PFRMAT TS TARGET T0234 AUTHOR 4204-4258-2837 METHOD The SAM-T04 human predictions for CASP6 use a very similar method to 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 7 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 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) for METHOD finding and aligning more remote 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. METHOD METHOD After the initial automatic run was finished, the results were METHOD examined by hand, and various tweaks were made to the undertaker METHOD cost function to improve the models. Many of the tweaks consisted of METHOD adding specific Hbonds, SSbonds, or distance constraints, to make the METHOD model look better to us. METHOD METHOD Undertaker uses a genetic algorithm with about 28 different operators METHOD to minimize its cost function. The cost function has many components, METHOD including various definitions of burial and compactness, sidechain METHOD rotamer preferences, steric clashes, chain breaks, predicted local METHOD backbone conformation, hydrogen bonding, disulfide bonds, and user METHOD specified constraints. The relative weights of these components were METHOD tweaked for each target, as we have not found a generally applicable METHOD set of weights. METHOD METHOD Because undertaker does not (yet) handle multimers, we sometimes added METHOD "scaffolding" constraints by hand to try to retain structure in METHOD dimerization interfaces. METHOD METHOD For multiple-domain models, we generally broke the sequence into METHOD chunks (often somewhat arbitrary overlapping chunks), and did the full METHOD method for each subchain. The alignments found were all tossed into METHOD the undertaker conformation search. In some cases, we performed METHOD undertaker runs for the subchains, and cut-and-pasted the pieces into METHOD one PDB file (with bad breaks) and let undertaker try to assemble the METHOD pieces. METHOD METHOD This is T0234.try9-monomer-from-repacked-dimer. The backbone (the METHOD same as model 1) was built by undertaker with the sidechains repacked METHOD by Rosetta. The repacking was done in the context of a dimer, formed METHOD by superimposing try9-opt2 on 1dnlA and 1dnlB. METHOD METHOD Since undertaker does not yet understand dimers, this crude METHOD approximation to dimerization is the best we can do at the moment. METHOD METHOD REMARK 6 REMARK 6 T0234 model 3 Mon Jul 19 21:17:05 2004 MODEL 3 PARENT 1dnl_A 1g79_A 1nrg_A 1axj 1flm_A REMARK 7 REMARK 7 ALLPARENTS 1dnl_A 1g79_A 1nrg_A 1axj 1flm_A 1ci0_A ATOM 1 N MET 1 3.879 -12.680 24.241 1.00 0.00 ATOM 2 CA MET 1 4.291 -11.417 24.846 1.00 0.00 ATOM 3 CB MET 1 4.673 -10.413 23.761 1.00 0.00 ATOM 4 CG MET 1 5.849 -10.840 22.893 1.00 0.00 ATOM 5 SD MET 1 7.387 -10.978 23.825 1.00 0.00 ATOM 6 CE MET 1 8.472 -11.681 22.587 1.00 0.00 ATOM 7 O MET 1 1.910 -11.284 25.002 1.00 0.00 ATOM 8 C MET 1 2.985 -11.200 25.600 1.00 0.00 ATOM 9 N SER 2 3.070 -11.015 26.922 1.00 0.00 ATOM 10 CA SER 2 1.890 -10.828 27.749 1.00 0.00 ATOM 11 CB SER 2 2.055 -11.288 29.199 1.00 0.00 ATOM 12 OG SER 2 3.014 -10.495 29.878 1.00 0.00 ATOM 13 O SER 2 0.443 -8.985 28.271 1.00 0.00 ATOM 14 C SER 2 1.510 -9.350 27.776 1.00 0.00 ATOM 15 N GLN 3 2.444 -8.479 27.392 1.00 0.00 ATOM 16 CA GLN 3 2.172 -7.049 27.339 1.00 0.00 ATOM 17 CB GLN 3 3.344 -6.258 27.927 1.00 0.00 ATOM 18 CG GLN 3 3.646 -6.581 29.381 1.00 0.00 ATOM 19 CD GLN 3 2.498 -6.219 30.304 1.00 0.00 ATOM 20 OE1 GLN 3 2.004 -5.088 30.289 1.00 0.00 ATOM 21 NE2 GLN 3 2.069 -7.177 31.118 1.00 0.00 ATOM 22 O GLN 3 2.568 -6.968 24.999 1.00 0.00 ATOM 23 C GLN 3 1.896 -6.513 25.923 1.00 0.00 ATOM 24 N LEU 4 0.986 -5.539 25.720 1.00 0.00 ATOM 25 CA LEU 4 0.864 -4.842 24.432 1.00 0.00 ATOM 26 CB LEU 4 -0.327 -3.875 24.462 1.00 0.00 ATOM 27 CG LEU 4 -1.106 -3.757 23.146 1.00 0.00 ATOM 28 CD1 LEU 4 -2.365 -2.928 23.357 1.00 0.00 ATOM 29 CD2 LEU 4 -0.217 -3.126 22.084 1.00 0.00 ATOM 30 O LEU 4 2.611 -4.104 22.950 1.00 0.00 ATOM 31 C LEU 4 2.157 -4.093 24.097 1.00 0.00 ATOM 32 N GLU 5 2.785 -3.497 25.101 1.00 0.00 ATOM 33 CA GLU 5 4.007 -2.729 24.911 1.00 0.00 ATOM 34 CB GLU 5 4.376 -1.983 26.196 1.00 0.00 ATOM 35 CG GLU 5 5.608 -1.098 26.077 1.00 0.00 ATOM 36 CD GLU 5 5.873 -0.356 27.358 1.00 0.00 ATOM 37 OE1 GLU 5 5.117 -0.520 28.284 1.00 0.00 ATOM 38 OE2 GLU 5 6.892 0.289 27.448 1.00 0.00 ATOM 39 O GLU 5 5.958 -3.254 23.614 1.00 0.00 ATOM 40 C GLU 5 5.162 -3.629 24.477 1.00 0.00 ATOM 41 N LYS 6 5.260 -4.825 25.063 1.00 0.00 ATOM 42 CA LYS 6 6.320 -5.765 24.718 1.00 0.00 ATOM 43 CB LYS 6 6.330 -6.943 25.694 1.00 0.00 ATOM 44 CG LYS 6 7.440 -7.955 25.446 1.00 0.00 ATOM 45 CD LYS 6 8.810 -7.352 25.716 1.00 0.00 ATOM 46 CE LYS 6 9.910 -8.396 25.591 1.00 0.00 ATOM 47 NZ LYS 6 11.257 -7.817 25.845 1.00 0.00 ATOM 48 O LYS 6 7.105 -6.342 22.507 1.00 0.00 ATOM 49 C LYS 6 6.139 -6.258 23.270 1.00 0.00 ATOM 50 N ALA 7 4.963 -6.561 22.904 1.00 0.00 ATOM 51 CA ALA 7 4.661 -7.059 21.560 1.00 0.00 ATOM 52 CB ALA 7 3.198 -7.458 21.449 1.00 0.00 ATOM 53 O ALA 7 5.643 -6.247 19.521 1.00 0.00 ATOM 54 C ALA 7 4.966 -5.984 20.516 1.00 0.00 ATOM 55 N GLN 8 4.470 -4.710 20.765 1.00 0.00 ATOM 56 CA GLN 8 4.713 -3.590 19.859 1.00 0.00 ATOM 57 CB GLN 8 3.723 -2.455 20.133 1.00 0.00 ATOM 58 CG GLN 8 2.297 -2.756 19.709 1.00 0.00 ATOM 59 CD GLN 8 2.136 -2.790 18.201 1.00 0.00 ATOM 60 OE1 GLN 8 2.599 -1.892 17.493 1.00 0.00 ATOM 61 NE2 GLN 8 1.474 -3.828 17.700 1.00 0.00 ATOM 62 O GLN 8 6.445 -2.262 18.881 1.00 0.00 ATOM 63 C GLN 8 6.090 -2.933 19.847 1.00 0.00 ATOM 64 N ALA 9 6.838 -3.088 20.921 1.00 0.00 ATOM 65 CA ALA 9 8.160 -2.481 21.016 1.00 0.00 ATOM 66 CB ALA 9 8.823 -2.818 22.344 1.00 0.00 ATOM 67 O ALA 9 9.756 -2.175 19.255 1.00 0.00 ATOM 68 C ALA 9 9.064 -2.976 19.885 1.00 0.00 ATOM 69 N GLU 10 8.891 -4.230 19.479 1.00 0.00 ATOM 70 CA GLU 10 9.696 -4.812 18.407 1.00 0.00 ATOM 71 CB GLU 10 9.591 -6.338 18.425 1.00 0.00 ATOM 72 CG GLU 10 10.260 -7.000 19.621 1.00 0.00 ATOM 73 CD GLU 10 10.035 -8.487 19.620 1.00 0.00 ATOM 74 OE1 GLU 10 9.339 -8.962 18.755 1.00 0.00 ATOM 75 OE2 GLU 10 10.646 -9.160 20.415 1.00 0.00 ATOM 76 O GLU 10 10.072 -3.879 16.223 1.00 0.00 ATOM 77 C GLU 10 9.250 -4.257 17.058 1.00 0.00 ATOM 78 N TYR 11 7.927 -4.198 16.890 1.00 0.00 ATOM 79 CA TYR 11 7.368 -3.681 15.638 1.00 0.00 ATOM 80 CB TYR 11 5.840 -3.759 15.662 1.00 0.00 ATOM 81 CG TYR 11 5.298 -5.171 15.616 1.00 0.00 ATOM 82 CD1 TYR 11 6.110 -6.235 15.250 1.00 0.00 ATOM 83 CD2 TYR 11 3.976 -5.436 15.940 1.00 0.00 ATOM 84 CE1 TYR 11 5.620 -7.525 15.206 1.00 0.00 ATOM 85 CE2 TYR 11 3.475 -6.722 15.900 1.00 0.00 ATOM 86 CZ TYR 11 4.301 -7.765 15.532 1.00 0.00 ATOM 87 OH TYR 11 3.807 -9.049 15.492 1.00 0.00 ATOM 88 O TYR 11 7.926 -1.828 14.194 1.00 0.00 ATOM 89 C TYR 11 7.797 -2.234 15.352 1.00 0.00 ATOM 90 N ALA 12 8.107 -1.468 16.398 1.00 0.00 ATOM 91 CA ALA 12 8.507 -0.083 16.155 1.00 0.00 ATOM 92 CB ALA 12 8.594 0.682 17.468 1.00 0.00 ATOM 93 O ALA 12 10.073 0.970 14.686 1.00 0.00 ATOM 94 C ALA 12 9.825 0.007 15.413 1.00 0.00 ATOM 95 N GLY 13 10.660 -1.012 15.569 1.00 0.00 ATOM 96 CA GLY 13 11.928 -1.048 14.858 1.00 0.00 ATOM 97 O GLY 13 12.169 -0.308 12.538 1.00 0.00 ATOM 98 C GLY 13 11.581 -1.059 13.362 1.00 0.00 ATOM 99 N PHE 14 10.639 -1.902 12.975 1.00 0.00 ATOM 100 CA PHE 14 10.249 -2.008 11.587 1.00 0.00 ATOM 101 CB PHE 14 9.365 -3.238 11.373 1.00 0.00 ATOM 102 CG PHE 14 9.224 -3.639 9.932 1.00 0.00 ATOM 103 CD1 PHE 14 10.192 -3.292 9.003 1.00 0.00 ATOM 104 CD2 PHE 14 8.120 -4.361 9.503 1.00 0.00 ATOM 105 CE1 PHE 14 10.063 -3.660 7.676 1.00 0.00 ATOM 106 CE2 PHE 14 7.989 -4.732 8.179 1.00 0.00 ATOM 107 CZ PHE 14 8.961 -4.380 7.265 1.00 0.00 ATOM 108 O PHE 14 9.740 -0.264 10.027 1.00 0.00 ATOM 109 C PHE 14 9.525 -0.744 11.139 1.00 0.00 ATOM 110 N ILE 15 8.682 -0.204 11.996 1.00 0.00 ATOM 111 CA ILE 15 7.977 1.026 11.665 1.00 0.00 