 36 3.060 5.975 7.739 1.00 0.00 ATOM 8 CB LEU 36 2.409 5.678 9.091 1.00 0.00 ATOM 9 CG LEU 36 2.740 4.324 9.722 1.00 0.00 ATOM 10 CD1 LEU 36 2.173 4.234 11.130 1.00 0.00 ATOM 11 CD2 LEU 36 2.207 3.188 8.862 1.00 0.00 ATOM 12 O LEU 36 1.493 7.113 6.318 1.00 0.00 ATOM 13 C LEU 36 2.428 7.215 7.113 1.00 0.00 ATOM 14 N LEU 37 2.944 8.388 7.467 1.00 0.00 ATOM 15 CA LEU 37 2.407 9.630 6.932 1.00 0.00 ATOM 16 CB LEU 37 2.842 10.818 7.794 1.00 0.00 ATOM 17 CG LEU 37 2.261 10.875 9.209 1.00 0.00 ATOM 18 CD1 LEU 37 2.895 12.006 10.004 1.00 0.00 ATOM 19 CD2 LEU 37 0.750 11.041 9.164 1.00 0.00 ATOM 20 O LEU 37 2.117 10.356 4.657 1.00 0.00 ATOM 21 C LEU 37 2.856 9.830 5.488 1.00 0.00 ATOM 22 N ALA 38 4.079 9.409 5.208 1.00 0.00 ATOM 23 CA ALA 38 4.650 9.501 3.873 1.00 0.00 ATOM 24 CB ALA 38 6.092 9.019 3.878 1.00 0.00 ATOM 25 O ALA 38 3.471 9.083 1.810 1.00 0.00 ATOM 26 C ALA 38 3.774 8.671 2.930 1.00 0.00 ATOM 27 N LYS 39 3.357 7.502 3.409 1.00 0.00 ATOM 28 CA LYS 39 2.516 6.592 2.635 1.00 0.00 ATOM 29 CB LYS 39 2.554 5.184 3.235 1.00 0.00 ATOM 30 CG LYS 39 1.813 4.141 2.416 1.00 0.00 ATOM 31 CD LYS 39 1.899 2.769 3.064 1.00 0.00 ATOM 32 CE LYS 39 3.311 2.210 2.989 1.00 0.00 ATOM 33 NZ LYS 39 3.379 0.806 3.483 1.00 0.00 ATOM 34 O LYS 39 0.488 7.071 1.450 1.00 0.00 ATOM 35 C LYS 39 1.065 7.050 2.539 1.00 0.00 ATOM 36 N GLN 40 0.477 7.410 3.677 1.00 0.00 ATOM 37 CA GLN 40 -0.910 7.857 3.697 1.00 0.00 ATOM 38 CB GLN 40 -1.383 8.072 5.135 1.00 0.00 ATOM 39 CG GLN 40 -1.501 6.792 5.947 1.00 0.00 ATOM 40 CD GLN 40 -2.545 5.843 5.391 1.00 0.00 ATOM 41 OE1 GLN 40 -3.708 6.212 5.228 1.00 0.00 ATOM 42 NE2 GLN 40 -2.132 4.615 5.099 1.00 0.00 ATOM 43 O GLN 40 -2.163 9.351 2.286 1.00 0.00 ATOM 44 C GLN 40 -1.108 9.144 2.893 1.00 0.00 ATOM 45 N GLU 41 -0.082 9.994 2.885 1.00 0.00 ATOM 46 CA GLU 41 -0.111 11.256 2.148 1.00 0.00 ATOM 47 CB GLU 41 1.128 12.094 2.471 1.00 0.00 ATOM 48 CG GLU 41 1.162 13.445 1.774 1.00 0.00 ATOM 49 CD GLU 41 2.388 14.258 2.142 1.00 0.00 ATOM 50 OE1 GLU 41 3.220 13.757 2.926 1.00 0.00 ATOM 51 OE2 GLU 41 2.513 15.398 1.647 1.00 0.00 ATOM 52 O GLU 41 -1.044 11.555 -0.042 1.00 0.00 ATOM 53 C GLU 41 -0.201 10.988 0.654 1.00 0.00 ATOM 54 N ARG 42 0.683 10.121 0.166 1.00 0.00 ATOM 55 CA ARG 42 0.705 9.766 -1.246 1.00 0.00 ATOM 56 CB ARG 42 1.862 8.809 -1.539 1.00 0.00 ATOM 57 CG ARG 42 1.970 8.394 -2.998 1.00 0.00 ATOM 58 CD ARG 42 3.173 7.495 -3.229 1.00 0.00 ATOM 59 NE ARG 42 3.250 7.029 -4.611 1.00 0.00 ATOM 60 CZ ARG 42 4.197 6.218 -5.075 1.00 0.00 ATOM 61 NH1 ARG 42 4.186 5.847 -6.347 1.00 0.00 ATOM 62 NH2 ARG 42 5.150 5.781 -4.264 1.00 0.00 ATOM 63 O ARG 42 -1.222 9.517 -2.662 1.00 0.00 ATOM 64 C ARG 42 -0.627 9.140 -1.650 1.00 0.00 ATOM 65 N ARG 43 -1.085 8.183 -0.849 1.00 0.00 ATOM 66 CA ARG 43 -2.341 7.488 -1.105 1.00 0.00 ATOM 67 CB ARG 43 -2.676 6.544 0.050 1.00 0.00 ATOM 68 CG ARG 43 -3.951 5.742 -0.154 1.00 0.00 ATOM 69 CD ARG 43 -4.282 4.908 1.073 1.00 0.00 ATOM 70 NE ARG 43 -4.556 5.739 2.243 1.00 0.00 ATOM 71 CZ ARG 43 -5.707 6.367 2.460 1.00 0.00 ATOM 72 NH1 ARG 43 -5.867 7.101 3.551 1.00 0.00 ATOM 73 NH2 ARG 43 -6.697 6.259 1.582 1.00 0.00 ATOM 74 O ARG 43 -4.237 8.376 -2.291 1.00 0.00 ATOM 75 C ARG 43 -3.481 8.477 -1.322 1.00 0.00 ATOM 76 N TYR 44 -3.594 9.441 -0.419 1.00 0.00 ATOM 77 CA TYR 44 -4.638 10.451 -0.515 1.00 0.00 ATOM 78 CB TYR 44 -4.628 11.354 0.719 1.00 0.00 ATOM 79 CG TYR 44 -5.714 12.405 0.719 1.00 0.00 ATOM 80 CD1 TYR 44 -7.022 12.078 1.052 1.00 0.00 ATOM 81 CD2 TYR 44 -5.428 13.723 0.384 1.00 0.00 ATOM 82 CE1 TYR 44 -8.020 13.032 1.055 1.00 0.00 ATOM 83 CE2 TYR 44 -6.415 14.690 0.381 1.00 0.00 ATOM 84 CZ TYR 44 -7.719 14.334 0.720 1.00 0.00 ATOM 85 OH TYR 44 -8.713 15.287 0.721 1.00 0.00 ATOM 86 O TYR 44 -5.432 11.955 -2.214 1.00 0.00 ATOM 87 C TYR 44 -4.483 11.300 -1.781 1.00 0.00 ATOM 88 N ALA 45 -3.293 11.286 -2.376 1.00 0.00 ATOM 89 CA ALA 45 -3.037 12.075 -3.584 1.00 0.00 ATOM 90 CB ALA 45 -1.610 12.603 -3.581 1.00 0.00 ATOM 91 O ALA 45 -2.920 11.838 -5.964 1.00 0.00 ATOM 92 C ALA 45 -3.263 11.331 -4.896 1.00 0.00 ATOM 93 N THR 46 -3.829 10.131 -4.824 1.00 0.00 ATOM 94 CA THR 46 -4.101 9.372 -6.039 1.00 0.00 ATOM 95 CB THR 46 -3.439 7.982 -5.996 1.00 0.00 ATOM 96 CG2 THR 46 -3.737 7.210 -7.273 1.00 0.00 ATOM 97 OG1 THR 46 -2.019 8.129 -5.872 1.00 0.00 ATOM 98 O THR 46 -6.279 8.487 -5.523 1.00 0.00 ATOM 99 C THR 46 -5.607 9.224 -6.243 1.00 0.00 ATOM 100 N TYR 47 -6.157 9.950 -7.230 1.00 0.00 ATOM 101 CA TYR 47 -7.580 9.940 -7.569 1.00 0.00 ATOM 102 CB TYR 47 -7.836 10.764 -8.833 1.00 0.00 ATOM 103 CG TYR 47 -9.284 10.784 -9.268 1.00 0.00 ATOM 104 CD1 TYR 47 -10.205 11.612 -8.639 1.00 0.00 ATOM 105 CD2 TYR 47 -9.726 9.975 -10.307 1.00 0.00 ATOM 106 CE1 TYR 47 -11.530 11.637 -9.030 1.00 0.00 ATOM 107 CE2 TYR 47 -11.047 9.988 -10.712 1.00 0.00 ATOM 108 CZ TYR 47 -11.950 10.828 -10.063 1.00 0.00 ATOM 109 OH TYR 47 -13.269 10.851 -10.454 1.00 0.00 ATOM 110 O TYR 47 -9.272 8.279 -7.307 1.00 0.00 ATOM 111 C TYR 47 -8.178 8.555 -7.780 1.00 0.00 ATOM 112 N LEU 48 -7.451 7.683 -8.470 1.00 0.00 ATOM 113 CA LEU 48 -7.943 6.334 -8.749 1.00 0.00 ATOM 114 CB LEU 48 -6.950 5.572 -9.630 1.00 0.00 ATOM 115 CG LEU 48 -6.803 6.069 -11.069 1.00 0.00 ATOM 116 CD1 LEU 48 -5.672 5.338 -11.777 1.00 0.00 ATOM 117 CD2 LEU 48 -8.105 5.897 -11.835 1.00 0.00 ATOM 118 O LEU 48 -9.123 4.670 -7.486 1.00 0.00 ATOM 119 C LEU 48 -8.217 5.503 -7.493 1.00 0.00 ATOM 120 N ALA 49 -7.443 5.710 -6.430 1.00 0.00 ATOM 121 CA ALA 49 -7.685 4.948 -5.208 1.00 0.00 ATOM 122 CB ALA 49 -6.638 5.284 -4.157 1.00 0.00 ATOM 123 O ALA 49 -9.819 4.368 -4.244 1.00 0.00 ATOM 124 C ALA 49 -9.102 5.258 -4.704 1.00 0.00 ATOM 125 N SER 50 -9.503 6.523 -4.816 1.00 0.00 ATOM 126 CA SER 50 -10.827 6.954 -4.384 1.00 0.00 ATOM 127 CB SER 50 -10.900 8.480 -4.319 1.00 0.00 ATOM 128 OG SER 50 -10.047 8.990 -3.309 1.00 0.00 ATOM 129 O SER 50 -13.002 6.070 -4.879 1.00 0.00 ATOM 130 C SER 50 -11.904 6.413 -5.317 1.00 0.00 ATOM 131 N LEU 51 -11.589 6.329 -6.606 1.00 0.00 ATOM 132 CA LEU 51 -12.549 5.823 -7.581 1.00 0.00 ATOM 133 CB LEU 51 -12.032 6.037 -9.005 1.00 0.00 ATOM 134 CG LEU 51 -12.957 5.588 -10.137 1.00 0.00 ATOM 135 CD1 LEU 51 -14.288 6.322 -10.068 1.00 0.00 ATOM 136 CD2 LEU 51 -12.299 5.812 -11.490 1.00 0.00 