ATOM 112 CB ILE 15 6.933 1.386 12.738 1.00 0.00 ATOM 113 CG1 ILE 15 5.534 0.963 12.283 1.00 0.00 ATOM 114 CG2 ILE 15 6.970 2.876 13.038 1.00 0.00 ATOM 115 CD1 ILE 15 5.457 -0.464 11.791 1.00 0.00 ATOM 116 O ILE 15 8.896 2.963 10.563 1.00 0.00 ATOM 117 C ILE 15 8.988 2.169 11.512 1.00 0.00 ATOM 118 N GLN 16 9.993 2.206 12.371 1.00 0.00 ATOM 119 CA GLN 16 11.009 3.259 12.283 1.00 0.00 ATOM 120 CB GLN 16 11.893 3.257 13.533 1.00 0.00 ATOM 121 CG GLN 16 11.154 3.591 14.818 1.00 0.00 ATOM 122 CD GLN 16 10.532 4.974 14.784 1.00 0.00 ATOM 123 OE1 GLN 16 11.180 5.953 14.404 1.00 0.00 ATOM 124 NE2 GLN 16 9.270 5.064 15.186 1.00 0.00 ATOM 125 O GLN 16 12.567 4.092 10.670 1.00 0.00 ATOM 126 C GLN 16 11.902 3.135 11.060 1.00 0.00 ATOM 127 N GLU 17 11.934 1.948 10.445 1.00 0.00 ATOM 128 CA GLU 17 12.760 1.755 9.267 1.00 0.00 ATOM 129 CB GLU 17 12.679 0.305 8.787 1.00 0.00 ATOM 130 CG GLU 17 13.598 -0.656 9.529 1.00 0.00 ATOM 131 CD GLU 17 13.730 -1.962 8.796 1.00 0.00 ATOM 132 OE1 GLU 17 13.091 -2.120 7.784 1.00 0.00 ATOM 133 OE2 GLU 17 14.554 -2.757 9.184 1.00 0.00 ATOM 134 O GLU 17 13.252 3.378 7.580 1.00 0.00 ATOM 135 C GLU 17 12.401 2.672 8.107 1.00 0.00 ATOM 136 N PHE 18 11.001 2.545 7.708 1.00 0.00 ATOM 137 CA PHE 18 10.555 3.317 6.545 1.00 0.00 ATOM 138 CB PHE 18 10.640 2.469 5.275 1.00 0.00 ATOM 139 CG PHE 18 12.028 1.992 4.956 1.00 0.00 ATOM 140 CD1 PHE 18 12.395 0.674 5.185 1.00 0.00 ATOM 141 CD2 PHE 18 12.972 2.860 4.428 1.00 0.00 ATOM 142 CE1 PHE 18 13.671 0.235 4.892 1.00 0.00 ATOM 143 CE2 PHE 18 14.249 2.424 4.134 1.00 0.00 ATOM 144 CZ PHE 18 14.599 1.110 4.367 1.00 0.00 ATOM 145 O PHE 18 8.621 2.492 7.759 1.00 0.00 ATOM 146 C PHE 18 9.250 3.474 7.355 1.00 0.00 ATOM 147 N GLN 19 8.842 4.718 7.586 1.00 0.00 ATOM 148 CA GLN 19 7.628 4.963 8.347 1.00 0.00 ATOM 149 CB GLN 19 7.745 6.268 9.139 1.00 0.00 ATOM 150 CG GLN 19 8.719 6.206 10.302 1.00 0.00 ATOM 151 CD GLN 19 10.136 6.553 9.891 1.00 0.00 ATOM 152 OE1 GLN 19 10.529 6.354 8.737 1.00 0.00 ATOM 153 NE2 GLN 19 10.916 7.070 10.833 1.00 0.00 ATOM 154 O GLN 19 5.265 5.230 8.005 1.00 0.00 ATOM 155 C GLN 19 6.367 5.034 7.487 1.00 0.00 ATOM 156 N SER 20 6.506 4.840 6.181 1.00 0.00 ATOM 157 CA SER 20 5.346 4.900 5.298 1.00 0.00 ATOM 158 CB SER 20 5.795 4.998 3.853 1.00 0.00 ATOM 159 OG SER 20 6.506 6.179 3.601 1.00 0.00 ATOM 160 O SER 20 4.926 2.594 5.792 1.00 0.00 ATOM 161 C SER 20 4.454 3.694 5.498 1.00 0.00 ATOM 162 N ALA 21 3.164 3.882 5.332 1.00 0.00 ATOM 163 CA ALA 21 2.211 2.802 5.491 1.00 0.00 ATOM 164 CB ALA 21 1.906 2.588 6.954 1.00 0.00 ATOM 165 O ALA 21 0.532 4.284 4.614 1.00 0.00 ATOM 166 C ALA 21 0.906 3.118 4.765 1.00 0.00 ATOM 167 N ILE 22 0.215 2.083 4.308 1.00 0.00 ATOM 168 CA ILE 22 -1.055 2.293 3.624 1.00 0.00 ATOM 169 CB ILE 22 -1.281 1.247 2.517 1.00 0.00 ATOM 170 CG1 ILE 22 -2.418 1.686 1.592 1.00 0.00 ATOM 171 CG2 ILE 22 -1.582 -0.115 3.127 1.00 0.00 ATOM 172 CD1 ILE 22 -2.112 2.938 0.801 1.00 0.00 ATOM 173 O ILE 22 -2.349 1.230 5.379 1.00 0.00 ATOM 174 C ILE 22 -2.183 2.232 4.665 1.00 0.00 ATOM 175 N ILE 23 -2.941 3.316 4.765 1.00 0.00 ATOM 176 CA ILE 23 -4.038 3.342 5.716 1.00 0.00 ATOM 177 CB ILE 23 -4.100 4.683 6.469 1.00 0.00 ATOM 178 CG1 ILE 23 -2.721 5.047 7.026 1.00 0.00 ATOM 179 CG2 ILE 23 -5.128 4.618 7.588 1.00 0.00 ATOM 180 CD1 ILE 23 -2.239 4.121 8.120 1.00 0.00 ATOM 181 O ILE 23 -5.634 3.785 4.009 1.00 0.00 ATOM 182 C ILE 23 -5.323 3.093 4.967 1.00 0.00 ATOM 183 N SER 24 -6.067 2.096 5.404 1.00 0.00 ATOM 184 CA SER 24 -7.335 1.797 4.779 1.00 0.00 ATOM 185 CB SER 24 -7.415 0.322 4.440 1.00 0.00 ATOM 186 OG SER 24 -8.672 -0.035 3.933 1.00 0.00 ATOM 187 O SER 24 -8.349 1.971 6.952 1.00 0.00 ATOM 188 C SER 24 -8.429 2.229 5.740 1.00 0.00 ATOM 189 N THR 25 -9.431 2.914 5.196 1.00 0.00 ATOM 190 CA THR 25 -10.590 3.363 5.963 1.00 0.00 ATOM 191 CB THR 25 -10.595 4.895 6.132 1.00 0.00 ATOM 192 CG2 THR 25 -9.294 5.365 6.766 1.00 0.00 ATOM 193 OG1 THR 25 -10.737 5.517 4.848 1.00 0.00 ATOM 194 O THR 25 -11.645 2.431 4.001 1.00 0.00 ATOM 195 C THR 25 -11.800 2.895 5.143 1.00 0.00 ATOM 196 N ILE 26 -12.998 3.039 5.701 1.00 0.00 ATOM 197 CA ILE 26 -14.221 2.594 5.042 1.00 0.00 ATOM 198 CB ILE 26 -14.794 1.329 5.707 1.00 0.00 ATOM 199 CG1 ILE 26 -13.854 0.140 5.491 1.00 0.00 ATOM 200 CG2 ILE 26 -16.181 1.023 5.163 1.00 0.00 ATOM 201 CD1 ILE 26 -14.234 -1.090 6.284 1.00 0.00 ATOM 202 O ILE 26 -15.584 4.270 6.098 1.00 0.00 ATOM 203 C ILE 26 -15.294 3.683 5.047 1.00 0.00 ATOM 204 N SER 27 -15.898 3.955 3.893 1.00 0.00 ATOM 205 CA SER 27 -16.919 4.994 3.867 1.00 0.00 ATOM 206 CB SER 27 -17.104 5.531 2.447 1.00 0.00 ATOM 207 OG SER 27 -17.679 4.547 1.601 1.00 0.00 ATOM 208 O SER 27 -18.377 3.295 4.702 1.00 0.00 ATOM 209 C SER 27 -18.270 4.462 4.349 1.00 0.00 ATOM 210 N GLU 28 -19.291 5.321 4.371 1.00 0.00 ATOM 211 CA GLU 28 -20.633 4.939 4.845 1.00 0.00 ATOM 212 CB GLU 28 -21.573 6.145 4.824 1.00 0.00 ATOM 213 CG GLU 28 -21.266 7.184 5.890 1.00 0.00 ATOM 214 CD GLU 28 -22.158 8.405 5.783 1.00 0.00 ATOM 215 OE1 GLU 28 -22.958 8.477 4.826 1.00 0.00 ATOM 216 OE2 GLU 28 -22.060 9.292 6.657 1.00 0.00 ATOM 217 O GLU 28 -22.248 3.197 4.525 1.00 0.00 ATOM 218 C GLU 28 -21.309 3.832 4.042 1.00 0.00 ATOM 219 N GLN 29 -20.845 3.562 2.808 1.00 0.00 ATOM 220 CA GLN 29 -21.441 2.516 1.989 1.00 0.00 ATOM 221 CB GLN 29 -21.542 2.970 0.530 1.00 0.00 ATOM 222 CG GLN 29 -22.369 4.228 0.325 1.00 0.00 ATOM 223 CD GLN 29 -23.813 4.047 0.752 1.00 0.00 ATOM 224 OE1 GLN 29 -24.458 3.052 0.408 1.00 0.00 ATOM 225 NE2 GLN 29 -24.332 5.012 1.503 1.00 0.00 ATOM 226 O GLN 29 -20.925 0.295 1.270 1.00 0.00 ATOM 227 C GLN 29 -20.661 1.211 2.049 1.00 0.00 ATOM 228 N GLY 30 -19.724 1.089 2.959 1.00 0.00 ATOM 229 CA GLY 30 -18.942 -0.135 3.104 1.00 0.00 ATOM 230 O GLY 30 -17.206 -1.171 1.828 1.00 0.00 ATOM 231 C GLY 30 -17.820 -0.136 2.083 1.00 0.00 ATOM 232 N ILE 31 -17.590 1.021 1.545 1.00 0.00 ATOM 233 CA ILE 31 -16.535 1.154 0.551 1.00 0.00 ATOM 234 CB ILE 31 -16.865 2.250 -0.479 1.00 0.00 ATOM 235 CG1 ILE 31 -18.154 1.908 -1.230 1.00 0.00 ATOM 236 CG2 ILE 31 -15.710 2.430 -1.453 1.00 0.00 ATOM 237 CD1 ILE 31 -18.671 3.030 -2.101 1.00 0.00 ATOM 238 O ILE 31 -14.972 2.504 1.776 1.00 0.00 ATOM 239 C ILE 31 -15.157 1.476 1.159 1.00 0.00 ATOM 240 N PRO 32 -14.185 0.580 1.007 1.00 0.00 ATOM 241 CA PRO 32 -12.884 0.935 1.596 1.00 0.00 ATOM 242 CB PRO 32 -12.092 -0.377 1.402 1.00 0.00 ATOM 243 CG PRO 32 -12.848 -1.187 0.454 1.00 0.00 ATOM 244 CD PRO 32 -14.147 -0.645 0.210 1.00 0.00 ATOM 245 O PRO 32 -12.050 1.884 -0.452 1.00 0.00 ATOM 246 C PRO 32 -11.994 1.886 0.783 1.00 0.00 ATOM 247 N ASN 33 -11.097 2.767 1.383 1.00 0.00 ATOM 248 CA ASN 33 -10.196 3.675 0.676 1.00 0.00 ATOM 249 CB ASN 33 -10.732 5.095 0.668 1.00 0.00 ATOM 250 CG ASN 33 -11.883 5.302 -0.277 1.00 0.00 ATOM 251 ND2 ASN 33 -13.049 5.492 0.287 1.00 0.00 ATOM 252 OD1 ASN 33 -11.705 5.365 -1.498 1.00 0.00 ATOM 253 O ASN 33 -8.708 3.388 2.531 1.00 0.00 ATOM 254 C ASN 33 -8.815 3.604 1.318 1.00 0.00 ATOM 255 N GLY 34 -7.764 3.757 0.511 1.00 0.00 ATOM 256 CA GLY 34 -6.398 3.699 1.032 1.00 0.00 ATOM 257 O GLY 34 -5.659 5.311 -0.611 1.00 0.00 ATOM 258 C GLY 34 -5.474 4.791 0.495 1.00 0.00 ATOM 259 N SER 35 -4.449 5.091 1.282 1.00 0.00 ATOM 260 CA SER 35 -3.446 6.069 0.896 1.00 0.00 ATOM 261 CB SER 35 -4.052 7.459 0.876 1.00 0.00 ATOM 262 OG SER 35 -4.404 7.898 2.159 1.00 0.00 ATOM 263 O SER 35 -2.540 5.557 3.044 1.00 0.00 ATOM 264 C SER 35 -2.320 5.929 1.891 1.00 0.00 ATOM 265 N TYR 36 -1.114 6.252 1.459 1.00 0.00 ATOM 266 CA TYR 36 0.036 6.190 2.338 1.00 0.00 ATOM 267 CB TYR 36 1.284 5.766 1.559 1.00 0.00 ATOM 268 CG TYR 36 1.834 6.843 0.651 1.00 0.00 ATOM 269 CD1 TYR 36 2.919 7.616 1.039 1.00 0.00 ATOM 270 CD2 TYR 36 1.270 7.081 -0.593 1.00 0.00 ATOM 271 CE1 TYR 36 3.427 8.601 0.213 1.00 0.00 ATOM 272 CE2 TYR 36 1.768 8.063 -1.427 1.00 0.00 ATOM 273 CZ TYR 36 2.847 8.821 -1.020 1.00 0.00 ATOM 274 OH TYR 36 3.348 9.799 -1.848 1.00 0.00 ATOM 275 O TYR 36 0.467 8.531 2.570 1.00 0.00 ATOM 276 C TYR 36 0.445 7.432 3.118 1.00 0.00 ATOM 277 N ALA 37 0.762 7.250 4.399 1.00 0.00 ATOM 278 CA ALA 37 1.117 8.374 5.251 1.00 0.00 ATOM 279 CB ALA 37 0.010 8.572 6.275 1.00 0.00 ATOM 280 O ALA 37 2.771 6.950 6.228 1.00 0.00 ATOM 281 C ALA 37 2.379 8.097 6.055 1.00 0.00 ATOM 282 N PRO 38 3.064 9.150 6.508 1.00 0.00 ATOM 283 CA PRO 38 4.275 8.916 7.299 1.00 0.00 ATOM 284 CB PRO 38 4.912 10.302 7.422 1.00 0.00 ATOM 285 CG PRO 38 3.818 11.265 7.151 1.00 0.00 ATOM 286 CD PRO 38 2.803 10.581 6.280 1.00 0.00 ATOM 287 O PRO 38 2.849 9.005 9.227 1.00 0.00 ATOM 288 C PRO 38 3.856 8.519 8.712 1.00 0.00 ATOM 289 N PHE 39 4.611 7.609 9.304 1.00 0.00 ATOM 290 CA PHE 39 4.335 7.196 10.673 1.00 0.00 ATOM 291 CB PHE 39 4.691 5.731 10.913 1.00 0.00 ATOM 292 CG PHE 39 3.658 4.754 10.413 1.00 0.00 ATOM 293 CD1 PHE 39 2.333 5.131 10.151 1.00 0.00 ATOM 294 CD2 PHE 39 4.010 3.409 10.311 1.00 0.00 ATOM 295 CE1 PHE 39 1.355 4.190 9.790 1.00 0.00 ATOM 296 CE2 PHE 39 3.041 2.447 9.974 1.00 0.00 ATOM 297 CZ PHE 39 1.714 2.837 9.706 1.00 0.00 ATOM 298 O PHE 39 6.423 8.346 10.955 1.00 0.00 ATOM 299 C PHE 39 5.270 8.192 11.367 1.00 0.00 ATOM 300 N VAL 40 4.783 8.897 12.383 1.00 0.00 ATOM 301 CA VAL 40 5.623 9.888 13.054 1.00 0.00 ATOM 302 CB VAL 40 4.964 11.280 13.054 1.00 0.00 ATOM 303 CG1 VAL 40 3.629 11.239 13.783 1.00 0.00 ATOM 304 CG2 VAL 40 5.887 12.307 13.693 1.00 0.00 ATOM 305 O VAL 40 6.898 9.979 15.090 1.00 0.00 ATOM 306 C VAL 40 5.933 9.493 14.503 1.00 0.00 ATOM 307 N ILE 41 5.165 8.288 14.956 1.00 0.00 ATOM 308 CA ILE 41 5.455 7.814 16.309 1.00 0.00 ATOM 309 CB ILE 41 5.119 8.881 17.367 1.00 0.00 ATOM 310 CG1 ILE 41 5.623 8.445 18.745 1.00 0.00 ATOM 311 CG2 ILE 41 3.621 9.143 17.401 1.00 0.00 ATOM 312 CD1 ILE 41 5.628 9.553 19.772 1.00 0.00 ATOM 313 O ILE 41 3.614 6.288 16.030 1.00 0.00 ATOM 314 C ILE 41 4.678 6.543 16.613 1.00 0.00 ATOM 315 N ASP 42 5.209 5.725 17.513 1.00 0.00 ATOM 316 CA ASP 42 4.500 4.514 17.890 1.00 0.00 ATOM 317 CB ASP 42 4.706 3.421 16.837 1.00 0.00 ATOM 318 CG ASP 42 6.165 3.151 16.490 1.00 0.00 ATOM 319 OD1 ASP 42 7.016 3.825 17.020 1.00 0.00 ATOM 320 OD2 ASP 42 6.424 2.178 15.823 1.00 0.00 ATOM 321 O ASP 42 6.070 4.308 19.691 1.00 0.00 ATOM 322 C ASP 42 4.957 4.024 19.256 1.00 0.00 ATOM 323 N ASP 43 3.968 3.317 19.930 1.00 0.00 ATOM 324 CA ASP 43 4.258 2.714 21.219 1.00 0.00 ATOM 325 CB ASP 43 4.476 3.795 22.281 1.00 0.00 ATOM 326 CG ASP 43 5.285 3.337 23.487 1.00 0.00 ATOM 327 OD1 ASP 43 5.557 2.164 23.586 1.00 0.00 ATOM 328 OD2 ASP 43 5.757 4.178 24.214 1.00 0.00 ATOM 329 O ASP 43 2.152 1.678 20.674 1.00 0.00 ATOM 330 C ASP 43 3.056 1.805 21.518 1.00 0.00 ATOM 331 N ALA 44 3.030 1.172 22.686 1.00 0.00 ATOM 332 CA ALA 44 1.935 0.251 22.966 1.00 0.00 ATOM 333 CB ALA 44 1.953 -0.298 24.332 1.00 0.00 ATOM 334 O ALA 44 -0.415 0.546 22.577 1.00 0.00 ATOM 335 C ALA 44 0.662 1.096 22.820 1.00 0.00 ATOM 336 N LYS 45 0.816 2.472 22.953 1.00 0.00 ATOM 337 CA LYS 45 -0.347 3.355 22.803 1.00 0.00 ATOM 338 CB LYS 45 0.077 4.821 22.903 1.00 0.00 ATOM 339 CG LYS 45 0.523 5.255 24.293 1.00 0.00 ATOM 340 CD LYS 45 0.912 6.725 24.317 1.00 0.00 ATOM 341 CE LYS 45 1.379 7.154 25.700 1.00 0.00 ATOM 342 NZ LYS 45 1.772 8.588 25.736 1.00 0.00 ATOM 343 O LYS 45 -2.228 2.879 21.353 1.00 0.00 ATOM 344 C LYS 45 -1.011 3.054 21.469 1.00 0.00 ATOM 345 N ASN 46 -0.040 3.140 20.436 1.00 0.00 ATOM 346 CA ASN 46 -0.512 3.019 19.071 1.00 0.00 ATOM 347 CB ASN 46 -1.876 3.662 18.897 1.00 0.00 ATOM 348 CG ASN 46 -2.067 4.907 19.718 1.00 0.00 ATOM 349 ND2 ASN 46 -1.102 5.787 19.642 1.00 0.00 ATOM 350 OD1 ASN 46 -3.110 5.102 20.354 1.00 0.00 ATOM 351 O ASN 46 1.499 3.953 18.157 1.00 0.00 ATOM 352 C ASN 46 0.348 3.565 17.949 1.00 0.00 ATOM 353 N ILE 47 -0.224 3.593 16.750 1.00 0.00 ATOM 354 CA ILE 47 0.486 4.093 15.578 1.00 0.00 ATOM 355 CB ILE 47 0.384 3.111 14.397 1.00 0.00 ATOM 356 CG1 ILE 47 0.907 1.731 14.800 1.00 0.00 ATOM 357 CG2 ILE 47 1.202 3.610 13.216 1.00 0.00 ATOM 358 CD1 ILE 47 2.359 1.733 15.234 1.00 0.00 ATOM 359 O ILE 47 -1.283 5.589 14.930 1.00 0.00 ATOM 360 C ILE 47 -0.069 5.426 15.104 1.00 0.00 ATOM 361 N TYR 48 0.847 6.352 14.838 1.00 0.00 ATOM 362 CA TYR 48 0.509 7.718 14.462 1.00 0.00 ATOM 363 CB TYR 48 1.241 8.717 15.361 1.00 0.00 ATOM 364 CG TYR 48 0.654 8.837 16.750 1.00 0.00 ATOM 365 CD1 TYR 48 0.913 7.877 17.718 1.00 0.00 ATOM 366 CD2 TYR 48 -0.155 9.910 17.089 1.00 0.00 ATOM 367 CE1 TYR 48 0.379 7.982 18.989 1.00 0.00 ATOM 368 CE2 TYR 48 -0.694 10.026 18.356 1.00 0.00 ATOM 369 CZ TYR 48 -0.425 9.059 19.303 1.00 0.00 ATOM 370 OH TYR 48 -0.958 9.169 20.567 1.00 0.00 ATOM 371 O TYR 48 1.844 8.040 12.505 1.00 0.00 ATOM 372 C TYR 48 0.754 8.227 13.041 1.00 0.00 ATOM 373 N ILE 49 -0.313 8.939 12.507 1.00 0.00 ATOM 374 CA ILE 49 -0.193 9.500 11.163 1.00 0.00 ATOM 375 CB ILE 49 -0.848 8.588 10.109 1.00 0.00 ATOM 376 CG1 ILE 49 -2.290 8.262 10.507 1.00 0.00 ATOM 377 CG2 ILE 49 -0.040 7.313 9.934 1.00 0.00 ATOM 378 CD1 ILE 49 -3.070 7.534 9.436 1.00 0.00 ATOM 379 O ILE 49 -1.666 11.136 12.157 1.00 0.00 ATOM 380 C ILE 49 -0.868 10.881 11.245 1.00 0.00 ATOM 381 N TYR 50 -0.502 11.781 10.338 1.00 0.00 ATOM 382 CA TYR 50 -1.069 13.121 10.303 1.00 0.00 ATOM 383 CB TYR 50 0.006 14.165 10.614 1.00 0.00 ATOM 384 CG TYR 50 1.266 14.012 9.791 1.00 0.00 ATOM 385 CD1 TYR 50 1.489 14.804 8.674 1.00 0.00 ATOM 386 CD2 TYR 50 2.230 13.076 10.136 1.00 0.00 ATOM 387 CE1 TYR 50 2.637 14.668 7.920 1.00 0.00 ATOM 388 CE2 TYR 50 3.383 12.932 9.389 1.00 0.00 ATOM 389 CZ TYR 50 3.584 13.729 8.281 1.00 0.00 ATOM 390 OH TYR 50 4.730 13.590 7.534 1.00 0.00 ATOM 391 O TYR 50 -1.081 13.279 7.916 1.00 0.00 ATOM 392 C TYR 50 -1.712 13.449 8.975 1.00 0.00 ATOM 393 N VAL 51 -2.988 14.018 8.998 1.00 0.00 ATOM 394 CA VAL 51 -3.682 14.381 7.749 1.00 0.00 ATOM 395 CB VAL 51 -4.308 13.147 7.073 1.00 0.00 ATOM 396 CG1 VAL 51 -5.592 12.745 7.783 1.00 0.00 ATOM 397 CG2 VAL 51 -4.580 13.426 5.602 1.00 0.00 ATOM 398 O VAL 51 -5.189 15.519 9.251 1.00 0.00 ATOM 399 C VAL 51 -4.748 15.414 8.089 1.00 0.00 ATOM 400 N SER 52 -5.179 16.188 7.098 1.00 0.00 ATOM 401 CA SER 52 -6.285 17.121 7.369 1.00 0.00 ATOM 402 CB SER 52 -6.640 17.890 6.111 1.00 0.00 ATOM 403 OG SER 52 -7.727 18.751 6.311 1.00 0.00 ATOM 404 O SER 52 -8.088 15.535 7.386 1.00 0.00 ATOM 405 C SER 52 -7.578 16.529 7.912 1.00 0.00 ATOM 406 N GLY 53 -8.138 17.146 8.960 1.00 0.00 ATOM 407 CA GLY 53 -9.381 16.679 9.550 1.00 0.00 ATOM 408 O GLY 53 -11.688 16.333 9.049 1.00 0.00 ATOM 409 C GLY 53 -10.618 16.826 8.686 1.00 0.00 ATOM 410 N LEU 54 -10.501 17.475 7.533 1.00 0.00 ATOM 411 CA LEU 54 -11.636 17.667 6.636 1.00 0.00 ATOM 412 CB LEU 54 -11.709 19.130 6.180 1.00 0.00 ATOM 413 CG LEU 54 -12.530 20.057 7.086 1.00 0.00 ATOM 414 CD1 LEU 54 -12.020 19.972 8.519 1.00 0.00 ATOM 415 CD2 LEU 54 -12.444 21.483 6.565 1.00 0.00 ATOM 416 O LEU 54 -12.447 16.729 4.590 1.00 0.00 ATOM 417 C LEU 54 -11.549 16.739 5.431 1.00 0.00 ATOM 418 N ALA 55 -10.500 15.977 5.378 1.00 0.00 ATOM 419 CA ALA 55 -10.283 15.050 4.272 1.00 0.00 ATOM 420 CB ALA 55 -8.935 14.355 4.401 1.00 0.00 ATOM 421 O ALA 55 -12.113 13.771 5.166 1.00 0.00 ATOM 422 C ALA 55 -11.337 13.956 4.223 1.00 0.00 ATOM 423 N VAL 56 -11.323 13.098 3.112 1.00 0.00 ATOM 424 CA VAL 56 -12.234 11.978 2.989 1.00 0.00 ATOM 425 CB VAL 56 -12.184 11.360 1.579 1.00 0.00 ATOM 426 CG1 VAL 56 -12.999 10.077 1.530 1.00 0.00 ATOM 427 CG2 VAL 56 -12.691 12.353 0.544 1.00 0.00 ATOM 428 O VAL 56 -12.816 10.292 4.588 1.00 0.00 ATOM 429 C VAL 56 -11.911 10.900 4.026 1.00 0.00 ATOM 430 N HIS 57 -10.632 10.632 4.261 1.00 0.00 ATOM 431 CA HIS 57 -10.306 9.571 5.211 1.00 0.00 ATOM 432 CB HIS 57 -8.793 9.335 5.261 1.00 0.00 ATOM 433 CG HIS 57 -8.247 8.674 4.033 1.00 0.00 ATOM 434 CD2 HIS 57 -7.368 9.111 3.101 1.00 0.00 ATOM 435 ND1 HIS 57 -8.605 7.398 