ATOM 137 O LEU 51 -13.980 3.887 -7.415 1.00 0.00 ATOM 138 C LEU 51 -12.833 4.338 -7.333 1.00 0.00 ATOM 139 N THR 52 -11.785 3.583 -7.027 1.00 0.00 ATOM 140 CA THR 52 -11.943 2.159 -6.776 1.00 0.00 ATOM 141 CB THR 52 -10.622 1.397 -6.991 1.00 0.00 ATOM 142 CG2 THR 52 -10.123 1.587 -8.415 1.00 0.00 ATOM 143 OG1 THR 52 -9.628 1.895 -6.087 1.00 0.00 ATOM 144 O THR 52 -12.787 0.768 -5.013 1.00 0.00 ATOM 145 C THR 52 -12.450 1.902 -5.360 1.00 0.00 ATOM 146 N GLN 53 -12.507 2.957 -4.548 1.00 0.00 ATOM 147 CA GLN 53 -12.966 2.810 -3.176 1.00 0.00 ATOM 148 CB GLN 53 -14.345 2.148 -3.140 1.00 0.00 ATOM 149 CG GLN 53 -15.431 2.939 -3.850 1.00 0.00 ATOM 150 CD GLN 53 -15.745 4.250 -3.157 1.00 0.00 ATOM 151 OE1 GLN 53 -16.174 4.268 -2.004 1.00 0.00 ATOM 152 NE2 GLN 53 -15.529 5.355 -3.862 1.00 0.00 ATOM 153 O GLN 53 -12.406 1.370 -1.341 1.00 0.00 ATOM 154 C GLN 53 -12.004 2.008 -2.317 1.00 0.00 ATOM 155 N ILE 54 -10.726 2.044 -2.676 1.00 0.00 ATOM 156 CA ILE 54 -9.702 1.312 -1.943 1.00 0.00 ATOM 157 CB ILE 54 -8.463 1.044 -2.818 1.00 0.00 ATOM 158 CG1 ILE 54 -8.831 0.140 -3.997 1.00 0.00 ATOM 159 CG2 ILE 54 -7.337 0.455 -1.982 1.00 0.00 ATOM 160 CD1 ILE 54 -7.744 0.031 -5.044 1.00 0.00 ATOM 161 O ILE 54 -9.148 3.270 -0.678 1.00 0.00 ATOM 162 C ILE 54 -9.281 2.051 -0.677 1.00 0.00 ATOM 163 N GLU 55 -9.070 1.305 0.400 1.00 0.00 ATOM 164 CA GLU 55 -8.661 1.904 1.665 1.00 0.00 ATOM 165 CB GLU 55 -9.821 1.893 2.662 1.00 0.00 ATOM 166 CG GLU 55 -11.018 2.725 2.231 1.00 0.00 ATOM 167 CD GLU 55 -12.140 2.704 3.251 1.00 0.00 ATOM 168 OE1 GLU 55 -12.065 1.895 4.199 1.00 0.00 ATOM 169 OE2 GLU 55 -13.092 3.498 3.102 1.00 0.00 ATOM 170 O GLU 55 -7.279 -0.028 1.982 1.00 0.00 ATOM 171 C GLU 55 -7.464 1.165 2.232 1.00 0.00 ATOM 172 N SER 56 -6.664 1.881 3.012 1.00 0.00 ATOM 173 CA SER 56 -5.499 1.290 3.645 1.00 0.00 ATOM 174 CB SER 56 -4.431 2.354 3.901 1.00 0.00 ATOM 175 OG SER 56 -3.329 1.811 4.607 1.00 0.00 ATOM 176 O SER 56 -6.610 1.265 5.765 1.00 0.00 ATOM 177 C SER 56 -5.965 0.630 4.933 1.00 0.00 ATOM 178 N GLN 57 -5.637 -0.645 5.094 1.00 0.00 ATOM 179 CA GLN 57 -6.032 -1.384 6.286 1.00 0.00 ATOM 180 CB GLN 57 -6.571 -2.765 5.907 1.00 0.00 ATOM 181 CG GLN 57 -7.077 -3.580 7.086 1.00 0.00 ATOM 182 CD GLN 57 -7.660 -4.914 6.664 1.00 0.00 ATOM 183 OE1 GLN 57 -7.733 -5.223 5.475 1.00 0.00 ATOM 184 NE2 GLN 57 -8.077 -5.712 7.641 1.00 0.00 ATOM 185 O GLN 57 -4.982 -1.186 8.439 1.00 0.00 ATOM 186 C GLN 57 -4.866 -1.527 7.259 1.00 0.00 ATOM 187 N GLU 58 -3.742 -2.028 6.760 1.00 0.00 ATOM 188 CA GLU 58 -2.559 -2.224 7.587 1.00 0.00 ATOM 189 CB GLU 58 -2.274 -3.716 7.771 1.00 0.00 ATOM 190 CG GLU 58 -3.373 -4.472 8.497 1.00 0.00 ATOM 191 CD GLU 58 -3.452 -4.115 9.969 1.00 0.00 ATOM 192 OE1 GLU 58 -2.447 -3.613 10.511 1.00 0.00 ATOM 193 OE2 GLU 58 -4.520 -4.340 10.578 1.00 0.00 ATOM 194 O GLU 58 -1.178 -1.519 5.755 1.00 0.00 ATOM 195 C GLU 58 -1.352 -1.528 6.974 1.00 0.00 ATOM 196 N ARG 59 -0.524 -0.939 7.825 1.00 0.00 ATOM 197 CA ARG 59 0.674 -0.257 7.369 1.00 0.00 ATOM 198 CB ARG 59 0.407 1.241 7.204 1.00 0.00 ATOM 199 CG ARG 59 -0.612 1.574 6.126 1.00 0.00 ATOM 200 CD ARG 59 -0.836 3.074 6.025 1.00 0.00 ATOM 201 NE ARG 59 -1.374 3.632 7.262 1.00 0.00 ATOM 202 CZ ARG 59 -2.663 3.618 7.590 1.00 0.00 ATOM 203 NH1 ARG 59 -3.059 4.150 8.738 1.00 0.00 ATOM 204 NH2 ARG 59 -3.550 3.074 6.769 1.00 0.00 ATOM 205 O ARG 59 1.758 -0.090 9.499 1.00 0.00 ATOM 206 C ARG 59 1.821 -0.482 8.333 1.00 0.00 ATOM 207 N GLU 60 2.868 -1.121 7.835 1.00 0.00 ATOM 208 CA GLU 60 4.053 -1.383 8.628 1.00 0.00 ATOM 209 CB GLU 60 3.963 -2.759 9.289 1.00 0.00 ATOM 210 CG GLU 60 2.820 -2.900 10.280 1.00 0.00 ATOM 211 CD GLU 60 3.040 -2.091 11.543 1.00 0.00 ATOM 212 OE1 GLU 60 4.207 -1.746 11.832 1.00 0.00 ATOM 213 OE2 GLU 60 2.049 -1.800 12.245 1.00 0.00 ATOM 214 O GLU 60 5.085 -1.218 6.485 1.00 0.00 ATOM 215 C GLU 60 5.241 -1.269 7.703 1.00 0.00 ATOM 216 N ASP 61 6.449 -1.191 8.271 1.00 0.00 ATOM 217 CA ASP 61 7.643 -1.087 7.440 1.00 0.00 ATOM 218 CB ASP 61 8.894 -0.969 8.312 1.00 0.00 ATOM 219 CG ASP 61 10.154 -0.747 7.498 1.00 0.00 ATOM 220 OD1 ASP 61 10.089 -0.875 6.257 1.00 0.00 ATOM 221 OD2 ASP 61 11.204 -0.445 8.100 1.00 0.00 ATOM 222 O ASP 61 7.992 -3.414 6.959 1.00 0.00 ATOM 223 C ASP 61 7.759 -2.291 6.509 1.00 0.00 ATOM 224 N GLY 62 7.581 -2.048 5.212 1.00 0.00 ATOM 225 CA GLY 62 7.692 -3.115 4.232 1.00 0.00 ATOM 226 O GLY 62 6.496 -4.926 3.232 1.00 0.00 ATOM 227 C GLY 62 6.453 -3.966 4.003 1.00 0.00 ATOM 228 N ARG 63 5.351 -3.642 4.669 1.00 0.00 ATOM 229 CA ARG 63 4.132 -4.417 4.480 1.00 0.00 ATOM 230 CB ARG 63 4.025 -5.513 5.541 1.00 0.00 ATOM 231 CG ARG 63 2.794 -6.394 5.401 1.00 0.00 ATOM 232 CD ARG 63 2.947 -7.686 6.187 1.00 0.00 ATOM 233 NE ARG 63 1.939 -8.676 5.814 1.00 0.00 ATOM 234 CZ ARG 63 1.756 -9.829 6.448 1.00 0.00 ATOM 235 NH1 ARG 63 0.814 -10.668 6.037 1.00 0.00 ATOM 236 NH2 ARG 63 2.513 -10.141 7.492 1.00 0.00 ATOM 237 O ARG 63 2.638 -2.876 5.528 1.00 0.00 ATOM 238 C ARG 63 2.910 -3.532 4.524 1.00 0.00 ATOM 239 N PHE 64 2.174 -3.528 3.419 1.00 0.00 ATOM 240 CA PHE 64 0.975 -2.718 3.286 1.00 0.00 ATOM 241 CB PHE 64 1.208 -1.576 2.295 1.00 0.00 ATOM 242 CG PHE 64 0.016 -0.682 2.109 1.00 0.00 ATOM 243 CD1 PHE 64 -0.580 -0.063 3.194 1.00 0.00 ATOM 244 CD2 PHE 64 -0.512 -0.460 0.849 1.00 0.00 ATOM 245 CE1 PHE 64 -1.677 0.759 3.023 1.00 0.00 ATOM 246 CE2 PHE 64 -1.609 0.363 0.678 1.00 0.00 ATOM 247 CZ PHE 64 -2.192 0.970 1.759 1.00 0.00 ATOM 248 O PHE 64 -0.052 -4.416 1.940 1.00 0.00 ATOM 249 C PHE 64 -0.194 -3.582 2.840 1.00 0.00 ATOM 250 N GLU 65 -1.346 -3.386 3.472 1.00 0.00 ATOM 251 CA GLU 65 -2.541 -4.143 3.122 1.00 0.00 ATOM 252 CB GLU 65 -2.923 -5.094 4.257 1.00 0.00 ATOM 253 CG GLU 65 -1.939 -6.231 4.474 1.00 0.00 ATOM 254 CD GLU 65 -2.229 -7.023 5.733 1.00 0.00 ATOM 255 OE1 GLU 65 -3.417 -7.313 5.991 1.00 0.00 ATOM 256 OE2 GLU 65 -1.272 -7.353 6.463 1.00 0.00 ATOM 257 O GLU 65 -3.983 -2.286 3.600 1.00 0.00 ATOM 258 C GLU 65 -3.678 -3.176 2.812 1.00 0.00 ATOM 259 N VAL 66 -4.285 -3.347 1.640 1.00 0.00 ATOM 260 CA VAL 66 -5.378 -2.488 1.214 1.00 0.00 ATOM 261 CB VAL 66 -5.053 -1.779 -0.115 1.00 0.00 ATOM 262 CG1 VAL 66 -3.823 -0.898 0.039 1.00 0.00 ATOM 263 CG2 VAL 66 -4.848 -2.798 -1.225 1.00 0.00 ATOM 264 O VAL 66 -6.594 -4.545 0.961 1.00 0.00 ATOM 265 C VAL 66 -6.650 -3.318 1.087 1.00 0.00 ATOM 266 N ARG 67 -7.795 -2.651 1.153 1.00 0.00 ATOM 267 CA ARG 67 -9.075 -3.332 1.014 1.00 0.00 ATOM 268 CB ARG 67 -9.748 -3.489 2.380 1.00 0.00 ATOM 269 CG ARG 67 -10.192 -2.178 3.007 1.00 0.00 ATOM 270 CD ARG 67 -10.792 -2.402 4.386 1.00 0.00 ATOM 271 NE ARG 67 -11.301 -1.162 4.969 1.00 0.00 ATOM 272 CZ ARG 67 -11.740 -1.050 6.218 1.00 0.00 ATOM 273 NH1 ARG 67 -12.185 0.118 6.662 1.00 0.00 ATOM 274 NH2 ARG 67 -11.732 -2.105 7.021 1.00 0.00 ATOM 275 O ARG 67 -9.714 -1.334 -0.153 1.00 0.00 ATOM 276 C ARG 67 -9.937 -2.529 0.052 1.00 0.00 ATOM 277 N LEU 68 -10.929 -3.192 -0.530 1.00 0.00 ATOM 278 CA LEU 68 -11.819 -2.557 -1.491 1.00 0.00 ATOM 279 CB LEU 68 -11.149 -2.470 -2.863 1.00 0.00 ATOM 280 CG LEU 68 -11.976 -1.828 -3.980 1.00 0.00 ATOM 281 CD1 LEU 68 -12.228 -0.356 -3.686 1.00 0.00 ATOM 282 CD2 LEU 68 -11.281 -1.986 -5.324 1.00 0.00 ATOM 283 O LEU 68 -13.122 -4.576 -1.623 1.00 0.00 ATOM 284 C LEU 68 -13.127 -3.344 -1.570 1.00 0.00 ATOM 285 N PRO 69 -14.270 -2.638 -1.555 1.00 0.00 ATOM 286 CA PRO 69 -15.560 -3.323 -1.636 1.00 0.00 ATOM 287 CB PRO 69 -16.548 -2.332 -1.014 1.00 0.00 ATOM 288 CG PRO 69 -16.039 -0.991 -1.430 1.00 0.00 ATOM 289 CD PRO 69 -14.550 -1.030 -1.230 1.00 0.00 ATOM 290 O PRO 69 -15.303 -3.086 -4.019 1.00 0.00 ATOM 291 C PRO 69 -15.907 -3.633 -3.090 1.00 0.00 ATOM 292 N ILE 70 -16.872 -4.523 -3.283 1.00 0.00 ATOM 293 CA ILE 70 -17.318 -4.876 -4.622 1.00 0.00 ATOM 294 CB ILE 70 -18.300 -6.062 -4.595 1.00 0.00 ATOM 295 CG1 ILE 70 -18.485 -6.633 -6.003 1.00 0.00 ATOM 296 CG2 ILE 70 -19.623 -5.644 -3.973 1.00 0.00 ATOM 297 CD1 ILE 70 -17.283 -7.396 -6.515 1.00 0.00 ATOM 298 O ILE 70 -18.451 -2.758 -4.523 1.00 0.00 ATOM 299 C ILE 70 -17.953 -3.626 -5.242 1.00 0.00 ATOM 300 N GLY 71 -17.921 -3.538 -6.568 1.00 0.00 ATOM 301 CA GLY 71 -18.498 -2.412 -7.303 1.00 0.00 ATOM 302 O GLY 71 -17.787 -3.207 -9.444 1.00 0.00 ATOM 303 C GLY 71 -18.742 -2.933 -8.711 1.00 0.00 ATOM 304 N PRO 72 -20.012 -3.081 -9.087 1.00 0.00 ATOM 305 CA PRO 72 -20.354 -3.585 -10.412 1.00 0.00 ATOM 306 CB PRO 72 -21.874 -3.431 -10.485 1.00 0.00 ATOM 307 CG PRO 72 -22.329 -3.529 -9.068 1.00 0.00 ATOM 308 CD PRO 72 -21.287 -2.824 -8.246 1.00 0.00 ATOM 309 O PRO 72 -19.353 -3.339 -12.570 1.00 0.00 ATOM 310 C PRO 72 -19.667 -2.794 -11.515 1.00 0.00 ATOM 311 N LEU 73 -19.422 -1.512 -11.262 1.00 0.00 ATOM 312 CA LEU 73 -18.782 -0.645 -12.245 1.00 0.00 ATOM 313 CB LEU 73 -18.720 0.795 -11.730 1.00 0.00 ATOM 314 CG LEU 73 -20.058 1.522 -11.591 1.00 0.00 ATOM 315 CD1 LEU 73 -19.865 2.878 -10.927 1.00 0.00 ATOM 316 CD2 LEU 73 -20.725 1.688 -12.948 1.00 0.00 ATOM 317 O LEU 73 -16.831 -0.617 -13.646 1.00 0.00 ATOM 318 C LEU 73 -17.371 -1.077 -12.639 1.00 0.00 ATOM 319 N VAL 74 -16.760 -1.957 -11.854 1.00 0.00 ATOM 320 CA VAL 74 -15.409 -2.398 -12.163 1.00 0.00 ATOM 321 CB VAL 74 -14.441 -2.108 -11.002 1.00 0.00 ATOM 322 CG1 VAL 74 -14.311 -0.609 -10.779 1.00 0.00 ATOM 323 CG2 VAL 74 -14.908 -2.802 -9.732 1.00 0.00 ATOM 324 O VAL 74 -14.302 -4.508 -12.454 1.00 0.00 ATOM 325 C VAL 74 -15.359 -3.886 -12.501 1.00 0.00 ATOM 326 N ASN 75 -16.505 -4.448 -12.867 1.00 0.00 ATOM 327 CA ASN 75 -16.579 -5.869 -13.177 1.00 0.00 ATOM 328 CB ASN 75 -17.830 -6.490 -12.553 1.00 0.00 ATOM 329 CG ASN 75 -17.782 -6.501 -11.038 1.00 0.00 ATOM 330 ND2 ASN 75 -18.948 -6.588 -10.410 1.00 0.00 ATOM 331 OD1 ASN 75 -16.707 -6.434 -10.443 1.00 0.00 ATOM 332 O ASN 75 -16.734 -5.312 -15.512 1.00 0.00 ATOM 333 C ASN 75 -16.563 -6.189 -14.665 1.00 0.00 ATOM 334 N ASN 76 -16.329 -7.461 -14.974 1.00 0.00 ATOM 335 CA ASN 76 -16.359 -7.918 -16.348 1.00 0.00 ATOM 336 CB ASN 76 -15.174 -8.844 -16.631 1.00 0.00 ATOM 337 CG ASN 76 -15.224 -10.120 -15.815 1.00 0.00 ATOM 338 ND2 ASN 76 -14.067 -10.745 -15.623 1.00 0.00 ATOM 339 OD1 ASN 76 -16.290 -10.538 -15.363 1.00 0.00 ATOM 340 O ASN 76 -18.569 -8.459 -15.616 1.00 0.00 ATOM 341 C ASN 76 -17.729 -8.589 -16.499 1.00 0.00 ATOM 342 N PRO 77 -17.953 -9.298 -17.600 1.00 0.00 ATOM 343 CA PRO 77 -19.245 -9.937 -17.873 1.00 0.00 ATOM 344 CB PRO 77 -18.942 -10.914 -19.012 1.00 0.00 ATOM 345 CG PRO 77 -17.822 -10.276 -19.762 1.00 0.00 ATOM 346 CD PRO 77 -16.916 -9.673 -18.725 1.00 0.00 ATOM 347 O PRO 77 -21.150 -10.537 -16.541 1.00 0.00 ATOM 348 C PRO 77 -19.952 -10.724 -16.760 1.00 0.00 ATOM 349 N LEU 78 -19.231 -11.594 -16.059 1.00 0.00 ATOM 350 CA LEU 78 -19.839 -12.414 -15.012 1.00 0.00 ATOM 351 CB LEU 78 -19.015 -13.683 -14.778 1.00 0.00 ATOM 352 CG LEU 78 -18.937 -14.665 -15.949 1.00 0.00 ATOM 353 CD1 LEU 78 -17.996 -15.814 -15.625 1.00 0.00 ATOM 354 CD2 LEU 78 -20.319 -15.196 -16.299 1.00 0.00 ATOM 355 O LEU 78 -20.473 -12.376 -12.699 1.00 0.00 ATOM 356 C LEU 78 -20.028 -11.739 -13.656 1.00 0.00 ATOM 357 N ASN 79 -19.693 -10.459 -13.561 1.00 0.00 ATOM 358 CA ASN 79 -19.844 -9.775 -12.294 1.00 0.00 ATOM 359 CB ASN 79 -21.091 -10.273 -11.561 1.00 0.00 ATOM 360 CG ASN 79 -22.372 -9.966 -12.315 1.00 0.00 ATOM 361 ND2 ASN 79 -23.200 -10.986 -12.509 1.00 0.00 ATOM 362 OD1 ASN 79 -22.610 -8.827 -12.714 1.00 0.00 ATOM 363 O ASN 79 -18.688 -9.620 -10.207 1.00 0.00 ATOM 364 C ASN 79 -18.628 -9.925 -11.397 1.00 0.00 ATOM 365 N MET 80 -17.523 -10.408 -11.955 1.00 0.00 ATOM 366 CA MET 80 -16.300 -10.562 -11.176 1.00 0.00 ATOM 367 CB MET 80 -15.576 -11.851 -11.564 1.00 0.00 ATOM 368 CG MET 80 -15.028 -11.853 -12.984 1.00 0.00 ATOM 369 SD MET 80 -14.039 -13.317 -13.346 1.00 0.00 ATOM 370 CE MET 80 -12.524 -12.926 -12.472 1.00 0.00 ATOM 371 O MET 80 -15.602 -8.708 -12.513 1.00 0.00 ATOM 372 C MET 80 -15.471 -9.312 -11.448 1.00 0.00 ATOM 373 N VAL 81 -14.631 -8.912 -10.501 1.00 0.00 ATOM 374 CA VAL 81 -13.792 -7.747 -10.736 1.00 0.00 ATOM 375 CB VAL 81 -12.961 -7.390 -9.490 1.00 0.00 ATOM 376 CG1 VAL 81 -13.872 -7.040 -8.324 1.00 0.00 ATOM 377 CG2 VAL 81 -12.035 -8.538 -9.121 1.00 0.00 ATOM 378 O VAL 81 -12.539 -9.250 -12.114 1.00 0.00 ATOM 379 C VAL 81 -12.925 -8.090 -11.938 1.00 0.00 ATOM 380 N HIS 82 -12.623 -7.090 -12.760 1.00 0.00 ATOM 381 CA HIS 82 -11.790 -7.301 -13.942 1.00 0.00 ATOM 382 CB HIS 82 -11.855 -6.084 -14.868 1.00 0.00 ATOM 383 CG HIS 82 -11.242 -6.316 -16.214 1.00 0.00 ATOM 384 CD2 HIS 82 -11.746 -6.596 -17.550 1.00 0.00 ATOM 