3.653 1.00 0.00 ATOM 436 CE1 HIS 57 -7.970 7.079 2.538 1.00 0.00 ATOM 437 NE2 HIS 57 -7.214 8.102 2.184 1.00 0.00 ATOM 438 O HIS 57 -11.358 9.083 7.310 1.00 0.00 ATOM 439 C HIS 57 -10.845 9.937 6.588 1.00 0.00 ATOM 440 N THR 58 -10.728 11.227 6.948 1.00 0.00 ATOM 441 CA THR 58 -11.206 11.707 8.235 1.00 0.00 ATOM 442 CB THR 58 -10.868 13.195 8.444 1.00 0.00 ATOM 443 CG2 THR 58 -11.426 13.688 9.771 1.00 0.00 ATOM 444 OG1 THR 58 -9.446 13.372 8.432 1.00 0.00 ATOM 445 O THR 58 -13.205 10.976 9.346 1.00 0.00 ATOM 446 C THR 58 -12.713 11.505 8.350 1.00 0.00 ATOM 447 N LYS 59 -13.482 11.915 7.324 1.00 0.00 ATOM 448 CA LYS 59 -14.931 11.764 7.330 1.00 0.00 ATOM 449 CB LYS 59 -15.537 12.367 6.062 1.00 0.00 ATOM 450 CG LYS 59 -15.469 13.887 5.992 1.00 0.00 ATOM 451 CD LYS 59 -16.089 14.411 4.707 1.00 0.00 ATOM 452 CE LYS 59 -16.000 15.928 4.627 1.00 0.00 ATOM 453 NZ LYS 59 -16.571 16.452 3.356 1.00 0.00 ATOM 454 O LYS 59 -16.164 9.905 8.256 1.00 0.00 ATOM 455 C LYS 59 -15.298 10.285 7.459 1.00 0.00 ATOM 456 N ASN 60 -14.676 9.379 6.598 1.00 0.00 ATOM 457 CA ASN 60 -14.995 7.961 6.612 1.00 0.00 ATOM 458 CB ASN 60 -14.226 7.209 5.541 1.00 0.00 ATOM 459 CG ASN 60 -14.606 7.596 4.139 1.00 0.00 ATOM 460 ND2 ASN 60 -13.771 7.221 3.204 1.00 0.00 ATOM 461 OD1 ASN 60 -15.679 8.162 3.899 1.00 0.00 ATOM 462 O ASN 60 -15.511 6.521 8.461 1.00 0.00 ATOM 463 C ASN 60 -14.728 7.341 7.977 1.00 0.00 ATOM 464 N ILE 61 -13.655 7.783 8.588 1.00 0.00 ATOM 465 CA ILE 61 -13.334 7.285 9.918 1.00 0.00 ATOM 466 CB ILE 61 -11.950 7.770 10.385 1.00 0.00 ATOM 467 CG1 ILE 61 -10.842 7.036 9.626 1.00 0.00 ATOM 468 CG2 ILE 61 -11.794 7.570 11.885 1.00 0.00 ATOM 469 CD1 ILE 61 -9.495 7.719 9.697 1.00 0.00 ATOM 470 O ILE 61 -14.764 6.942 11.767 1.00 0.00 ATOM 471 C ILE 61 -14.395 7.731 10.901 1.00 0.00 ATOM 472 N GLU 62 -14.933 8.968 10.741 1.00 0.00 ATOM 473 CA GLU 62 -16.004 9.450 11.619 1.00 0.00 ATOM 474 CB GLU 62 -16.367 10.897 11.276 1.00 0.00 ATOM 475 CG GLU 62 -15.307 11.919 11.657 1.00 0.00 ATOM 476 CD GLU 62 -15.690 13.300 11.202 1.00 0.00 ATOM 477 OE1 GLU 62 -16.703 13.433 10.559 1.00 0.00 ATOM 478 OE2 GLU 62 -15.033 14.237 11.593 1.00 0.00 ATOM 479 O GLU 62 -17.986 8.461 12.547 1.00 0.00 ATOM 480 C GLU 62 -17.270 8.589 11.557 1.00 0.00 ATOM 481 N ALA 63 -17.542 7.993 10.399 1.00 0.00 ATOM 482 CA ALA 63 -18.715 7.121 10.264 1.00 0.00 ATOM 483 CB ALA 63 -19.211 7.119 8.826 1.00 0.00 ATOM 484 O ALA 63 -19.277 4.927 11.093 1.00 0.00 ATOM 485 C ALA 63 -18.390 5.664 10.654 1.00 0.00 ATOM 486 N ASN 64 -17.131 5.260 10.504 1.00 0.00 ATOM 487 CA ASN 64 -16.702 3.893 10.830 1.00 0.00 ATOM 488 CB ASN 64 -16.947 2.944 9.672 1.00 0.00 ATOM 489 CG ASN 64 -16.597 1.514 9.976 1.00 0.00 ATOM 490 ND2 ASN 64 -16.441 0.737 8.935 1.00 0.00 ATOM 491 OD1 ASN 64 -16.396 1.136 11.136 1.00 0.00 ATOM 492 O ASN 64 -14.355 4.086 10.369 1.00 0.00 ATOM 493 C ASN 64 -15.226 3.971 11.223 1.00 0.00 ATOM 494 N PRO 65 -14.933 3.906 12.530 1.00 0.00 ATOM 495 CA PRO 65 -13.567 3.987 13.060 1.00 0.00 ATOM 496 CB PRO 65 -13.677 4.382 14.592 1.00 0.00 ATOM 497 CG PRO 65 -15.147 4.093 14.855 1.00 0.00 ATOM 498 CD PRO 65 -15.942 3.936 13.560 1.00 0.00 ATOM 499 O PRO 65 -11.408 2.920 13.106 1.00 0.00 ATOM 500 C PRO 65 -12.605 2.815 12.803 1.00 0.00 ATOM 501 N LEU 66 -13.213 1.672 12.267 1.00 0.00 ATOM 502 CA LEU 66 -12.385 0.483 11.991 1.00 0.00 ATOM 503 CB LEU 66 -13.277 -0.739 11.744 1.00 0.00 ATOM 504 CG LEU 66 -14.115 -1.189 12.947 1.00 0.00 ATOM 505 CD1 LEU 66 -15.183 -2.179 12.499 1.00 0.00 ATOM 506 CD2 LEU 66 -13.206 -1.816 13.993 1.00 0.00 ATOM 507 O LEU 66 -11.902 0.969 9.704 1.00 0.00 ATOM 508 C LEU 66 -11.454 0.676 10.811 1.00 0.00 ATOM 509 N VAL 67 -10.159 0.573 11.043 1.00 0.00 ATOM 510 CA VAL 67 -9.245 0.744 9.940 1.00 0.00 ATOM 511 CB VAL 67 -8.456 2.061 10.063 1.00 0.00 ATOM 512 CG1 VAL 67 -9.400 3.254 10.037 1.00 0.00 ATOM 513 CG2 VAL 67 -7.673 2.094 11.368 1.00 0.00 ATOM 514 O VAL 67 -8.122 -1.199 10.805 1.00 0.00 ATOM 515 C VAL 67 -8.234 -0.390 9.875 1.00 0.00 ATOM 516 N ASN 68 -7.496 -0.428 8.768 1.00 0.00 ATOM 517 CA ASN 68 -6.447 -1.419 8.539 1.00 0.00 ATOM 518 CB ASN 68 -6.907 -2.501 7.579 1.00 0.00 ATOM 519 CG ASN 68 -5.907 -3.608 7.393 1.00 0.00 ATOM 520 ND2 ASN 68 -6.148 -4.706 8.063 1.00 0.00 ATOM 521 OD1 ASN 68 -4.969 -3.497 6.594 1.00 0.00 ATOM 522 O ASN 68 -5.372 0.335 7.288 1.00 0.00 ATOM 523 C ASN 68 -5.229 -0.650 8.027 1.00 0.00 ATOM 524 N VAL 69 -4.046 -1.094 8.421 1.00 0.00 ATOM 525 CA VAL 69 -2.789 -0.490 8.010 1.00 0.00 ATOM 526 CB VAL 69 -2.057 0.160 9.199 1.00 0.00 ATOM 527 CG1 VAL 69 -0.725 0.743 8.750 1.00 0.00 ATOM 528 CG2 VAL 69 -2.896 1.282 9.791 1.00 0.00 ATOM 529 O VAL 69 -1.755 -2.670 8.116 1.00 0.00 ATOM 530 C VAL 69 -1.901 -1.622 7.477 1.00 0.00 ATOM 531 N LEU 70 -1.290 -1.358 6.377 1.00 0.00 ATOM 532 CA LEU 70 -0.422 -2.325 5.742 1.00 0.00 ATOM 533 CB LEU 70 -1.129 -2.962 4.539 1.00 0.00 ATOM 534 CG LEU 70 -0.499 -4.263 4.026 1.00 0.00 ATOM 535 CD1 LEU 70 0.738 -3.954 3.195 1.00 0.00 ATOM 536 CD2 LEU 70 -0.147 -5.158 5.206 1.00 0.00 ATOM 537 O LEU 70 0.864 -0.626 4.652 1.00 0.00 ATOM 538 C LEU 70 0.873 -1.665 5.322 1.00 0.00 ATOM 539 N PHE 71 1.980 -2.248 5.778 1.00 0.00 ATOM 540 CA PHE 71 3.317 -1.771 5.447 1.00 0.00 ATOM 541 CB PHE 71 4.210 -1.783 6.689 1.00 0.00 ATOM 542 CG PHE 71 5.595 -1.253 6.443 1.00 0.00 ATOM 543 CD1 PHE 71 5.847 -0.391 5.386 1.00 0.00 ATOM 544 CD2 PHE 71 6.649 -1.618 7.268 1.00 0.00 ATOM 545 CE1 PHE 71 7.120 0.095 5.159 1.00 0.00 ATOM 546 CE2 PHE 71 7.922 -1.131 7.044 1.00 0.00 ATOM 547 CZ PHE 71 8.158 -0.273 5.988 1.00 0.00 ATOM 548 O PHE 71 4.003 -3.907 4.588 1.00 0.00 ATOM 549 C PHE 71 3.766 -2.719 4.346 1.00 0.00 ATOM 550 N VAL 72 3.816 -2.156 3.134 1.00 0.00 ATOM 551 CA VAL 72 4.228 -2.914 1.964 1.00 0.00 ATOM 552 CB VAL 72 3.582 -2.365 0.678 1.00 0.00 ATOM 553 CG1 VAL 72 4.077 -0.954 0.394 1.00 0.00 ATOM 554 CG2 VAL 72 3.879 -3.280 -0.500 1.00 0.00 ATOM 555 O VAL 72 6.234 -2.288 0.809 1.00 0.00 ATOM 556 C VAL 72 5.717 -2.985 1.686 1.00 0.00 ATOM 557 N ASP 73 6.407 -3.824 2.445 1.00 0.00 ATOM 558 CA ASP 73 7.848 -3.990 2.309 1.00 0.00 ATOM 559 CB ASP 73 8.482 -3.839 3.727 1.00 0.00 ATOM 560 CG ASP 73 9.982 -3.657 3.733 1.00 0.00 ATOM 561 OD1 ASP 73 10.549 -3.064 2.783 1.00 0.00 ATOM 562 OD2 ASP 73 10.683 -4.078 4.670 1.00 0.00 ATOM 563 O ASP 73 7.974 -6.353 1.867 1.00 0.00 ATOM 564 C ASP 73 7.804 -5.225 1.407 1.00 0.00 ATOM 565 N ASP 74 7.650 -4.807 0.070 1.00 0.00 ATOM 566 CA ASP 74 7.735 -5.794 -0.965 1.00 0.00 ATOM 567 CB ASP 74 6.660 -5.553 -2.027 1.00 0.00 ATOM 568 CG ASP 74 6.614 -6.603 -3.128 1.00 0.00 ATOM 569 OD1 ASP 74 6.146 -7.687 -2.868 1.00 0.00 ATOM 570 OD2 ASP 74 6.900 -6.270 -4.252 1.00 0.00 ATOM 571 O ASP 74 9.658 -6.696 -2.034 1.00 0.00 ATOM 572 C ASP 74 9.152 -5.707 -1.535 1.00 0.00 ATOM 573 N GLU 75 9.780 -4.534 -1.489 1.00 0.00 ATOM 574 CA GLU 75 11.150 -4.433 -1.986 1.00 0.00 ATOM 575 CB GLU 75 11.591 -2.969 -2.050 1.00 0.00 ATOM 576 CG GLU 75 10.830 -2.128 -3.067 1.00 0.00 ATOM 577 CD GLU 75 9.510 -1.666 -2.517 1.00 0.00 ATOM 578 OE1 GLU 75 9.215 -1.982 -1.389 1.00 0.00 ATOM 579 OE2 GLU 75 8.846 -0.906 -3.180 1.00 0.00 ATOM 580 O GLU 75 13.091 -5.741 -1.407 1.00 0.00 ATOM 581 C GLU 75 12.020 -5.269 -1.038 1.00 0.00 ATOM 582 N ALA 76 11.484 -5.433 0.138 1.00 0.00 ATOM 583 CA ALA 76 12.172 -6.290 1.093 1.00 0.00 ATOM 584 CB ALA 76 11.253 -6.346 2.386 1.00 0.00 ATOM 585 O ALA 76 13.684 -8.205 1.073 1.00 0.00 ATOM 586 C ALA 76 12.588 -7.744 0.714 1.00 0.00 ATOM 587 N LYS 77 11.733 -8.309 -0.133 1.00 0.00 ATOM 588 CA LYS 77 12.042 -9.637 -0.651 1.00 0.00 ATOM 589 CB LYS 77 10.895 -10.153 -1.522 1.00 0.00 ATOM 590 CG LYS 77 9.640 -10.531 -0.748 1.00 0.00 ATOM 591 CD LYS 77 8.600 -11.167 -1.658 1.00 0.00 ATOM 592 CE LYS 77 7.954 -10.135 -2.570 1.00 0.00 ATOM 593 NZ LYS 77 6.868 -10.724 -3.399 1.00 0.00 ATOM 594 O LYS 77 14.138 -10.562 -1.401 1.00 0.00 ATOM 595 C LYS 77 13.337 -9.627 -1.444 1.00 0.00 ATOM 596 N THR 78 13.558 -8.566 -2.207 1.00 0.00 ATOM 597 CA THR 78 14.721 -8.488 -3.072 1.00 0.00 ATOM 598 CB THR 78 14.664 -7.251 -3.986 1.00 0.00 ATOM 599 CG2 THR 78 13.453 -7.322 -4.905 1.00 0.00 ATOM 600 OG1 THR 78 14.582 -6.065 -3.185 1.00 0.00 ATOM 601 O THR 78 17.072 -8.553 -2.794 1.00 0.00 ATOM 602 C THR 78 15.995 -8.448 -2.270 1.00 0.00 ATOM 603 N ASN 79 16.005 -8.495 -0.607 1.00 0.00 ATOM 604 CA ASN 79 17.205 -8.526 0.230 1.00 0.00 ATOM 605 CB ASN 79 18.231 -7.508 -0.232 1.00 0.00 ATOM 606 CG ASN 79 19.570 -7.651 0.437 1.00 0.00 ATOM 607 ND2 ASN 79 20.250 -6.543 0.582 1.00 0.00 ATOM 608 OD1 ASN 79 19.950 -8.739 0.885 1.00 0.00 ATOM 609 O ASN 79 15.815 -7.876 2.079 1.00 0.00 ATOM 610 C ASN 79 16.915 -8.301 1.705 1.00 0.00 ATOM 611 N GLN 80 17.916 -8.636 2.528 1.00 0.00 ATOM 612 CA GLN 80 17.782 -8.441 3.974 1.00 0.00 ATOM 613 CB GLN 80 19.003 -9.005 4.706 1.00 0.00 ATOM 614 CG GLN 80 19.090 -10.521 4.695 1.00 0.00 ATOM 615 CD GLN 80 20.377 -11.031 5.315 1.00 0.00 ATOM 616 OE1 GLN 80 21.259 -10.250 5.679 1.00 0.00 ATOM 617 NE2 GLN 80 20.495 -12.349 5.432 1.00 0.00 ATOM 618 O GLN 80 16.717 -6.605 5.143 1.00 0.00 ATOM 619 C GLN 80 17.609 -6.973 4.360 1.00 0.00 ATOM 620 N ILE 81 18.456 -6.125 3.800 1.00 0.00 ATOM 621 CA ILE 81 18.394 -4.711 4.100 1.00 0.00 ATOM 622 CB ILE 81 19.464 -3.922 3.319 1.00 0.00 ATOM 623 CG1 ILE 81 20.862 -4.273 3.825 1.00 0.00 ATOM 624 CG2 ILE 81 19.249 -2.425 3.490 1.00 0.00 ATOM 625 CD1 ILE 81 21.977 -3.750 2.947 1.00 0.00 ATOM 626 O ILE 81 16.460 -3.355 4.527 1.00 0.00 ATOM 627 C ILE 81 17.053 -4.104 3.738 1.00 0.00 ATOM 628 N PHE 82 16.560 -4.467 2.563 1.00 0.00 ATOM 629 CA PHE 82 15.331 -3.865 2.055 1.00 0.00 ATOM 630 CB PHE 82 15.525 -3.393 0.611 1.00 0.00 ATOM 631 CG PHE 82 16.541 -2.296 0.466 1.00 0.00 ATOM 632 CD1 PHE 82 17.870 -2.594 0.217 1.00 0.00 ATOM 633 CD2 PHE 82 16.170 -0.970 0.580 1.00 0.00 ATOM 634 CE1 PHE 82 18.806 -1.587 0.082 1.00 0.00 ATOM 635 CE2 PHE 82 17.105 0.040 0.444 1.00 0.00 ATOM 636 CZ PHE 82 18.419 -0.264 0.196 1.00 0.00 ATOM 637 O PHE 82 14.998 -6.228 1.587 1.00 0.00 ATOM 638 C PHE 82 14.917 -5.303 2.403 1.00 0.00 ATOM 639 N ALA 83 14.500 -5.358 3.822 1.00 0.00 ATOM 640 CA ALA 83 14.022 -6.580 4.463 1.00 0.00 ATOM 641 CB ALA 83 13.349 -6.257 5.788 1.00 0.00 ATOM 642 O ALA 83 13.269 -8.529 5.634 1.00 0.00 ATOM 643 C ALA 83 13.210 -7.860 4.598 1.00 0.00 ATOM 644 N ARG 84 12.534 -8.243 3.515 1.00 0.00 ATOM 645 CA ARG 84 11.683 -9.435 3.490 1.00 0.00 ATOM 646 CB ARG 84 12.495 -10.720 3.434 1.00 0.00 ATOM 647 CG ARG 84 13.476 -10.807 2.276 1.00 0.00 ATOM 648 CD ARG 84 13.636 -12.171 1.710 1.00 0.00 ATOM 649 NE ARG 84 14.144 -13.158 2.650 1.00 0.00 ATOM 650 CZ ARG 84 15.449 -13.354 2.922 1.00 0.00 ATOM 651 NH1 ARG 84 16.381 -12.662 2.305 1.00 0.00 ATOM 652 NH2 ARG 84 15.768 -14.277 3.811 1.00 0.00 ATOM 653 O ARG 84 10.506 -10.528 5.312 1.00 0.00 ATOM 654 C ARG 84 10.676 -9.490 4.658 1.00 0.00 ATOM 655 N ARG 85 10.104 -8.333 4.984 1.00 0.00 ATOM 656 CA ARG 85 9.135 -8.262 6.068 1.00 0.00 ATOM 657 CB ARG 85 9.768 -7.815 7.377 1.00 0.00 ATOM 658 CG ARG 85 10.957 -8.649 7.829 1.00 0.00 ATOM 659 CD ARG 85 11.715 -8.067 8.966 1.00 0.00 ATOM 660 NE ARG 85 12.828 -8.881 9.428 1.00 0.00 ATOM 661 CZ ARG 85 13.631 -8.564 10.462 1.00 0.00 ATOM 662 NH1 ARG 85 13.474 -7.436 11.120 1.00 0.00 ATOM 663 NH2 ARG 85 14.599 -9.405 10.783 1.00 0.00 ATOM 664 O ARG 85 7.906 -6.657 4.776 1.00 0.00 ATOM 665 C ARG 85 7.923 -7.395 5.757 1.00 0.00 ATOM 666 N ARG 86 6.823 -7.684 6.442 1.00 0.00 ATOM 667 CA ARG 86 5.604 -6.877 6.344 1.00 0.00 ATOM 668 CB ARG 86 4.677 -7.370 5.242 1.00 0.00 ATOM 669 CG ARG 86 4.297 -8.838 5.336 1.00 0.00 ATOM 670 CD ARG 86 3.141 -9.227 4.488 1.00 0.00 ATOM 671 NE ARG 86 2.715 -10.608 4.646 1.00 0.00 ATOM 672 CZ ARG 86 1.700 -11.179 3.966 1.00 0.00 ATOM 673 NH1 ARG 86 0.983 -10.485 3.112 1.00 0.00 ATOM 674 NH2 ARG 86 1.431 -12.451 4.200 1.00 0.00 ATOM 675 O ARG 86 5.082 -7.906 8.417 1.00 0.00 ATOM 676 C ARG 86 5.007 -6.892 7.737 1.00 0.00 ATOM 677 N LEU 87 4.369 -5.793 8.123 1.00 0.00 ATOM 678 CA LEU 87 3.652 -5.723 9.396 1.00 0.00 ATOM 679 CB LEU 87 4.461 -4.912 10.416 1.00 0.00 ATOM 680 CG LEU 87 3.705 -4.532 11.695 1.00 0.00 ATOM 681 CD1 LEU 87 3.209 -5.786 12.401 1.00 0.00 ATOM 682 CD2 LEU 87 4.619 -3.726 12.607 1.00 0.00 ATOM 683 O LEU 87 2.308 -4.041 8.320 1.00 0.00 ATOM 684 C LEU 87 2.300 -5.088 8.984 1.00 0.00 ATOM 685 N SER 88 1.251 -5.755 9.370 1.00 0.00 ATOM 686 CA SER 88 -0.106 -5.229 9.117 1.00 0.00 ATOM 687 CB SER 88 -0.839 -6.214 8.204 1.00 0.00 ATOM 688 OG SER 88 -2.140 -5.750 7.893 1.00 0.00 ATOM 689 O SER 88 -0.637 -5.875 11.344 1.00 0.00 ATOM 690 C SER 88 -0.827 -5.058 10.446 1.00 0.00 ATOM 691 N PHE 89 -1.602 -3.998 10.598 1.00 0.00 ATOM 692 CA PHE 89 -2.257 -3.690 11.876 1.00 0.00 ATOM 693 CB PHE 89 -1.893 -2.273 12.236 1.00 0.00 ATOM 694 CG PHE 89 -0.401 -2.077 12.360 1.00 0.00 ATOM 695 CD1 PHE 89 0.260 -2.412 13.534 1.00 0.00 ATOM 696 CD2 PHE 89 0.346 -1.587 11.293 1.00 0.00 ATOM 697 CE1 PHE 89 1.645 -2.260 13.649 1.00 0.00 ATOM 698 CE2 PHE 89 1.725 -1.434 11.396 1.00 0.00 ATOM 699 CZ PHE 89 2.377 -1.772 12.577 1.00 0.00 ATOM 700 O PHE 89 -4.117 -2.981 10.572 1.00 0.00 ATOM 701 C PHE 89 -3.719 -3.472 11.625 1.00 0.00 ATOM 702 N ASP 90 -4.428 -3.925 12.765 1.00 0.00 ATOM 703 CA ASP 90 -5.873 -3.870 12.701 1.00 0.00 ATOM 704 CB ASP 90 -6.463 -5.282 12.682 1.00 0.00 ATOM 705 CG ASP 90 -7.964 -5.333 12.429 1.00 0.00 ATOM 706 OD1 ASP 90 -8.691 -4.703 13.161 1.00 0.00 ATOM 707 OD2 ASP 90 -8.359 -5.869 11.422 1.00 0.00 ATOM 708 O ASP 90 -5.905 -3.445 15.051 1.00 0.00 ATOM 709 C ASP 90 -6.243 -3.052 13.933 1.00 0.00 ATOM 710 N CYS 91 -7.043 -2.005 13.737 1.00 0.00 ATOM 711 CA CYS 91 -7.474 -1.160 14.841 1.00 0.00 ATOM 712 CB CYS 91 -6.321 -0.313 15.379 1.00 0.00 ATOM 713 SG CYS 91 -5.738 0.957 14.257 1.00 0.00 ATOM 714 O CYS 91 -8.800 0.074 13.250 1.00 0.00 ATOM 715 C CYS 91 -8.523 -0.137 14.419 1.00 0.00 ATOM 716 N THR 92 -8.876 0.827 15.430 1.00 0.00 ATOM 717 CA THR 92 -9.681 1.999 15.182 1.00 0.00 ATOM 718 CB THR 92 -10.734 2.182 16.329 1.00 0.00 ATOM 719 CG2 THR 92 -11.703 1.004 16.415 1.00 0.00 ATOM 720 OG1 THR 92 -10.008 2.293 17.555 1.00 0.00 ATOM 721 O THR 92 -7.836 3.440 15.605 1.00 0.00 ATOM 722 C THR 92 -8.922 3.306 15.054 1.00 0.00 ATOM 723 N ALA 93 -9.461 4.287 14.272 1.00 0.00 ATOM 724 CA ALA 93 -8.853 5.598 14.088 1.00 0.00 ATOM 725 CB ALA 93 -8.875 6.048 12.635 1.00 0.00 ATOM 726 O ALA 93 -10.768 6.647 15.009 1.00 0.00 ATOM 727 C ALA 93 -9.531 6.577 15.006 1.00 0.00 ATOM 728 N THR 94 -8.755 7.345 15.759 1.00 0.00 ATOM 729 CA THR 94 -9.304 8.388 16.631 1.00 0.00 ATOM 730 CB THR 94 -9.186 8.001 18.117 1.00 0.00 ATOM 731 CG2 THR 94 -9.761 9.098 19.001 1.00 0.00 ATOM 732 OG1 THR 94 -9.898 6.780 18.354 1.00 0.00 ATOM 733 O THR 94 -7.336 9.698 16.251 1.00 0.00 ATOM 734 C THR 94 -8.559 9.690 16.356 1.00 0.00 ATOM 735 N LEU 95 -9.257 10.788 16.286 1.00 0.00 ATOM 736 CA LEU 95 -8.630 12.083 16.070 1.00 0.00 ATOM 737 CB LEU 95 -9.683 13.177 16.155 1.00 0.00 ATOM 738 CG LEU 95 -9.203 14.566 15.753 1.00 0.00 ATOM 739 CD1 LEU 95 -8.808 14.630 14.288 1.00 0.00 ATOM 740 CD2 LEU 95 -10.270 15.588 16.064 1.00 0.00 ATOM 741 O LEU 95 -7.822 12.199 18.323 1.00 0.00 ATOM 742 C LEU 95 -7.603 12.452 17.138 1.00 0.00 ATOM 743 N ILE 96 -7.025 12.911 17.445 1.00 0.00 ATOM 744 CA ILE 96 -6.200 13.344 18.572 1.00 0.00 ATOM 745 CB ILE 96 -4.711 13.417 18.186 1.00 0.00 ATOM 746 CG1 ILE 96 -4.212 12.047 17.721 1.00 0.00 ATOM 747 CG2 ILE 96 -3.881 13.919 19.359 1.00 0.00 ATOM 748 CD1 ILE 96 -4.318 10.968 18.775 1.00 0.00 ATOM 749 O ILE 96 -7.078 15.552 18.376 1.00 0.00 ATOM 750 C ILE 96 -6.614 14.696 19.119 1.00 0.00 ATOM 751 N GLU 97 -6.407 14.924 20.422 1.00 0.00 ATOM 752 CA GLU 97 -6.788 16.227 20.984 1.00 0.00 ATOM 753 CB GLU 97 -6.639 16.218 22.507 