385 ND1 HIS 82 -9.880 -6.296 -16.424 1.00 0.00 ATOM 386 CE1 HIS 82 -9.635 -6.535 -17.724 1.00 0.00 ATOM 387 NE2 HIS 82 -10.750 -6.716 -18.406 1.00 0.00 ATOM 388 O HIS 82 -9.905 -6.927 -12.519 1.00 0.00 ATOM 389 C HIS 82 -10.372 -7.575 -13.449 1.00 0.00 ATOM 390 N GLY 83 -9.696 -8.537 -14.066 1.00 0.00 ATOM 391 CA GLY 83 -8.340 -8.902 -13.663 1.00 0.00 ATOM 392 O GLY 83 -6.548 -7.623 -12.719 1.00 0.00 ATOM 393 C GLY 83 -7.420 -7.687 -13.582 1.00 0.00 ATOM 394 N GLY 84 -7.612 -6.730 -14.486 1.00 0.00 ATOM 395 CA GLY 84 -6.786 -5.532 -14.476 1.00 0.00 ATOM 396 O GLY 84 -6.085 -3.979 -12.785 1.00 0.00 ATOM 397 C GLY 84 -7.005 -4.659 -13.249 1.00 0.00 ATOM 398 N ILE 85 -8.230 -4.651 -12.728 1.00 0.00 ATOM 399 CA ILE 85 -8.527 -3.854 -11.540 1.00 0.00 ATOM 400 CB ILE 85 -10.046 -3.718 -11.317 1.00 0.00 ATOM 401 CG1 ILE 85 -10.685 -2.941 -12.469 1.00 0.00 ATOM 402 CG2 ILE 85 -10.330 -3.072 -9.970 1.00 0.00 ATOM 403 CD1 ILE 85 -10.045 -1.596 -12.728 1.00 0.00 ATOM 404 O ILE 85 -7.253 -3.819 -9.508 1.00 0.00 ATOM 405 C ILE 85 -7.852 -4.501 -10.342 1.00 0.00 ATOM 406 N THR 86 -7.945 -5.825 -10.274 1.00 0.00 ATOM 407 CA THR 86 -7.297 -6.592 -9.214 1.00 0.00 ATOM 408 CB THR 86 -7.536 -8.103 -9.382 1.00 0.00 ATOM 409 CG2 THR 86 -6.822 -8.880 -8.288 1.00 0.00 ATOM 410 OG1 THR 86 -8.940 -8.380 -9.299 1.00 0.00 ATOM 411 O THR 86 -5.163 -6.095 -8.180 1.00 0.00 ATOM 412 C THR 86 -5.788 -6.271 -9.229 1.00 0.00 ATOM 413 N ALA 87 -5.212 -6.190 -10.427 1.00 0.00 ATOM 414 CA ALA 87 -3.784 -5.889 -10.572 1.00 0.00 ATOM 415 CB ALA 87 -3.337 -6.123 -12.007 1.00 0.00 ATOM 416 O ALA 87 -2.368 -4.177 -9.682 1.00 0.00 ATOM 417 C ALA 87 -3.462 -4.463 -10.161 1.00 0.00 ATOM 418 N THR 88 -4.420 -3.563 -10.367 1.00 0.00 ATOM 419 CA THR 88 -4.230 -2.159 -10.024 1.00 0.00 ATOM 420 CB THR 88 -5.439 -1.306 -10.449 1.00 0.00 ATOM 421 CG2 THR 88 -5.260 0.135 -9.995 1.00 0.00 ATOM 422 OG1 THR 88 -5.563 -1.324 -11.876 1.00 0.00 ATOM 423 O THR 88 -3.034 -1.311 -8.134 1.00 0.00 ATOM 424 C THR 88 -3.988 -1.974 -8.528 1.00 0.00 ATOM 425 N LEU 89 -4.836 -2.576 -7.703 1.00 0.00 ATOM 426 CA LEU 89 -4.682 -2.464 -6.259 1.00 0.00 ATOM 427 CB LEU 89 -5.964 -2.902 -5.548 1.00 0.00 ATOM 428 CG LEU 89 -5.968 -2.782 -4.024 1.00 0.00 ATOM 429 CD1 LEU 89 -5.742 -1.340 -3.596 1.00 0.00 ATOM 430 CD2 LEU 89 -7.273 -3.307 -3.445 1.00 0.00 ATOM 431 O LEU 89 -2.847 -2.897 -4.778 1.00 0.00 ATOM 432 C LEU 89 -3.503 -3.287 -5.741 1.00 0.00 ATOM 433 N LEU 90 -3.224 -4.420 -6.377 1.00 0.00 ATOM 434 CA LEU 90 -2.089 -5.243 -5.964 1.00 0.00 ATOM 435 CB LEU 90 -2.062 -6.553 -6.753 1.00 0.00 ATOM 436 CG LEU 90 -1.702 -7.814 -5.963 1.00 0.00 ATOM 437 CD1 LEU 90 -2.519 -7.897 -4.682 1.00 0.00 ATOM 438 CD2 LEU 90 -1.915 -9.058 -6.808 1.00 0.00 ATOM 439 O LEU 90 0.061 -4.316 -5.340 1.00 0.00 ATOM 440 C LEU 90 -0.830 -4.388 -6.195 1.00 0.00 ATOM 441 N ASP 91 -0.784 -3.709 -7.338 1.00 0.00 ATOM 442 CA ASP 91 0.347 -2.850 -7.687 1.00 0.00 ATOM 443 CB ASP 91 0.190 -2.310 -9.111 1.00 0.00 ATOM 444 CG ASP 91 1.274 -1.318 -9.480 1.00 0.00 ATOM 445 OD1 ASP 91 2.445 -1.737 -9.605 1.00 0.00 ATOM 446 OD2 ASP 91 0.954 -0.122 -9.646 1.00 0.00 ATOM 447 O ASP 91 1.588 -1.351 -6.286 1.00 0.00 ATOM 448 C ASP 91 0.484 -1.692 -6.702 1.00 0.00 ATOM 449 N THR 92 -0.640 -1.083 -6.336 1.00 0.00 ATOM 450 CA THR 92 -0.618 0.020 -5.381 1.00 0.00 ATOM 451 CB THR 92 -2.018 0.630 -5.191 1.00 0.00 ATOM 452 CG2 THR 92 -1.976 1.753 -4.165 1.00 0.00 ATOM 453 OG1 THR 92 -2.482 1.168 -6.437 1.00 0.00 ATOM 454 O THR 92 0.755 0.136 -3.418 1.00 0.00 ATOM 455 C THR 92 -0.067 -0.505 -4.058 1.00 0.00 ATOM 456 N ALA 93 -0.530 -1.683 -3.657 1.00 0.00 ATOM 457 CA ALA 93 -0.073 -2.287 -2.414 1.00 0.00 ATOM 458 CB ALA 93 -0.815 -3.588 -2.151 1.00 0.00 ATOM 459 O ALA 93 2.147 -2.260 -1.497 1.00 0.00 ATOM 460 C ALA 93 1.439 -2.533 -2.463 1.00 0.00 ATOM 461 N MET 94 1.930 -3.038 -3.594 1.00 0.00 ATOM 462 CA MET 94 3.359 -3.297 -3.754 1.00 0.00 ATOM 463 CB MET 94 3.622 -4.083 -5.040 1.00 0.00 ATOM 464 CG MET 94 3.128 -5.520 -5.000 1.00 0.00 ATOM 465 SD MET 94 3.664 -6.479 -6.429 1.00 0.00 ATOM 466 CE MET 94 2.617 -5.796 -7.709 1.00 0.00 ATOM 467 O MET 94 5.218 -1.888 -3.204 1.00 0.00 ATOM 468 C MET 94 4.127 -1.982 -3.760 1.00 0.00 ATOM 469 N GLY 95 3.554 -0.973 -4.406 1.00 0.00 ATOM 470 CA GLY 95 4.202 0.322 -4.469 1.00 0.00 ATOM 471 O GLY 95 5.435 1.468 -2.762 1.00 0.00 ATOM 472 C GLY 95 4.373 0.944 -3.096 1.00 0.00 ATOM 473 N GLN 96 3.314 0.901 -2.297 1.00 0.00 ATOM 474 CA GLN 96 3.370 1.475 -0.960 1.00 0.00 ATOM 475 CB GLN 96 1.967 1.558 -0.354 1.00 0.00 ATOM 476 CG GLN 96 1.043 2.536 -1.060 1.00 0.00 ATOM 477 CD GLN 96 1.544 3.965 -0.989 1.00 0.00 ATOM 478 OE1 GLN 96 2.278 4.332 -0.072 1.00 0.00 ATOM 479 NE2 GLN 96 1.146 4.780 -1.961 1.00 0.00 ATOM 480 O GLN 96 4.983 1.246 0.804 1.00 0.00 ATOM 481 C GLN 96 4.284 0.672 -0.041 1.00 0.00 ATOM 482 N MET 97 4.292 -0.650 -0.197 1.00 0.00 ATOM 483 CA MET 97 5.154 -1.484 0.640 1.00 0.00 ATOM 484 CB MET 97 4.925 -2.965 0.337 1.00 0.00 ATOM 485 CG MET 97 3.586 -3.497 0.823 1.00 0.00 ATOM 486 SD MET 97 3.457 -5.290 0.680 1.00 0.00 ATOM 487 CE MET 97 3.294 -5.478 -1.094 1.00 0.00 ATOM 488 O MET 97 7.402 -1.023 1.350 1.00 0.00 ATOM 489 C MET 97 6.613 -1.096 0.406 1.00 0.00 ATOM 490 N VAL 98 6.972 -0.862 -0.854 1.00 0.00 ATOM 491 CA VAL 98 8.338 -0.476 -1.197 1.00 0.00 ATOM 492 CB VAL 98 8.587 -0.572 -2.713 1.00 0.00 ATOM 493 CG1 VAL 98 8.376 -1.998 -3.199 1.00 0.00 ATOM 494 CG2 VAL 98 7.681 0.391 -3.465 1.00 0.00 ATOM 495 O VAL 98 9.675 1.245 -0.165 1.00 0.00 ATOM 496 C VAL 98 8.603 0.942 -0.693 1.00 0.00 ATOM 497 N ASN 99 7.598 1.792 -0.866 1.00 0.00 ATOM 498 CA ASN 99 7.648 3.199 -0.475 1.00 0.00 ATOM 499 CB ASN 99 6.388 3.931 -0.941 1.00 0.00 ATOM 500 CG ASN 99 6.454 5.424 -0.691 1.00 0.00 ATOM 501 ND2 ASN 99 5.554 5.922 0.149 1.00 0.00 ATOM 502 OD1 ASN 99 7.305 6.119 -1.246 1.00 0.00 ATOM 503 O ASN 99 8.595 4.221 1.485 1.00 0.00 ATOM 504 C ASN 99 7.826 3.369 1.036 1.00 0.00 ATOM 505 N ARG 100 7.122 2.557 1.818 1.00 0.00 ATOM 506 CA ARG 100 7.220 2.646 3.270 1.00 0.00 ATOM 507 CB ARG 100 6.344 1.582 3.934 1.00 0.00 ATOM 508 CG ARG 100 6.399 1.592 5.452 1.00 0.00 ATOM 509 CD ARG 100 5.817 2.877 6.018 1.00 0.00 ATOM 510 NE ARG 100 5.887 2.915 7.478 1.00 0.00 ATOM 511 