1.00 0.00 ATOM 754 CG GLU 97 -7.649 15.343 23.233 1.00 0.00 ATOM 755 CD GLU 97 -7.430 15.374 24.720 1.00 0.00 ATOM 756 OE1 GLU 97 -6.489 15.997 25.150 1.00 0.00 ATOM 757 OE2 GLU 97 -8.265 14.870 25.434 1.00 0.00 ATOM 758 O GLU 97 -4.802 17.064 19.916 1.00 0.00 ATOM 759 C GLU 97 -5.929 17.311 20.351 1.00 0.00 ATOM 760 N ARG 98 -6.584 18.540 20.140 1.00 0.00 ATOM 761 CA ARG 98 -5.962 19.607 19.381 1.00 0.00 ATOM 762 CB ARG 98 -6.875 20.816 19.237 1.00 0.00 ATOM 763 CG ARG 98 -8.054 20.619 18.299 1.00 0.00 ATOM 764 CD ARG 98 -8.775 21.870 17.950 1.00 0.00 ATOM 765 NE ARG 98 -9.428 22.522 19.073 1.00 0.00 ATOM 766 CZ ARG 98 -10.674 22.241 19.503 1.00 0.00 ATOM 767 NH1 ARG 98 -11.419 21.351 18.887 1.00 0.00 ATOM 768 NH2 ARG 98 -11.139 22.903 20.548 1.00 0.00 ATOM 769 O ARG 98 -3.651 20.205 19.218 1.00 0.00 ATOM 770 C ARG 98 -4.612 20.016 19.953 1.00 0.00 ATOM 771 N GLU 99 -4.540 20.151 21.262 1.00 0.00 ATOM 772 CA GLU 99 -3.292 20.557 21.882 1.00 0.00 ATOM 773 CB GLU 99 -3.488 20.782 23.384 1.00 0.00 ATOM 774 CG GLU 99 -4.309 22.015 23.732 1.00 0.00 ATOM 775 CD GLU 99 -4.544 22.113 25.213 1.00 0.00 ATOM 776 OE1 GLU 99 -4.142 21.221 25.921 1.00 0.00 ATOM 777 OE2 GLU 99 -5.025 23.133 25.652 1.00 0.00 ATOM 778 O GLU 99 -1.038 19.869 21.566 1.00 0.00 ATOM 779 C GLU 99 -2.219 19.537 21.648 1.00 0.00 ATOM 780 N SER 100 -2.614 18.272 21.582 1.00 0.00 ATOM 781 CA SER 100 -1.618 17.240 21.343 1.00 0.00 ATOM 782 CB SER 100 -2.226 15.868 21.560 1.00 0.00 ATOM 783 OG SER 100 -2.582 15.655 22.898 1.00 0.00 ATOM 784 O SER 100 0.145 17.237 19.695 1.00 0.00 ATOM 785 C SER 100 -1.058 17.381 19.916 1.00 0.00 ATOM 786 N GLN 101 -1.938 17.630 19.019 1.00 0.00 ATOM 787 CA GLN 101 -1.576 17.892 17.625 1.00 0.00 ATOM 788 CB GLN 101 -2.832 18.072 16.770 1.00 0.00 ATOM 789 CG GLN 101 -2.560 18.193 15.280 1.00 0.00 ATOM 790 CD GLN 101 -2.081 19.579 14.890 1.00 0.00 ATOM 791 OE1 GLN 101 -1.123 19.728 14.127 1.00 0.00 ATOM 792 NE2 GLN 101 -2.744 20.602 15.417 1.00 0.00 ATOM 793 O GLN 101 0.223 19.169 16.697 1.00 0.00 ATOM 794 C GLN 101 -0.696 19.124 17.518 1.00 0.00 ATOM 795 N LYS 102 -1.003 20.145 18.323 1.00 0.00 ATOM 796 CA LYS 102 -0.229 21.392 18.351 1.00 0.00 ATOM 797 CB LYS 102 -0.838 22.377 19.349 1.00 0.00 ATOM 798 CG LYS 102 -0.117 23.717 19.429 1.00 0.00 ATOM 799 CD LYS 102 -0.811 24.662 20.399 1.00 0.00 ATOM 800 CE LYS 102 -0.072 25.987 20.507 1.00 0.00 ATOM 801 NZ LYS 102 -0.730 26.914 21.467 1.00 0.00 ATOM 802 O LYS 102 2.168 21.576 18.017 1.00 0.00 ATOM 803 C LYS 102 1.234 21.119 18.701 1.00 0.00 ATOM 804 N TRP 103 1.437 20.439 19.826 1.00 0.00 ATOM 805 CA TRP 103 2.791 20.158 20.242 1.00 0.00 ATOM 806 CB TRP 103 2.794 19.355 21.543 1.00 0.00 ATOM 807 CG TRP 103 4.169 19.034 22.046 1.00 0.00 ATOM 808 CD1 TRP 103 4.961 19.831 22.817 1.00 0.00 ATOM 809 CD2 TRP 103 4.913 17.832 21.814 1.00 0.00 ATOM 810 CE2 TRP 103 6.146 17.970 22.474 1.00 0.00 ATOM 811 CE3 TRP 103 4.651 16.649 21.110 1.00 0.00 ATOM 812 NE1 TRP 103 6.152 19.201 23.079 1.00 0.00 ATOM 813 CZ2 TRP 103 7.115 16.979 22.453 1.00 0.00 ATOM 814 CZ3 TRP 103 5.624 15.656 21.089 1.00 0.00 ATOM 815 CH2 TRP 103 6.819 15.816 21.742 1.00 0.00 ATOM 816 O TRP 103 4.702 19.726 18.835 1.00 0.00 ATOM 817 C TRP 103 3.555 19.393 19.139 1.00 0.00 ATOM 818 N ASN 104 2.898 18.367 18.760 1.00 0.00 ATOM 819 CA ASN 104 3.558 17.544 17.739 1.00 0.00 ATOM 820 CB ASN 104 2.707 16.348 17.354 1.00 0.00 ATOM 821 CG ASN 104 3.387 15.401 16.405 1.00 0.00 ATOM 822 ND2 ASN 104 2.870 15.338 15.204 1.00 0.00 ATOM 823 OD1 ASN 104 4.411 14.790 16.732 1.00 0.00 ATOM 824 O ASN 104 5.005 18.230 15.893 1.00 0.00 ATOM 825 C ASN 104 3.909 18.363 16.481 1.00 0.00 ATOM 826 N GLN 105 2.960 19.193 16.061 1.00 0.00 ATOM 827 CA GLN 105 3.133 19.994 14.858 1.00 0.00 ATOM 828 CB GLN 105 1.868 20.808 14.572 1.00 0.00 ATOM 829 CG GLN 105 1.972 21.711 13.354 1.00 0.00 ATOM 830 CD GLN 105 2.458 23.104 13.706 1.00 0.00 ATOM 831 OE1 GLN 105 2.138 23.637 14.772 1.00 0.00 ATOM 832 NE2 GLN 105 3.230 23.705 12.807 1.00 0.00 ATOM 833 O GLN 105 5.056 21.085 13.971 1.00 0.00 ATOM 834 C GLN 105 4.314 20.940 14.943 1.00 0.00 ATOM 835 N VAL 106 4.504 21.612 16.073 1.00 0.00 ATOM 836 CA VAL 106 5.625 22.523 16.254 1.00 0.00 ATOM 837 CB VAL 106 5.492 23.329 17.560 1.00 0.00 ATOM 838 CG1 VAL 106 6.759 24.129 17.822 1.00 0.00 ATOM 839 CG2 VAL 106 4.284 24.250 17.498 1.00 0.00 ATOM 840 O VAL 106 7.948 22.270 15.774 1.00 0.00 ATOM 841 C VAL 106 6.945 21.769 16.264 1.00 0.00 ATOM 842 N VAL 107 6.938 20.545 16.825 1.00 0.00 ATOM 843 CA VAL 107 8.157 19.741 16.854 1.00 0.00 ATOM 844 CB VAL 107 7.942 18.414 17.606 1.00 0.00 ATOM 845 CG1 VAL 107 9.169 17.525 17.480 1.00 0.00 ATOM 846 CG2 VAL 107 7.624 18.678 19.070 1.00 0.00 ATOM 847 O VAL 107 9.962 19.087 15.371 1.00 0.00 ATOM 848 C VAL 107 8.753 19.373 15.487 1.00 0.00 ATOM 849 N ASP 108 7.920 19.421 14.364 1.00 0.00 ATOM 850 CA ASP 108 8.420 19.108 13.029 1.00 0.00 ATOM 851 CB ASP 108 7.258 18.894 12.057 1.00 0.00 ATOM 852 CG ASP 108 6.392 17.682 12.369 1.00 0.00 ATOM 853 OD1 ASP 108 6.938 16.641 12.647 1.00 0.00 ATOM 854 OD2 ASP 108 5.199 17.841 12.481 1.00 0.00 ATOM 855 O ASP 108 9.307 21.345 13.035 1.00 0.00 ATOM 856 C ASP 108 9.340 20.228 12.533 1.00 0.00 ATOM 857 N GLN 109 10.141 19.957 11.499 1.00 0.00 ATOM 858 CA GLN 109 11.000 21.044 11.034 1.00 0.00 ATOM 859 CB GLN 109 12.474 20.690 11.248 1.00 0.00 ATOM 860 CG GLN 109 12.868 20.519 12.705 1.00 0.00 ATOM 861 CD GLN 109 14.330 20.147 12.870 1.00 0.00 ATOM 862 OE1 GLN 109 15.113 20.213 11.918 1.00 0.00 ATOM 863 NE2 GLN 109 14.704 19.746 14.079 1.00 0.00 ATOM 864 O GLN 109 10.259 21.199 8.753 1.00 0.00 ATOM 865 C GLN 109 10.158 20.616 9.834 1.00 0.00 ATOM 866 N PHE 110 9.312 19.499 9.979 1.00 0.00 ATOM 867 CA PHE 110 8.576 18.936 8.859 1.00 0.00 ATOM 868 CB PHE 110 8.321 17.444 9.083 1.00 0.00 ATOM 869 CG PHE 110 9.564 16.602 9.027 1.00 0.00 ATOM 870 CD1 PHE 110 10.194 16.193 10.192 1.00 0.00 ATOM 871 CD2 PHE 110 10.104 16.217 7.810 1.00 0.00 ATOM 872 CE1 PHE 110 11.338 15.417 10.142 1.00 0.00 ATOM 873 CE2 PHE 110 11.246 15.442 7.756 1.00 0.00 ATOM 874 CZ PHE 110 11.863 15.041 8.924 1.00 0.00 ATOM 875 O PHE 110 7.040 18.395 7.102 1.00 0.00 ATOM 876 C PHE 110 7.272 19.108 8.079 1.00 0.00 ATOM 877 N GLN 111 6.364 19.933 8.625 1.00 0.00 ATOM 878 CA GLN 111 5.080 20.143 7.964 1.00 0.00 ATOM 879 CB GLN 111 4.233 21.150 8.746 1.00 0.00 ATOM 880 CG GLN 111 4.806 22.557 8.774 1.00 0.00 ATOM 881 CD GLN 111 3.998 23.493 9.651 1.00 0.00 ATOM 882 OE1 GLN 111 2.930 23.131 10.152 1.00 0.00 ATOM 883 NE2 GLN 111 4.501 24.707 9.840 1.00 0.00 ATOM 884 O GLN 111 4.524 20.230 5.638 1.00 0.00 ATOM 885 C GLN 111 5.261 20.631 6.537 1.00 0.00 ATOM 886 N GLU 112 6.225 21.500 6.355 1.00 0.00 ATOM 887 CA GLU 112 6.416 22.043 5.019 1.00 0.00 ATOM 888 CB GLU 112 7.446 23.175 5.044 1.00 0.00 ATOM 889 CG GLU 112 6.969 24.446 5.731 1.00 0.00 ATOM 890 CD GLU 112 8.071 25.464 5.822 1.00 0.00 ATOM 891 OE1 GLU 112 9.172 25.158 5.430 1.00 0.00 ATOM 892 OE2 GLU 112 7.789 26.585 6.177 1.00 0.00 ATOM 893 O GLU 112 6.371 20.910 2.926 1.00 0.00 ATOM 894 C GLU 112 6.847 20.956 4.059 1.00 0.00 ATOM 895 N ARG 113 7.721 20.017 4.517 1.00 0.00 ATOM 896 CA ARG 113 8.188 18.924 3.667 1.00 0.00 ATOM 897 CB ARG 113 9.369 18.185 4.279 1.00 0.00 ATOM 898 CG ARG 113 10.673 18.966 4.296 1.00 0.00 ATOM 899 CD ARG 113 11.803 18.257 4.949 1.00 0.00 ATOM 900 NE ARG 113 13.046 19.011 4.988 1.00 0.00 ATOM 901 CZ ARG 113 14.180 18.587 5.578 1.00 0.00 ATOM 902 NH1 ARG 113 14.224 17.436 6.212 1.00 0.00 ATOM 903 NH2 ARG 113 15.243 19.370 5.525 1.00 0.00 ATOM 904 O ARG 113 6.719 17.649 2.229 1.00 0.00 ATOM 905 C ARG 113 6.976 18.045 3.390 1.00 0.00 ATOM 906 N PHE 114 6.096 17.688 4.445 1.00 0.00 ATOM 907 CA PHE 114 4.882 16.886 4.238 1.00 0.00 ATOM 908 CB PHE 114 4.050 16.412 5.430 1.00 0.00 ATOM 909 CG PHE 114 2.980 15.421 5.067 1.00 0.00 ATOM 910 CD1 PHE 114 3.307 14.114 4.754 1.00 0.00 ATOM 911 CD2 PHE 114 1.648 15.799 5.035 1.00 0.00 ATOM 912 CE1 PHE 114 2.321 13.203 4.420 1.00 0.00 ATOM 913 CE2 PHE 114 0.666 14.888 4.699 1.00 0.00 ATOM 914 CZ PHE 114 0.996 13.594 4.393 1.00 0.00 ATOM 915 O PHE 114 3.191 16.752 2.544 1.00 0.00 ATOM 916 C PHE 114 3.897 17.488 3.238 1.00 0.00 ATOM 917 N GLY 115 3.879 18.833 3.384 1.00 0.00 ATOM 918 CA GLY 115 2.937 19.461 2.481 1.00 0.00 ATOM 919 O GLY 115 0.920 20.638 1.887 1.00 0.00 ATOM 920 C GLY 115 1.494 19.547 2.002 1.00 0.00 ATOM 921 N GLN 116 0.897 18.395 1.729 1.00 0.00 ATOM 922 CA GLN 116 -0.491 18.364 1.259 1.00 0.00 ATOM 923 CB GLN 116 -0.889 16.942 0.857 1.00 0.00 ATOM 924 CG GLN 116 -0.967 15.965 2.017 1.00 0.00 ATOM 925 CD GLN 116 -1.510 14.612 1.600 1.00 0.00 ATOM 926 OE1 GLN 116 -1.882 14.407 0.440 1.00 0.00 ATOM 927 NE2 GLN 116 -1.564 13.679 2.544 1.00 0.00 ATOM 928 O GLN 116 -2.384 19.635 2.016 1.00 0.00 ATOM 929 C GLN 116 -1.459 18.881 2.320 1.00 0.00 ATOM 930 N ILE 117 -1.203 18.549 3.592 1.00 0.00 ATOM 931 CA ILE 117 -2.059 18.980 4.688 1.00 0.00 ATOM 932 CB ILE 117 -1.674 18.292 6.010 1.00 0.00 ATOM 933 CG1 ILE 117 -1.866 16.778 5.900 1.00 0.00 ATOM 934 CG2 ILE 117 -2.494 18.854 7.160 1.00 0.00 ATOM 935 CD1 ILE 117 -1.136 15.990 6.964 1.00 0.00 ATOM 936 O ILE 117 -3.031 21.134 5.005 1.00 0.00 ATOM 937 C ILE 117 -2.001 20.494 4.882 1.00 0.00 ATOM 938 N ILE 118 -0.824 21.103 4.862 1.00 0.00 ATOM 939 CA ILE 118 -0.703 22.549 5.068 1.00 0.00 ATOM 940 CB ILE 118 0.781 22.948 5.150 1.00 0.00 ATOM 941 CG1 ILE 118 1.455 22.251 6.335 1.00 0.00 ATOM 942 CG2 ILE 118 0.924 24.450 5.331 1.00 0.00 ATOM 943 CD1 ILE 118 0.844 22.600 7.674 1.00 0.00 ATOM 944 O ILE 118 -2.022 24.367 4.205 1.00 0.00 ATOM 945 C ILE 118 -1.333 23.375 3.957 1.00 0.00 ATOM 946 N GLU 119 -1.155 22.942 2.720 1.00 0.00 ATOM 947 CA GLU 119 -1.654 23.743 1.607 1.00 0.00 ATOM 948 CB GLU 119 -0.495 24.245 0.746 1.00 0.00 ATOM 949 CG GLU 119 0.438 25.210 1.461 1.00 0.00 ATOM 950 CD GLU 119 1.596 25.656 0.590 1.00 0.00 ATOM 951 OE1 GLU 119 1.669 25.209 -0.576 1.00 0.00 ATOM 952 OE2 GLU 119 2.430 26.451 1.069 1.00 0.00 ATOM 953 O GLU 119 -3.371 23.660 -0.055 1.00 0.00 ATOM 954 C GLU 119 -2.603 23.019 0.660 1.00 0.00 ATOM 955 N VAL 120 -2.594 21.693 0.683 1.00 0.00 ATOM 956 CA VAL 120 -3.471 20.936 -0.200 1.00 0.00 ATOM 957 CB VAL 120 -2.738 19.736 -0.831 1.00 0.00 ATOM 958 CG1 VAL 120 -3.649 19.013 -1.812 1.00 0.00 ATOM 959 CG2 VAL 120 -1.466 20.195 -1.526 1.00 0.00 ATOM 960 O VAL 120 -5.836 20.655 0.047 1.00 0.00 ATOM 961 C VAL 120 -4.717 20.412 0.501 1.00 0.00 ATOM 962 N LEU 121 -4.523 19.679 1.599 1.00 0.00 ATOM 963 CA LEU 121 -5.648 19.129 2.347 1.00 0.00 ATOM 964 CB LEU 121 -5.197 17.912 3.164 1.00 0.00 ATOM 965 CG LEU 121 -4.507 16.804 2.359 1.00 0.00 ATOM 966 CD1 LEU 121 -4.230 15.603 3.254 1.00 0.00 ATOM 967 CD2 LEU 121 -5.386 16.408 1.182 1.00 0.00 ATOM 968 O LEU 121 -5.617 21.145 3.645 1.00 0.00 ATOM 969 C LEU 121 -6.273 20.177 3.261 1.00 0.00 ATOM 970 N ARG 122 -7.491 19.904 3.715 1.00 0.00 ATOM 971 CA ARG 122 -8.174 20.821 4.613 1.00 0.00 ATOM 972 CB ARG 122 -9.697 20.584 4.570 1.00 0.00 ATOM 973 CG ARG 122 -10.397 20.905 3.256 1.00 0.00 ATOM 974 CD ARG 122 -11.895 20.981 3.411 1.00 0.00 ATOM 975 NE ARG 122 -12.610 21.010 2.148 1.00 0.00 ATOM 976 CZ ARG 122 -12.689 22.062 1.361 1.00 0.00 ATOM 977 NH1 ARG 122 -12.092 23.185 1.704 1.00 0.00 ATOM 978 NH2 ARG 122 -13.393 21.980 0.240 1.00 0.00 ATOM 979 O ARG 122 -8.037 23.129 5.172 1.00 0.00 ATOM 980 C ARG 122 -7.563 21.992 5.336 1.00 0.00 ATOM 981 N GLY 123 -6.514 21.750 6.237 1.00 0.00 ATOM 982 CA GLY 123 -5.931 22.840 6.977 1.00 0.00 ATOM 983 O GLY 123 -5.372 22.122 9.190 1.00 0.00 ATOM 984 C GLY 123 -5.349 23.040 8.361 1.00 0.00 ATOM 985 N LEU 124 -4.728 24.187 8.587 1.00 0.00 ATOM 986 CA LEU 124 -4.103 24.511 9.866 1.00 0.00 ATOM 987 CB LEU 124 -3.391 25.868 9.778 1.00 0.00 ATOM 988 CG LEU 124 -2.124 25.885 8.915 1.00 0.00 ATOM 989 CD1 LEU 124 -1.626 27.315 8.747 1.00 0.00 ATOM 990 CD2 LEU 124 -1.055 25.015 9.560 1.00 0.00 ATOM 991 O LEU 124 -5.010 23.879 11.980 1.00 0.00 ATOM 992 C LEU 124 -5.192 24.498 10.919 1.00 0.00 ATOM 993 N ALA 125 -6.270 25.256 10.718 1.00 0.00 ATOM 994 CA ALA 125 -7.339 25.299 11.724 1.00 0.00 ATOM 995 CB ALA 125 -8.331 26.313 11.531 1.00 0.00 ATOM 996 O ALA 125 -8.515 23.329 12.354 1.00 0.00 ATOM 997 C ALA 125 -7.890 23.895 11.474 1.00 0.00 ATOM 998 N ASP 126 -7.606 23.347 10.314 1.00 0.00 ATOM 999 CA ASP 126 -8.100 22.020 9.965 1.00 0.00 ATOM 1000 CB ASP 126 -8.799 22.049 8.603 1.00 0.00 ATOM 1001 CG ASP 126 -10.035 22.936 8.548 1.00 0.00 ATOM 1002 OD1 ASP 126 -10.875 22.804 9.408 1.00 0.00 ATOM 1003 OD2 ASP 126 -10.058 23.839 7.747 1.00 0.00 ATOM 1004 O ASP 126 -7.141 19.883 9.500 1.00 0.00 ATOM 1005 C ASP 126 -6.959 21.004 9.956 1.00 0.00 ATOM 1006 N PHE 127 -5.824 21.388 10.490 1.00 0.00 ATOM 1007 CA PHE 127 -4.699 20.462 10.531 1.00 0.00 ATOM 1008 CB PHE 127 -3.387 21.225 10.723 1.00 0.00 ATOM 1009 CG PHE 127 -2.188 20.335 10.889 1.00 0.00 ATOM 1010 CD1 PHE 127 -2.150 19.081 10.299 1.00 0.00 ATOM 1011 CD2 PHE 127 -1.096 20.749 11.637 1.00 0.00 ATOM 1012 CE1 PHE 127 -1.048 18.261 10.451 1.00 0.00 ATOM 1013 CE2 PHE 127 0.008 19.932 11.790 1.00 0.00 ATOM 1014 CZ PHE 127 0.031 18.687 11.196 1.00 0.00 ATOM 1015 O PHE 127 -5.161 19.851 12.783 1.00 0.00 ATOM 1016 C PHE 127 -4.888 19.444 11.639 1.00 0.00 ATOM 1017 N ARG 128 -4.799 18.282 11.174 1.00 0.00 ATOM 1018 CA ARG 128 -5.233 17.209 12.070 1.00 0.00 ATOM 1019 CB ARG 128 -6.720 16.918 11.939 1.00 0.00 ATOM 1020 CG ARG 128 -7.634 18.081 12.291 1.00 0.00 ATOM 1021 CD ARG 128 -7.667 18.418 13.736 1.00 0.00 ATOM 1022 NE ARG 128 -8.652 19.424 14.098 1.00 0.00 ATOM 1023 CZ ARG 128 -8.426 20.753 14.095 1.00 0.00 ATOM 1024 NH1 ARG 128 -7.243 21.238 13.787 1.00 0.00 ATOM 1025 NH2 ARG 128 -9.418 21.556 14.433 1.00 0.00 ATOM 1026 O ARG 128 -3.633 15.628 11.182 1.00 0.00 ATOM 1027 C ARG 128 -4.517 15.864 12.020 1.00 0.00 ATOM 1028 N ILE 129 -4.820 14.836 12.941 1.00 0.00 ATOM 1029 CA ILE 129 -4.175 13.544 12.977 1.00 0.00 ATOM 1030 CB ILE 129 -2.855 13.593 13.769 1.00 0.00 ATOM 1031 CG1 ILE 129 -3.130 13.884 15.246 1.00 0.00 ATOM 1032 CG2 ILE 129 -1.921 14.639 13.181 1.00 0.00 ATOM 1033 CD1 ILE 129 -1.886 13.919 16.103 1.00 0.00 ATOM 1034 O ILE 129 -6.024 12.761 14.283 1.00 0.00 ATOM 1035 C ILE 129 -5.048 12.465 13.581 1.00 0.00 ATOM 1036 N PHE 130 -4.567 11.230 13.493 1.00 0.00 ATOM 1037 CA PHE 130 -5.278 10.086 14.015 1.00 0.00 ATOM 1038 CB PHE 130 -5.936 9.300 12.880 1.00 0.00 ATOM 1039 CG PHE 130 -6.947 10.089 12.101 1.00 0.00 ATOM 1040 CD1 PHE 130 -6.581 10.768 10.954 1.00 0.00 ATOM 1041 CD2 PHE 130 -8.267 10.153 12.518 1.00 0.00 ATOM 1042 CE1 PHE 130 -7.514 11.494 10.237 1.00 0.00 ATOM 1043 CE2 PHE 130 -9.199 10.879 11.801 1.00 0.00 ATOM 1044 CZ PHE 130 -8.827 11.550 10.663 1.00 0.00 ATOM 1045 O PHE 130 -3.129 9.096 14.483 1.00 0.00 ATOM 1046 C PHE 130 -4.339 9.159 14.757 1.00 0.00 ATOM 1047 N GLN 131 -4.901 8.460 15.731 1.00 0.00 ATOM 1048 CA GLN 131 -4.163 7.479 16.495 1.00 0.00 ATOM 1049 CB GLN 131 -4.188 7.832 17.985 1.00 0.00 ATOM 1050 CG GLN 131 -5.582 8.021 18.556 1.00 0.00 ATOM 1051 CD GLN 131 -5.587 8.049 20.073 1.00 0.00 ATOM 1052 OE1 GLN 131 -4.608 7.664 20.718 1.00 0.00 ATOM 1053 NE2 GLN 131 -6.692 8.505 20.652 1.00 0.00 ATOM 1054 O GLN 131 -6.073 6.173 16.099 1.00 0.00 ATOM 1055 C GLN 131 -4.883 6.186 16.146 1.00 0.00 ATOM 1056 N LEU 132 -4.141 5.187 15.741 1.00 0.00 ATOM 1057 CA LEU 132 -4.750 3.884 15.448 1.00 0.00 ATOM 1058 CB LEU 132 -4.179 3.312 14.144 1.00 0.00 ATOM 1059 CG LEU 132 -4.934 3.711 12.870 1.00 0.00 ATOM 1060 CD1 LEU 132 -5.033 5.229 12.774 1.00 0.00 ATOM 1061 CD2 LEU 132 -4.219 3.140 11.654 1.00 0.00 ATOM 1062 O LEU 132 -3.388 2.617 16.944 1.00 0.00 ATOM 1063 C LEU 132 -4.523 2.927 16.603 1.00 0.00 ATOM 1064 N THR 133 -5.574 2.405 17.208 1.00 0.00 