CZ ARG 100 6.952 3.317 8.163 1.00 0.00 ATOM 512 NH1 ARG 100 6.925 3.317 9.489 1.00 0.00 ATOM 513 NH2 ARG 100 8.042 3.718 7.522 1.00 0.00 ATOM 514 O ARG 100 8.973 2.866 4.878 1.00 0.00 ATOM 515 C ARG 100 8.660 2.499 3.752 1.00 0.00 ATOM 516 N GLN 101 9.536 1.986 2.892 1.00 0.00 ATOM 517 CA GLN 101 10.940 1.780 3.257 1.00 0.00 ATOM 518 CB GLN 101 11.426 0.413 2.768 1.00 0.00 ATOM 519 CG GLN 101 12.833 0.058 3.219 1.00 0.00 ATOM 520 CD GLN 101 13.899 0.600 2.286 1.00 0.00 ATOM 521 OE1 GLN 101 13.660 0.774 1.091 1.00 0.00 ATOM 522 NE2 GLN 101 15.079 0.868 2.831 1.00 0.00 ATOM 523 O GLN 101 13.003 3.009 3.308 1.00 0.00 ATOM 524 C GLN 101 11.925 2.831 2.739 1.00 0.00 ATOM 525 N LEU 102 11.558 3.518 1.663 1.00 0.00 ATOM 526 CA LEU 102 12.431 4.511 1.050 1.00 0.00 ATOM 527 CB LEU 102 11.835 5.007 -0.269 1.00 0.00 ATOM 528 CG LEU 102 11.673 3.963 -1.375 1.00 0.00 ATOM 529 CD1 LEU 102 10.962 4.562 -2.579 1.00 0.00 ATOM 530 CD2 LEU 102 13.026 3.400 -1.785 1.00 0.00 ATOM 531 O LEU 102 12.167 5.920 2.980 1.00 0.00 ATOM 532 C LEU 102 12.740 5.734 1.910 1.00 0.00 ATOM 533 N PRO 103 13.667 6.554 1.427 1.00 0.00 ATOM 534 CA PRO 103 14.059 7.775 2.120 1.00 0.00 ATOM 535 CB PRO 103 15.375 8.175 1.449 1.00 0.00 ATOM 536 CG PRO 103 15.849 6.927 0.783 1.00 0.00 ATOM 537 CD PRO 103 14.613 6.182 0.366 1.00 0.00 ATOM 538 O PRO 103 12.221 8.744 0.941 1.00 0.00 ATOM 539 C PRO 103 12.960 8.805 1.919 1.00 0.00 ATOM 540 N ASP 104 12.875 9.752 2.845 1.00 0.00 ATOM 541 CA ASP 104 11.863 10.801 2.815 1.00 0.00 ATOM 542 CB ASP 104 12.121 11.827 3.920 1.00 0.00 ATOM 543 CG ASP 104 11.821 11.286 5.302 1.00 0.00 ATOM 544 OD1 ASP 104 11.164 10.228 5.396 1.00 0.00 ATOM 545 OD2 ASP 104 12.242 11.918 6.294 1.00 0.00 ATOM 546 O ASP 104 10.622 11.990 1.138 1.00 0.00 ATOM 547 C ASP 104 11.723 11.575 1.505 1.00 0.00 ATOM 548 N GLY 105 12.824 11.772 0.794 1.00 0.00 ATOM 549 CA GLY 105 12.768 12.542 -0.442 1.00 0.00 ATOM 550 O GLY 105 12.619 12.233 -2.822 1.00 0.00 ATOM 551 C GLY 105 12.634 11.697 -1.709 1.00 0.00 ATOM 552 N GLN 106 12.525 10.383 -1.540 1.00 0.00 ATOM 553 CA GLN 106 12.396 9.477 -2.677 1.00 0.00 ATOM 554 CB GLN 106 13.028 8.120 -2.356 1.00 0.00 ATOM 555 CG GLN 106 14.510 8.191 -2.021 1.00 0.00 ATOM 556 CD GLN 106 15.345 8.711 -3.174 1.00 0.00 ATOM 557 OE1 GLN 106 15.308 8.164 -4.276 1.00 0.00 ATOM 558 NE2 GLN 106 16.102 9.773 -2.923 1.00 0.00 ATOM 559 O GLN 106 10.017 9.392 -2.305 1.00 0.00 ATOM 560 C GLN 106 10.951 9.265 -3.104 1.00 0.00 ATOM 561 N SER 107 10.782 8.943 -4.380 1.00 0.00 ATOM 562 CA SER 107 9.477 8.682 -4.963 1.00 0.00 ATOM 563 CB SER 107 9.164 9.705 -6.057 1.00 0.00 ATOM 564 OG SER 107 9.086 11.015 -5.522 1.00 0.00 ATOM 565 O SER 107 10.614 6.769 -5.843 1.00 0.00 ATOM 566 C SER 107 9.539 7.252 -5.487 1.00 0.00 ATOM 567 N ALA 108 8.401 6.571 -5.535 1.00 0.00 ATOM 568 CA ALA 108 8.384 5.195 -6.021 1.00 0.00 ATOM 569 CB ALA 108 7.594 4.307 -5.071 1.00 0.00 ATOM 570 O ALA 108 6.843 5.805 -7.757 1.00 0.00 ATOM 571 C ALA 108 7.798 5.104 -7.422 1.00 0.00 ATOM 572 N VAL 109 8.386 4.229 -8.230 1.00 0.00 ATOM 573 CA VAL 109 7.941 4.007 -9.597 1.00 0.00 ATOM 574 CB VAL 109 8.888 4.672 -10.614 1.00 0.00 ATOM 575 CG1 VAL 109 10.299 4.125 -10.463 1.00 0.00 ATOM 576 CG2 VAL 109 8.379 4.464 -12.032 1.00 0.00 ATOM 577 O VAL 109 8.752 1.747 -9.528 1.00 0.00 ATOM 578 C VAL 109 7.835 2.506 -9.854 1.00 0.00 ATOM 579 N THR 110 6.724 2.070 -10.433 1.00 0.00 ATOM 580 CA THR 110 6.588 0.654 -10.734 1.00 0.00 ATOM 581 CB THR 110 5.109 0.232 -10.810 1.00 0.00 ATOM 582 CG2 THR 110 4.344 1.145 -11.757 1.00 0.00 ATOM 583 OG1 THR 110 5.016 -1.112 -11.294 1.00 0.00 ATOM 584 O THR 110 6.954 0.936 -13.104 1.00 0.00 ATOM 585 C THR 110 7.311 0.386 -12.059 1.00 0.00 ATOM 586 N SER 111 8.353 -0.435 -11.998 1.00 0.00 ATOM 587 CA SER 111 9.138 -0.781 -13.175 1.00 0.00 ATOM 588 CB SER 111 10.523 -1.282 -12.768 1.00 0.00 ATOM 589 OG SER 111 11.294 -1.636 -13.904 1.00 0.00 ATOM 590 O SER 111 8.302 -1.702 -15.232 1.00 0.00 ATOM 591 C SER 111 8.418 -1.832 -14.010 1.00 0.00 ATOM 592 N GLU 112 7.958 -2.881 -13.339 1.00 0.00 ATOM 593 CA GLU 112 7.229 -3.954 -14.001 1.00 0.00 ATOM 594 CB GLU 112 8.160 -4.741 -14.926 1.00 0.00 ATOM 595 CG GLU 112 9.266 -5.492 -14.202 1.00 0.00 ATOM 596 CD GLU 112 8.766 -6.747 -13.515 1.00 0.00 ATOM 597 OE1 GLU 112 8.031 -7.524 -14.160 1.00 0.00 ATOM 598 OE2 GLU 112 9.108 -6.954 -12.332 1.00 0.00 ATOM 599 O GLU 112 6.982 -4.810 -11.795 1.00 0.00 ATOM 600 C GLU 112 6.612 -4.855 -12.966 1.00 0.00 ATOM 601 N LEU 113 5.650 -5.661 -13.397 1.00 0.00 ATOM 602 CA LEU 113 5.043 -6.633 -12.510 1.00 0.00 ATOM 603 CB LEU 113 3.978 -5.968 -11.634 1.00 0.00 ATOM 604 CG LEU 113 2.824 -5.286 -12.370 1.00 0.00 ATOM 605 CD1 LEU 113 1.770 -6.304 -12.776 1.00 0.00 ATOM 606 CD2 LEU 113 2.204 -4.198 -11.507 1.00 0.00 ATOM 607 O LEU 113 4.177 -7.603 -14.522 1.00 0.00 ATOM 608 C LEU 113 4.443 -7.762 -13.328 1.00 0.00 ATOM 609 N ASN 114 4.321 -8.924 -12.699 1.00 0.00 ATOM 610 CA ASN 114 3.761 -10.104 -13.331 1.00 0.00 ATOM 611 CB ASN 114 4.863 -11.118 -13.645 1.00 0.00 ATOM 612 CG ASN 114 5.853 -10.604 -14.672 1.00 0.00 ATOM 613 ND2 ASN 114 6.992 -10.112 -14.199 1.00 0.00 ATOM 614 OD1 ASN 114 5.594 -10.648 -15.874 1.00 0.00 ATOM 615 O ASN 114 2.980 -10.699 -11.153 1.00 0.00 ATOM 616 C ASN 114 2.722 -10.607 -12.355 1.00 0.00 ATOM 617 N ILE 115 1.549 -10.933 -12.864 1.00 0.00 ATOM 618 CA ILE 115 0.478 -11.390 -11.996 1.00 0.00 ATOM 619 CB ILE 115 -0.622 -10.324 -11.846 1.00 0.00 ATOM 620 CG1 ILE 115 -1.667 -10.775 -10.823 1.00 0.00 ATOM 621 CG2 ILE 115 -1.250 -10.011 -13.196 1.00 0.00 ATOM 622 CD1 ILE 115 -2.598 -9.671 -10.373 1.00 0.00 ATOM 623 O ILE 115 -0.216 -12.915 -13.725 1.00 0.00 ATOM 624 C ILE 115 -0.125 -12.688 -12.514 1.00 0.00 ATOM 625 N HIS 116 -0.500 -13.552 -11.581 1.00 0.00 ATOM 626 CA HIS 116 -1.120 -14.822 -11.918 1.00 0.00 ATOM 627 CB HIS 116 -0.268 -15.986 -11.407 1.00 0.00 ATOM 628 CG HIS 116 1.092 -16.055 -12.025 1.00 0.00 ATOM 629 CD2 HIS 116 2.425 -15.599 -11.656 1.00 0.00 ATOM 630 ND1 HIS 116 1.328 -16.662 -13.240 1.00 0.00 ATOM 631 CE1 HIS 116 2.638 -16.566 -13.530 1.00 0.00 ATOM 632 NE2 HIS 116 3.302 -15.929 -12.585 1.00 0.00 ATOM 633 O HIS 116 -2.662 -14.458 -10.131 1.00 0.00 ATOM 634 C HIS 116 -2.508 -14.804 -11.302 1.00 0.00 ATOM 635 N TYR 117 -3.515 -15.140 -12.102 1.00 0.00 ATOM 636 CA TYR 117 -4.898 -15.153 -11.618 1.00 0.00 ATOM 637 CB TYR 117 -5.839 -14.565 -12.671 1.00 0.00 ATOM 638 CG TYR 117 -5.617 -13.094 -12.936 1.00 0.00 ATOM 639 CD1 TYR 117 -4.687 -12.671 -13.877 1.00 0.00 ATOM 640 CD2 TYR 117 -6.340 -12.130 -12.245 1.00 0.00 ATOM 641 CE1 TYR 117 -4.478 -11.329 -14.126 1.00 0.00 ATOM 642 CE2 TYR 117 -6.145 -10.782 -12.481 1.00 0.00 ATOM 643 CZ TYR 117 -5.204 -10.386 -13.430 1.00 0.00 ATOM 644 OH TYR 117 -4.998 -9.049 -13.677 1.00 0.00 ATOM 645 O TYR 117 -5.360 -17.452 -12.130 1.00 0.00 ATOM 646 C TYR 117 -5.288 -16.574 -11.271 1.00 0.00 ATOM 647 N VAL 118 -5.515 -16.782 -9.981 1.00 0.00 ATOM 648 CA VAL 118 -5.833 -18.086 -9.428 1.00 0.00 ATOM 649 CB VAL 118 -5.381 -18.203 -7.961 1.00 0.00 ATOM 650 CG1 VAL 118 -5.849 -19.522 -7.363 1.00 0.00 ATOM 651 CG2 VAL 118 -3.869 -18.073 -7.858 1.00 0.00 ATOM 652 O VAL 118 -7.591 -19.682 -9.720 1.00 0.00 ATOM 653 C VAL 118 -7.294 -18.515 -9.464 1.00 0.00 ATOM 654 N LYS 119 -8.195 -17.579 -9.195 1.00 0.00 ATOM 655 CA LYS 119 -9.628 -17.861 -9.175 1.00 0.00 ATOM 656 CB LYS 119 -10.063 -18.331 -7.784 1.00 0.00 ATOM 657 CG LYS 119 -9.431 -19.642 -7.347 1.00 0.00 ATOM 658 CD LYS 119 -9.944 -20.074 -5.983 1.00 0.00 ATOM 659 CE LYS 119 -9.300 -21.376 -5.537 1.00 0.00 ATOM 660 NZ LYS 119 -9.815 -21.827 -4.215 1.00 0.00 ATOM 661 O LYS 119 -9.873 -15.514 -9.565 1.00 0.00 ATOM 662 C LYS 119 -10.402 -16.620 -9.593 1.00 0.00 ATOM 663 N PRO 120 -11.677 -16.789 -9.974 1.00 0.00 ATOM 664 CA PRO 120 -12.477 -15.632 -10.382 1.00 0.00 ATOM 665 CB PRO 120 -13.825 -16.235 -10.781 1.00 0.00 ATOM 666 CG PRO 120 -13.976 -17.428 -9.897 1.00 0.00 ATOM 667 CD PRO 120 -12.644 -18.123 -9.904 1.00 0.00 ATOM 668 O PRO 120 -12.861 -15.052 -8.087 1.00 0.00 ATOM 669 C PRO 120 -12.615 -14.649 -9.223 1.00 0.00 ATOM 670 N GLY 121 -12.455 -13.362 -9.510 1.00 0.00 ATOM 671 CA GLY 121 -12.559 -12.341 -8.473 1.00 0.00 ATOM 672 O GLY 121 -14.560 -11.019 -8.468 1.00 0.00 ATOM 673 C GLY 121 -14.014 -12.060 -8.110 1.00 0.00 ATOM 674 N MET 122 -14.647 -12.988 -7.407 1.00 0.00 ATOM 675 CA MET 122 -16.031 -12.772 -7.016 1.00 0.00 ATOM 676 CB MET 122 -16.926 -13.879 -7.575 1.00 0.00 ATOM 677 CG MET 122 -17.005 -13.905 -9.094 1.00 0.00 ATOM 678 SD MET 122 -18.055 -15.234 -9.713 1.00 0.00 ATOM 679 CE MET 122 -19.671 -14.653 -9.205 1.00 0.00 ATOM 680 O MET 122 -15.551 -13.516 -4.791 1.00 0.00 ATOM 681 C MET 122 -16.147 -12.707 -5.506 1.00 0.00 ATOM 682 N GLY 123 -16.911 -11.728 -5.036 1.00 0.00 ATOM 683 CA GLY 123 -17.112 -11.542 -3.614 1.00 0.00 ATOM 684 O GLY 123 -17.819 -9.358 -4.286 1.00 0.00 ATOM 685 C GLY 123 -17.666 -10.156 -3.355 1.00 0.00 ATOM 686 N THR 124 -17.975 -9.856 -2.098 1.00 0.00 ATOM 687 CA THR 124 -18.513 -8.545 -1.766 1.00 0.00 ATOM 688 CB THR 124 -19.601 -8.640 -0.680 1.00 0.00 ATOM 689 CG2 THR 124 -20.734 -9.546 -1.140 1.00 0.00 ATOM 690 OG1 THR 124 -19.036 -9.185 0.519 1.00 0.00 ATOM 691 O THR 124 -17.628 -6.398 -1.191 1.00 0.00 ATOM 692 C THR 124 -17.411 -7.604 -1.297 1.00 0.00 ATOM 693 N TYR 125 -16.231 -8.163 -1.028 1.00 0.00 ATOM 694 CA TYR 125 -15.100 -7.387 -0.523 1.00 0.00 ATOM 695 CB TYR 125 -15.179 -7.254 0.999 1.00 0.00 ATOM 696 CG TYR 125 -15.042 -8.567 1.736 1.00 0.00 ATOM 697 CD1 TYR 125 -13.801 -9.004 2.186 1.00 0.00 ATOM 698 CD2 TYR 125 -16.151 -9.365 1.981 1.00 0.00 ATOM 699 CE1 TYR 125 -13.666 -10.202 2.862 1.00 0.00 ATOM 700 CE2 TYR 125 -16.035 -10.566 2.655 1.00 0.00 ATOM 701 CZ TYR 125 -14.778 -10.980 3.095 1.00 0.00 ATOM 702 OH TYR 125 -14.646 -12.175 3.767 1.00 0.00 ATOM 703 O TYR 125 -13.756 -9.224 -1.252 1.00 0.00 ATOM 704 C TYR 125 -13.782 -8.042 -0.936 1.00 0.00 ATOM 705 N LEU 126 -12.693 -7.273 -0.940 1.00 0.00 ATOM 706 CA LEU 126 -11.389 -7.811 -1.333 1.00 0.00 ATOM 707 CB LEU 126 -11.137 -7.571 -2.822 1.00 0.00 ATOM 708 CG LEU 126 -11.115 -6.111 -3.279 1.00 0.00 ATOM 709 CD1 LEU 126 -9.767 -5.473 -2.980 1.00 0.00 ATOM 710 CD2 LEU 126 -11.432 -6.008 -4.764 1.00 0.00 ATOM 711 O LEU 126 -10.367 -6.112 0.015 1.00 0.00 ATOM 712 C LEU 126 -10.245 -7.209 -0.519 1.00 0.00 ATOM 713 N ARG 127 -9.138 -7.943 -0.439 1.00 0.00 ATOM 714 CA ARG 127 -7.953 -7.508 0.287 1.00 0.00 ATOM 715 CB ARG 127 -7.842 -8.246 1.623 1.00 0.00 ATOM 716 CG ARG 127 -8.979 -7.955 2.588 1.00 0.00 ATOM 717 CD ARG 127 -8.811 -8.726 3.888 1.00 0.00 ATOM 718 NE ARG 127 -7.649 -8.273 4.647 1.00 0.00 ATOM 719 CZ ARG 127 -7.163 -8.898 5.715 1.00 0.00 ATOM 720 NH1 ARG 127 -6.101 -8.411 6.342 1.00 0.00 ATOM 721 NH2 ARG 127 -7.740 -10.007 6.151 1.00 0.00 ATOM 722 O ARG 127 -6.679 -8.745 -1.335 1.00 0.00 ATOM 723 C ARG 127 -6.738 -7.757 -0.596 1.00 0.00 ATOM 724 N ALA 128 -5.769 -6.856 -0.503 1.00 0.00 ATOM 725 CA ALA 128 -4.556 -6.925 -1.303 1.00 0.00 ATOM 726 CB ALA 128 -4.584 -5.875 -2.403 1.00 0.00 ATOM 727 O ALA 128 -3.182 -5.631 0.158 1.00 0.00 ATOM 728 C ALA 128 -3.405 -6.731 -0.330 1.00 0.00 ATOM 729 N VAL 129 -2.689 -7.812 -0.040 1.00 0.00 ATOM 730 CA VAL 129 -1.590 -7.768 0.914 1.00 0.00 ATOM 731 CB VAL 129 -1.717 -8.879 1.974 1.00 0.00 ATOM 732 CG1 VAL 129 -0.540 -8.834 2.936 1.00 0.00 ATOM 733 CG2 VAL 129 -3.032 -8.746 2.728 1.00 0.00 ATOM 734 O VAL 129 0.050 -8.862 -0.450 1.00 0.00 ATOM 735 C VAL 129 -0.241 -7.879 0.228 1.00 0.00 ATOM 736 N ALA 130 0.576 -6.849 0.417 1.00 0.00 ATOM 737 CA ALA 130 1.895 -6.771 -0.189 1.00 0.00 ATOM 738 CB ALA 130 1.966 -5.594 -1.150 1.00 0.00 ATOM 739 O ALA 130 2.788 -6.051 1.920 1.00 0.00 ATOM 740 C ALA 130 2.988 -6.647 0.861 1.00 0.00 ATOM 741 N SER 131 4.146 -7.211 0.544 1.00 0.00 ATOM 742 CA SER 131 5.306 -7.149 1.420 1.00 0.00 ATOM 743 CB SER 131 5.296 -8.316 2.408 1.00 0.00 ATOM 744 OG SER 131 6.425 -8.272 3.263 1.00 0.00 ATOM 745 O SER 131 6.591 -7.777 -0.509 1.00 0.00 ATOM 746 C SER 131 6.557 -7.160 0.559 1.00 0.00 ATOM 747 N ILE 132 7.582 -6.451 1.017 1.00 0.00 ATOM 748 CA ILE 132 8.845 -6.371 0.295 1.00 0.00 ATOM 749 CB ILE 132 9.679 -5.158 0.749 1.00 0.00 ATOM 750 CG1 ILE 132 8.941 -3.855 0.433 1.00 0.00 ATOM 751 CG2 ILE 132 11.062 -5.194 0.117 1.00 0.00 ATOM 752 CD1 ILE 132 9.568 -2.631 1.062 1.00 0.00 ATOM 753 O ILE 132 9.807 -8.160 1.579 1.00 0.00 ATOM 754 C ILE 132 9.656 -7.658 0.470 1.00 0.00 ATOM 755 N VAL 133 10.170 -8.188 -0.636 1.00 0.00 ATOM 756 CA VAL 133 10.963 -9.404 -0.611 1.00 0.00 ATOM 757 CB VAL 133 10.772 -10.230 -1.896 1.00 0.00 ATOM 758 CG1 VAL 133 11.680 -11.451 -1.884 1.00 0.00 ATOM 759 CG2 VAL 133 9.317 -10.645 -2.051 1.00 0.00 ATOM 760 O VAL 133 13.130 -9.593 0.383 1.00 0.00 ATOM 761 C VAL 133 12.403 -8.995 -0.414 1.00 0.00 ATOM 762 N HIS 134 12.813 -7.968 -1.146 1.00 0.00 ATOM 763 CA HIS 134 14.160 -7.447 -1.017 1.00 0.00 ATOM 764 CB HIS 134 15.110 -8.172 -1.972 1.00 0.00 ATOM 765 CG HIS 134 16.542 -7.765 -1.825 1.00 0.00 ATOM 766 CD2 HIS 134 17.492 -7.003 -2.623 1.00 0.00 ATOM 767 ND1 HIS 134 17.305 -8.107 -0.729 1.00 0.00 ATOM 768 CE1 HIS 134 18.542 -7.602 -0.881 1.00 0.00 ATOM 769 NE2 HIS 134 18.662 -6.940 -2.015 1.00 0.00 ATOM 770 O HIS 134 14.040 -5.494 -2.403 1.00 0.00 ATOM 771 C HIS 134 14.229 -5.950 -1.275 1.00 0.00 ATOM 772 N GLN 135 14.478 -5.158 -0.219 1.00 0.00 ATOM 773 CA GLN 135 14.564 -3.714 -0.432 1.00 0.00 ATOM 774 CB GLN 135 14.261 -2.964 0.866 1.00 0.00 ATOM 775 CG GLN 135 15.327 -3.118 1.937 1.00 0.00 ATOM 776 CD GLN 135 15.111 -4.343 2.803 1.00 0.00 ATOM 777 OE1 GLN 135 14.744 -5.409 2.307 1.00 0.00 ATOM 778 NE2 GLN 135 15.337 -4.195 4.103 1.00 0.00 ATOM 779 O GLN 135 16.837 -4.310 -0.832 1.00 0.00 ATOM 780 C GLN 135 15.965 -3.453 -0.949 1.00 0.00 ATOM 781 N GLY 136 16.187 -2.284 -1.531 1.00 0.00 ATOM 782 CA GLY 136 17.514 -1.981 -2.023 1.00 0.00 ATOM 783 O GLY 136 16.592 0.114 -2.655 1.00 0.00 ATOM 784 C GLY 136 17.610 -0.545 -2.474 1.00 0.00 ATOM 785 N LYS 137 18.836 -0.050 -2.616 1.00 0.00 ATOM 786 CA LYS 137 19.048 1.306 -3.090 1.00 0.00 ATOM 787 CB LYS 137 20.444 1.449 -3.701 1.00 0.00 ATOM 788 CG LYS 137 20.768 2.851 -4.186 1.00 0.00 ATOM 789 CD LYS 137 22.192 2.938 -4.713 1.00 0.00 ATOM 790 CE LYS 137 22.509 4.335 -5.220 1.00 0.00 ATOM 791 NZ LYS 137 23.901 4.434 -5.738 1.00 0.00 ATOM 792 O LYS 137 17.440 2.914 -3.795 1.00 0.00 ATOM 793 C LYS 137 18.133 1.951 -4.114 1.00 0.00 ATOM 794 N GLN 138 18.146 1.440 -5.337 1.00 0.00 ATOM 795 CA GLN 138 17.321 1.977 -6.412 1.00 0.00 ATOM 796 CB GLN 138 18.155 2.174 -7.679 1.00 0.00 ATOM 797 CG GLN 138 19.295 3.170 -7.523 1.00 0.00 ATOM 798 CD GLN 138 18.809 4.564 -7.184 1.00 0.00 ATOM 799 OE1 GLN 138 17.978 5.132 -7.893 1.00 0.00 ATOM 800 NE2 GLN 138 19.326 5.120 -6.094 1.00 0.00 ATOM 801 O GLN 138 15.029 1.431 -6.793 1.00 0.00 ATOM 802 C GLN 138 16.165 1.003 -6.634 1.00 0.00 ATOM 803 N ARG 139 16.443 -0.300 -6.631 1.00 0.00 ATOM 804 CA ARG 139 15.401 -1.299 -6.880 1.00 0.00 ATOM 805 CB ARG 139 15.862 -2.305 -7.937 1.00 0.00 ATOM 806 CG ARG 139 14.822 -3.355 -8.291 1.00 0.00 ATOM 807 CD ARG 139 15.305 -4.251 -9.421 1.00 0.00 ATOM 808 NE ARG 139 14.323 -5.277 -9.763 1.00 0.00 ATOM 809 CZ ARG 139 14.489 -6.180 -10.724 1.00 0.00 ATOM 810 NH1 ARG 139 13.540 -7.074 -10.964 1.00 0.00 ATOM 811 NH2 ARG 139 15.603 -6.184 -11.443 1.00 0.00 ATOM 812 O ARG 139 15.693 -2.603 -4.871 1.00 0.00 ATOM 813 C ARG 139 14.908 -2.120 -5.686 1.00 0.00 ATOM 814 N ILE 140 13.589 -2.280 -5.609 1.00 0.00 ATOM 815 CA ILE 140 12.946 -3.048 -4.548 1.00 0.00 ATOM 816 CB ILE 140 12.156 -2.137 -3.590 1.00 0.00 ATOM 817 CG1 ILE 140 13.090 -1.125 -2.924 1.00 0.00 ATOM 818 CG2 ILE 140 11.399 -2.969 -2.566 1.00 0.00 ATOM 819 CD1 ILE 140 12.368 -0.050 -2.143 1.00 0.00 ATOM 820 O ILE 140 11.343 -3.827 -6.164 1.00 0.00 ATOM 821 C ILE 140 12.040 -4.099 -5.186 1.00 0.00 ATOM 822 N VAL 141 12.063 -5.304 -4.641 1.00 0.00 ATOM 823 CA VAL 141 11.219 -6.380 -5.143 1.00 0.00 ATOM 824 CB VAL 141 12.042 -7.645 -5.450 1.00 0.00 ATOM 825 CG1 VAL 141 11.128 -8.785 -5.875 1.00 0.00 ATOM 826 CG2 VAL 141 13.078 -7.360 -6.526 1.00 0.00 ATOM 827 O VAL 141 10.444 -6.781 -2.912 1.00 0.00 ATOM 828 C VAL 141 10.147 -6.644 -4.095 1.00 0.00 ATOM 829 N VAL 142 8.895 -6.713 -4.526 1.00 0.00 ATOM 830 CA VAL 142 7.815 -6.964 -3.587 1.00 0.00 ATOM 831 CB VAL 142 7.047 -5.673 -3.251 1.00 0.00 ATOM 832 CG1 VAL 142 6.395 -5.099 -4.499 1.00 0.00 ATOM 833 CG2 VAL 142 6.005 -5.937 -2.176 1.00 0.00 ATOM 834 O VAL 142 6.757 -8.180 -5.365 1.00 0.00 ATOM 835 C VAL 142 6.864 -8.011 -4.150 1.00 0.00 ATOM 836 N GLU 143 6.189 -8.718 -3.255 1.00 0.00 ATOM 837 CA GLU 143 5.234 -9.742 -3.640 1.00 0.00 ATOM 838 CB GLU 143 5.729 -11.124 -3.210 1.00 0.00 ATOM 839 CG GLU 143 4.821 -12.268 -3.635 1.00 0.00 ATOM 840 CD GLU 143 5.370 -13.624 -3.242 1.00 0.00 ATOM 841 OE1 GLU 143 6.497 -13.676 -2.707 1.00 0.00 ATOM 842 OE2 GLU 143 4.673 -14.635 -3.470 1.00 0.00 ATOM 843 O GLU 143 3.871 -8.764 -1.924 1.00 0.00 ATOM 844 C GLU 143 3.904 -9.384 -3.000 1.00 0.00 ATOM 845 N GLY 144 2.808 -9.759 -3.651 1.00 0.00 ATOM 846 CA GLY 144 1.490 -9.454 -3.113 1.00 0.00 ATOM 847 O GLY 144 0.573 -11.134 -4.559 1.00 0.00 ATOM 848 C GLY 144 0.452 -10.485 -3.522 1.00 0.00 ATOM 849 N LYS 145 -0.564 -10.640 -2.684 1.00 0.00 ATOM 850 CA LYS 145 -1.636 -11.586 -2.944 1.00 0.00 ATOM 851 CB LYS 145 -1.532 -12.788 -2.004 1.00 0.00 ATOM 852 CG LYS 145 -0.276 -13.622 -2.200 1.00 0.00 ATOM 853 CD LYS 145 -0.271 -14.837 -1.287 1.00 0.00 ATOM 854 CE LYS 145 0.996 -15.655 -1.462 1.00 0.00 ATOM 855 NZ LYS 145 1.007 -16.859 -0.587 1.00 0.00 ATOM 856 O LYS 145 -3.126 -10.033 -1.897 1.00 0.00 ATOM 857 C LYS 145 -2.969 -10.873 -2.782 1.00 0.00 ATOM 858 N VAL 146 -3.917 -11.211 -3.645 1.00 0.00 ATOM 859 CA VAL 146 -5.252 -10.632 -3.598 1.00 0.00 ATOM 860 CB VAL 146 -5.701 -10.135 -4.985 1.00 0.00 ATOM 861 CG1 VAL 146 -7.125 -9.604 -4.925 1.00 0.00 ATOM 862 CG2 VAL 146 -4.750 -9.069 -5.504 1.00 0.00 ATOM 863 O VAL 146 -6.024 -12.881 -3.339 1.00 0.00 ATOM 864 C VAL 146 -6.192 -11.697 -3.045 1.00 0.00 ATOM 865 N TYR 147 -7.176 -11.273 -2.255 1.00 0.00 ATOM 866 CA TYR 147 -8.148 -12.186 -1.665 1.00 0.00 ATOM 867 CB TYR 147 -7.856 -12.394 -0.178 1.00 0.00 ATOM 868 CG TYR 147 -6.469 -12.925 0.105 1.00 0.00 ATOM 869 CD1 TYR 147 -5.383 -12.065 0.193 1.00 0.00 ATOM 870 CD2 TYR 147 -6.252 -14.286 0.281 1.00 0.00 ATOM 871 CE1 TYR 147 -4.111 -12.543 0.452 1.00 0.00 ATOM 872 CE2 TYR 147 -4.987 -14.781 0.540 1.00 0.00 ATOM 873 CZ TYR 147 -3.914 -13.895 0.625 1.00 0.00 ATOM 874 OH TYR 147 -2.649 -14.372 0.882 1.00 0.00 ATOM 875 O TYR 147 -9.789 -10.460 -1.894 1.00 0.00 ATOM 876 C TYR 147 -9.563 -11.665 -1.854 1.00 0.00 ATOM 877 N THR 148 -10.509 -12.589 -1.964 1.00 0.00 ATOM 878 CA THR 148 -11.915 -12.244 -2.120 1.00 0.00 ATOM 879 CB THR 148 -12.472 -12.735 -3.470 1.00 0.00 ATOM 880 CG2 THR 148 -11.771 -12.030 -4.621 1.00 0.00 ATOM 881 OG1 THR 148 -12.253 -14.146 -3.595 1.00 0.00 ATOM 882 O THR 148 -12.323 -13.954 -0.480 1.00 0.00 ATOM 883 C THR 148 -12.669 -12.866 -0.947 1.00 0.00 ATOM 884 N ASP 149 -16.323 -14.127 0.033 1.00 0.00 ATOM 885 CA ASP 149 -17.679 -14.451 -0.396 1.00 0.00 ATOM 886 CB ASP 149 -17.720 -15.838 -1.042 1.00 0.00 ATOM 887 CG ASP 149 -17.022 -15.877 -2.386 1.00 0.00 ATOM 888 OD1 ASP 149 -16.751 -14.793 -2.946 1.00 0.00 ATOM 889 OD2 ASP 149 -16.744 -16.989 -2.880 1.00 0.00 ATOM 890 O ASP 149 -18.789 -13.317 1.415 1.00 0.00 ATOM 891 C ASP 149 -18.614 -14.373 0.807 1.00 0.00 ATOM 892 N GLN 150 -19.206 -15.513 1.149 1.00 0.00 ATOM 893 CA GLN 150 -20.122 -15.604 2.279 1.00 0.00 ATOM 894 CB GLN 150 -21.061 -16.800 2.112 1.00 0.00 ATOM 895 CG GLN 150 -21.926 -16.740 0.862 1.00 0.00 ATOM 896 CD GLN 150 -22.854 -15.541 0.853 1.00 0.00 ATOM 897 OE1 GLN 150 -23.743 -15.425 1.698 1.00 0.00 ATOM 898 NE2 GLN 150 -22.651 -14.643 -0.104 1.00 0.00 ATOM 899 O GLN 150 -19.547 -16.564 4.408 1.00 0.00 ATOM 900 C GLN 150 -19.295 -15.714 3.556 1.00 0.00 ATOM 901 N GLY 151 -18.299 -14.843 3.671 1.00 0.00 ATOM 902 CA GLY 151 -17.441 -14.854 4.842 1.00 0.00 ATOM 903 O GLY 151 -15.103 -15.217 5.184 1.00 0.00 ATOM 904 C GLY 151 -16.124 -15.565 4.587 1.00 0.00 ATOM 905 N GLU 152 -16.135 -16.561 3.707 1.00 0.00 ATOM 906 CA GLU 152 -14.914 -17.297 3.409 1.00 0.00 ATOM 907 CB GLU 152 -15.235 -18.569 2.622 1.00 0.00 ATOM 908 CG GLU 152 -16.047 -19.592 3.401 1.00 0.00 ATOM 909 CD GLU 152 -15.990 -20.975 2.780 1.00 0.00 ATOM 910 OE1 GLU 152 -14.879 -21.535 2.681 1.00 0.00 ATOM 911 OE2 GLU 152 -17.057 -21.496 2.394 1.00 0.00 ATOM 912 O GLU 152 -14.264 -15.766 1.671 1.00 0.00 ATOM 913 C GLU 152 -13.912 -16.453 2.629 1.00 0.00 ATOM 914 N THR 153 -7.783 -16.736 -1.849 1.00 0.00 ATOM 915 CA THR 153 -6.763 -16.051 -2.643 1.00 0.00 ATOM 916 CB THR 153 -5.368 -16.661 -2.413 1.00 0.00 ATOM 917 CG2 THR 153 -4.322 -15.921 -3.234 1.00 0.00 ATOM 918 OG1 THR 153 -5.019 -16.555 -1.027 1.00 0.00 ATOM 919 O THR 153 -7.535 -17.225 -4.586 1.00 0.00 ATOM 920 C THR 153 -7.176 -16.150 -4.108 1.00 0.00 ATOM 921 N VAL 154 -7.119 -15.028 -4.818 1.00 0.00 ATOM 922 CA VAL 154 -7.531 -14.984 -6.214 1.00 0.00 ATOM 923 CB VAL 154 -8.711 -14.018 -6.424 1.00 0.00 ATOM 924 CG1 VAL 154 -9.923 -14.476 -5.627 1.00 0.00 ATOM 925 CG2 VAL 154 -8.316 -12.602 -6.035 1.00 0.00 ATOM 926 O VAL 154 -6.611 -14.796 -8.407 1.00 0.00 ATOM 927 C VAL 154 -6.450 -14.596 -7.202 1.00 0.00 ATOM 928 N ALA 155 -5.355 -14.029 -6.702 1.00 0.00 ATOM 929 CA ALA 155 -4.256 -13.619 -7.569 1.00 0.00 ATOM 930 CB ALA 155 -4.616 -12.342 -8.314 1.00 0.00 ATOM 931 O ALA 155 -2.989 -13.196 -5.563 1.00 0.00 ATOM 932 C ALA 155 -2.964 -13.413 -6.779 1.00 0.00 ATOM 933 N MET 156 -1.837 -13.505 -7.477 1.00 0.00 ATOM 934 CA MET 156 -0.535 -13.316 -6.859 1.00 0.00 ATOM 935 CB MET 156 0.107 -14.667 -6.539 1.00 0.00 ATOM 936 CG MET 156 1.446 -14.563 -5.825 1.00 0.00 ATOM 937 SD MET 156 2.135 -16.175 -5.405 1.00 0.00 ATOM 938 CE MET 156 2.678 -16.741 -7.014 1.00 0.00 ATOM 939 O MET 156 0.299 -12.699 -9.024 1.00 0.00 ATOM 940 C MET 156 0.328 -12.496 -7.807 1.00 0.00 ATOM 941 N GLY 157 1.089 -11.564 -7.248 1.00 0.00 ATOM 942 CA GLY 157 1.928 -10.679 -8.052 1.00 0.00 ATOM 943 O GLY 157 3.531 -10.568 -6.274 1.00 0.00 ATOM 944 C GLY 157 3.332 -10.504 -7.486 1.00 0.00 ATOM 945 N THR 158 4.302 -10.319 -8.374 1.00 0.00 ATOM 946 CA THR 158 5.666 -10.012 -7.962 1.00 0.00 ATOM 947 CB THR 158 6.620 -11.188 -8.243 1.00 0.00 ATOM 948 CG2 THR 158 8.047 -10.818 -7.869 1.00 0.00 ATOM 949 OG1 THR 158 6.223 -12.324 -7.468 1.00 0.00 ATOM 950 O THR 158 5.727 -8.709 -9.982 1.00 0.00 ATOM 951 C THR 158 5.965 -8.753 -8.774 1.00 0.00 ATOM 952 N GLY 159 6.467 -7.715 -8.124 1.00 0.00 ATOM 953 CA GLY 159 6.731 -6.494 -8.858 1.00 0.00 ATOM 954 O GLY 159 8.697 -6.213 -7.520 1.00 0.00 ATOM 955 C GLY 159 8.100 -5.930 -8.562 1.00 0.00 ATOM 956 N SER 160 8.601 -5.137 -9.500 1.00 0.00 ATOM 957 CA SER 160 9.887 -4.488 -9.325 1.00 0.00 ATOM 958 CB SER 160 10.835 -4.863 -10.466 1.00 0.00 ATOM 959 OG SER 160 11.143 -6.245 -10.440 1.00 0.00 ATOM 960 O SER 160 8.934 -2.445 -10.151 1.00 0.00 ATOM 961 C SER 160 9.596 -2.999 -9.265 1.00 0.00 ATOM 962 N PHE 161 10.081 -2.361 -8.207 1.00 0.00 ATOM 963 CA PHE 161 9.866 -0.939 -7.993 1.00 0.00 ATOM 964 CB PHE 161 9.035 -0.706 -6.730 1.00 0.00 ATOM 965 CG PHE 161 7.639 -1.255 -6.813 1.00 0.00 ATOM 966 CD1 PHE 161 7.378 -2.574 -6.480 1.00 0.00 ATOM 967 CD2 PHE 161 6.589 -0.455 -7.224 1.00 0.00 ATOM 968 CE1 PHE 161 6.095 -3.079 -6.555 1.00 0.00 ATOM 969 CE2 PHE 161 5.305 -0.961 -7.300 1.00 0.00 ATOM 970 CZ PHE 161 5.056 -2.267 -6.968 1.00 0.00 ATOM 971 O PHE 161 12.183 -0.784 -7.413 1.00 0.00 ATOM 972 C PHE 161 11.199 -0.219 -7.895 1.00 0.00 ATOM 973 N PHE 162 11.230 1.027 -8.358 1.00 0.00 ATOM 974 CA PHE 162 12.452 1.809 -8.301 1.00 0.00 ATOM 975 CB PHE 162 12.915 2.185 -9.709 1.00 0.00 ATOM 976 CG PHE 162 13.300 1.005 -10.555 1.00 0.00 ATOM 977 CD1 PHE 162 13.410 -0.258 -10.000 1.00 0.00 ATOM 978 CD2 PHE 162 13.554 1.158 -11.907 1.00 0.00 ATOM 979 CE1 PHE 162 13.764 -1.343 -10.780 1.00 0.00 ATOM 980 CE2 PHE 162 13.907 0.073 -12.686 1.00 0.00 ATOM 981 CZ PHE 162 14.014 -1.174 -12.128 1.00 0.00 ATOM 982 O PHE 162 11.179 3.644 -7.396 1.00 0.00 ATOM 983 C PHE 162 12.269 3.070 -7.459 1.00 0.00 ATOM 984 N VAL 163 13.343 3.478 -6.794 1.00 0.00 ATOM 985 CA VAL 163 13.332 4.671 -5.961 1.00 0.00 ATOM 986 CB VAL 163 14.174 4.478 -4.687 1.00 0.00 ATOM 987 CG1 VAL 163 14.193 5.755 -3.861 1.00 0.00 ATOM 988 CG2 VAL 163 13.638 3.315 -3.864 1.00 0.00 ATOM 989 O VAL 163 14.954 5.840 -7.295 1.00 0.00 ATOM 990 C VAL 163 13.840 5.864 -6.765 1.00 0.00 ATOM 991 N LEU 164 13.011 6.898 -6.866 1.00 0.00 ATOM 992 CA LEU 164 13.375 8.113 -7.582 1.00 0.00 ATOM 993 CB LEU 164 12.209 8.593 -8.451 1.00 0.00 ATOM 994 CG LEU 164 11.701 7.609 -9.507 1.00 0.00 ATOM 995 CD1 LEU 164 10.370 8.073 -10.078 1.00 0.00 ATOM 996 CD2 LEU 164 12.724 7.440 -10.621 1.00 0.00 ATOM 997 O LEU 164 12.926 9.619 -5.776 1.00 0.00 ATOM 998 C LEU 164 13.773 9.134 -6.527 1.00 0.00 TER END