ATOM 1065 CA THR 133 -5.428 1.481 18.319 1.00 0.00 ATOM 1066 CB THR 133 -6.757 1.204 19.053 1.00 0.00 ATOM 1067 CG2 THR 133 -7.432 2.515 19.492 1.00 0.00 ATOM 1068 OG1 THR 133 -7.656 0.515 18.160 1.00 0.00 ATOM 1069 O THR 133 -5.131 -0.366 16.805 1.00 0.00 ATOM 1070 C THR 133 -4.793 0.156 17.876 1.00 0.00 ATOM 1071 N PRO 134 -4.203 -0.538 18.845 1.00 0.00 ATOM 1072 CA PRO 134 -3.546 -1.823 18.619 1.00 0.00 ATOM 1073 CB PRO 134 -2.383 -1.754 19.590 1.00 0.00 ATOM 1074 CG PRO 134 -2.889 -0.900 20.700 1.00 0.00 ATOM 1075 CD PRO 134 -3.600 0.222 19.959 1.00 0.00 ATOM 1076 O PRO 134 -4.432 -3.496 20.095 1.00 0.00 ATOM 1077 C PRO 134 -4.467 -2.990 18.978 1.00 0.00 ATOM 1078 N LYS 135 -5.247 -3.518 17.887 1.00 0.00 ATOM 1079 CA LYS 135 -6.079 -4.676 18.151 1.00 0.00 ATOM 1080 CB LYS 135 -7.425 -4.542 17.436 1.00 0.00 ATOM 1081 CG LYS 135 -8.398 -5.681 17.710 1.00 0.00 ATOM 1082 CD LYS 135 -9.748 -5.425 17.056 1.00 0.00 ATOM 1083 CE LYS 135 -10.735 -6.541 17.365 1.00 0.00 ATOM 1084 NZ LYS 135 -12.073 -6.282 16.768 1.00 0.00 ATOM 1085 O LYS 135 -5.357 -6.958 18.359 1.00 0.00 ATOM 1086 C LYS 135 -5.315 -5.916 17.698 1.00 0.00 ATOM 1087 N GLU 136 -4.578 -5.785 16.600 1.00 0.00 ATOM 1088 CA GLU 136 -3.792 -6.882 16.056 1.00 0.00 ATOM 1089 CB GLU 136 -4.633 -7.641 15.031 1.00 0.00 ATOM 1090 CG GLU 136 -5.973 -8.118 15.574 1.00 0.00 ATOM 1091 CD GLU 136 -6.817 -8.794 14.523 1.00 0.00 ATOM 1092 OE1 GLU 136 -7.180 -8.121 13.528 1.00 0.00 ATOM 1093 OE2 GLU 136 -7.119 -9.995 14.695 1.00 0.00 ATOM 1094 O GLU 136 -2.682 -5.592 14.387 1.00 0.00 ATOM 1095 C GLU 136 -2.560 -6.401 15.309 1.00 0.00 ATOM 1096 N GLY 137 -1.384 -6.892 15.697 1.00 0.00 ATOM 1097 CA GLY 137 -0.159 -6.553 14.967 1.00 0.00 ATOM 1098 O GLY 137 0.533 -8.847 15.125 1.00 0.00 ATOM 1099 C GLY 137 0.326 -7.865 14.379 1.00 0.00 ATOM 1100 N ARG 138 0.534 -7.977 12.911 1.00 0.00 ATOM 1101 CA ARG 138 0.979 -9.203 12.256 1.00 0.00 ATOM 1102 CB ARG 138 -0.065 -9.753 11.296 1.00 0.00 ATOM 1103 CG ARG 138 -1.439 -9.979 11.905 1.00 0.00 ATOM 1104 CD ARG 138 -2.515 -10.233 10.914 1.00 0.00 ATOM 1105 NE ARG 138 -2.857 -9.085 10.088 1.00 0.00 ATOM 1106 CZ ARG 138 -3.739 -9.112 9.070 1.00 0.00 ATOM 1107 NH1 ARG 138 -4.340 -10.227 8.722 1.00 0.00 ATOM 1108 NH2 ARG 138 -3.964 -7.988 8.410 1.00 0.00 ATOM 1109 O ARG 138 2.470 -7.978 10.825 1.00 0.00 ATOM 1110 C ARG 138 2.325 -8.932 11.585 1.00 0.00 ATOM 1111 N PHE 139 3.300 -9.785 11.877 1.00 0.00 ATOM 1112 CA PHE 139 4.632 -9.691 11.293 1.00 0.00 ATOM 1113 CB PHE 139 5.695 -9.653 12.392 1.00 0.00 ATOM 1114 CG PHE 139 7.099 -9.804 11.882 1.00 0.00 ATOM 1115 CD1 PHE 139 7.669 -8.829 11.077 1.00 0.00 ATOM 1116 CD2 PHE 139 7.854 -10.921 12.205 1.00 0.00 ATOM 1117 CE1 PHE 139 8.961 -8.967 10.607 1.00 0.00 ATOM 1118 CE2 PHE 139 9.146 -11.063 11.737 1.00 0.00 ATOM 1119 CZ PHE 139 9.700 -10.083 10.937 1.00 0.00 ATOM 1120 O PHE 139 4.441 -12.018 10.673 1.00 0.00 ATOM 1121 C PHE 139 4.824 -10.882 10.359 1.00 0.00 ATOM 1122 N VAL 140 5.383 -10.609 9.191 1.00 0.00 ATOM 1123 CA VAL 140 5.655 -11.651 8.206 1.00 0.00 ATOM 1124 CB VAL 140 4.690 -11.562 7.008 1.00 0.00 ATOM 1125 CG1 VAL 140 5.123 -12.516 5.905 1.00 0.00 ATOM 1126 CG2 VAL 140 3.266 -11.867 7.447 1.00 0.00 ATOM 1127 O VAL 140 7.568 -10.363 7.512 1.00 0.00 ATOM 1128 C VAL 140 7.109 -11.483 7.760 1.00 0.00 ATOM 1129 N ILE 141 7.843 -12.583 7.692 1.00 0.00 ATOM 1130 CA ILE 141 9.215 -12.528 7.196 1.00 0.00 ATOM 1131 CB ILE 141 10.235 -12.551 8.349 1.00 0.00 ATOM 1132 CG1 ILE 141 11.660 -12.432 7.804 1.00 0.00 ATOM 1133 CG2 ILE 141 10.125 -13.849 9.132 1.00 0.00 ATOM 1134 CD1 ILE 141 12.698 -12.149 8.866 1.00 0.00 ATOM 1135 O ILE 141 8.621 -14.633 6.317 1.00 0.00 ATOM 1136 C ILE 141 9.353 -13.664 6.216 1.00 0.00 ATOM 1137 N GLY 142 9.973 -13.451 5.071 1.00 0.00 ATOM 1138 CA GLY 142 10.160 -14.471 4.075 1.00 0.00 ATOM 1139 O GLY 142 11.013 -15.539 6.026 1.00 0.00 ATOM 1140 C GLY 142 10.646 -15.679 4.858 1.00 0.00 ATOM 1141 N PHE 143 10.505 -16.981 4.380 1.00 0.00 ATOM 1142 CA PHE 143 10.764 -18.254 5.063 1.00 0.00 ATOM 1143 CB PHE 143 12.268 -18.514 5.157 1.00 0.00 ATOM 1144 CG PHE 143 12.962 -18.542 3.825 1.00 0.00 ATOM 1145 CD1 PHE 143 13.695 -17.449 3.386 1.00 0.00 ATOM 1146 CD2 PHE 143 12.884 -19.659 3.008 1.00 0.00 ATOM 1147 CE1 PHE 143 14.335 -17.474 2.160 1.00 0.00 ATOM 1148 CE2 PHE 143 13.523 -19.688 1.784 1.00 0.00 ATOM 1149 CZ PHE 143 14.249 -18.592 1.360 1.00 0.00 ATOM 1150 O PHE 143 10.472 -18.992 7.323 1.00 0.00 ATOM 1151 C PHE 143 10.111 -18.205 6.459 1.00 0.00 ATOM 1152 N GLY 144 9.135 -17.237 6.848 1.00 0.00 ATOM 1153 CA GLY 144 8.413 -17.397 8.092 1.00 0.00 ATOM 1154 O GLY 144 7.838 -15.069 8.183 1.00 0.00 ATOM 1155 C GLY 144 7.474 -16.236 8.383 1.00 0.00 ATOM 1156 N ALA 145 6.307 -16.549 8.932 1.00 0.00 ATOM 1157 CA ALA 145 5.321 -15.534 9.262 1.00 0.00 ATOM 1158 CB ALA 145 4.277 -15.444 8.148 1.00 0.00 ATOM 1159 O ALA 145 4.818 -16.951 11.141 1.00 0.00 ATOM 1160 C ALA 145 4.874 -15.809 10.697 1.00 0.00 ATOM 1161 N ALA 146 4.711 -14.705 11.440 1.00 0.00 ATOM 1162 CA ALA 146 4.219 -14.779 12.815 1.00 0.00 ATOM 1163 CB ALA 146 5.362 -14.759 13.818 1.00 0.00 ATOM 1164 O ALA 146 3.740 -12.418 13.037 1.00 0.00 ATOM 1165 C ALA 146 3.313 -13.585 13.080 1.00 0.00 ATOM 1166 N TYR 147 2.122 -13.884 13.554 1.00 0.00 ATOM 1167 CA TYR 147 1.159 -12.863 13.863 1.00 0.00 ATOM 1168 CB TYR 147 -0.203 -13.217 13.285 1.00 0.00 ATOM 1169 CG TYR 147 -0.202 -13.358 11.786 1.00 0.00 ATOM 1170 CD1 TYR 147 0.831 -12.830 11.007 1.00 0.00 ATOM 1171 CD2 TYR 147 -1.326 -13.838 11.132 1.00 0.00 ATOM 1172 CE1 TYR 147 0.745 -12.818 9.640 1.00 0.00 ATOM 1173 CE2 TYR 147 -1.387 -13.883 9.767 1.00 0.00 ATOM 1174 CZ TYR 147 -0.333 -13.410 9.032 1.00 0.00 ATOM 1175 OH TYR 147 -0.408 -13.424 7.687 1.00 0.00 ATOM 1176 O TYR 147 0.788 -13.722 16.069 1.00 0.00 ATOM 1177 C TYR 147 1.041 -12.734 15.380 1.00 0.00 ATOM 1178 N HIS 148 1.288 -11.406 15.840 1.00 0.00 ATOM 1179 CA HIS 148 1.130 -11.155 17.274 1.00 0.00 ATOM 1180 CB HIS 148 2.317 -10.354 17.818 1.00 0.00 ATOM 1181 CG HIS 148 3.615 -11.099 17.778 1.00 0.00 ATOM 1182 CD2 HIS 148 4.043 -12.103 16.978 1.00 0.00 ATOM 1183 ND1 HIS 148 4.654 -10.830 18.645 1.00 0.00 ATOM 1184 CE1 HIS 148 5.665 -11.639 18.378 1.00 0.00 ATOM 1185 NE2 HIS 148 5.319 -12.420 17.371 1.00 0.00 ATOM 1186 O HIS 148 -0.303 -9.247 17.055 1.00 0.00 ATOM 1187 C HIS 148 -0.201 -10.421 17.408 1.00 0.00 ATOM 1188 N ILE 149 -1.134 -11.057 18.052 1.00 0.00 ATOM 1189 CA ILE 149 -2.460 -10.473 18.221 1.00 0.00 ATOM 1190 CB ILE 149 -3.506 -11.510 17.777 1.00 0.00 ATOM 1191 CG1 ILE 149 -3.264 -11.924 16.323 1.00 0.00 ATOM 1192 CG2 ILE 149 -4.909 -10.936 17.883 1.00 0.00 ATOM 1193 CD1 ILE 149 -4.120 -13.086 15.869 1.00 0.00 ATOM 1194 O ILE 149 -2.799 -10.983 20.533 1.00 0.00 ATOM 1195 C ILE 149 -2.777 -10.114 19.671 1.00 0.00 ATOM 1196 N SER 150 -2.993 -8.812 19.902 1.00 0.00 ATOM 1197 CA SER 150 -3.369 -8.328 21.243 1.00 0.00 ATOM 1198 CB SER 150 -3.478 -6.816 21.242 1.00 0.00 ATOM 1199 OG SER 150 -3.856 -6.314 22.494 1.00 0.00 ATOM 1200 O SER 150 -5.582 -9.093 20.864 1.00 0.00 ATOM 1201 C SER 150 -4.669 -8.964 21.680 1.00 0.00 ATOM 1202 N GLY 151 -4.643 -9.605 22.846 1.00 0.00 ATOM 1203 CA GLY 151 -5.809 -10.284 23.417 1.00 0.00 ATOM 1204 O GLY 151 -4.322 -10.320 25.307 1.00 0.00 ATOM 1205 C GLY 151 -5.457 -10.060 24.872 1.00 0.00 ATOM 1206 N ASP 152 -6.577 -9.707 25.636 1.00 0.00 ATOM 1207 CA ASP 152 -6.577 -9.370 27.082 1.00 0.00 ATOM 1208 CB ASP 152 -6.841 -10.620 27.925 1.00 0.00 ATOM 1209 CG ASP 152 -7.105 -10.341 29.399 1.00 0.00 ATOM 1210 OD1 ASP 152 -7.316 -9.201 29.739 1.00 0.00 ATOM 1211 OD2 ASP 152 -7.249 -11.281 30.144 1.00 0.00 ATOM 1212 O ASP 152 -4.556 -9.356 28.361 1.00 0.00 ATOM 1213 C ASP 152 -5.308 -8.720 27.620 1.00 0.00 ATOM 1214 N ARG 153 -4.991 -7.529 27.121 1.00 0.00 ATOM 1215 CA ARG 153 -3.804 -6.820 27.581 1.00 0.00 ATOM 1216 CB ARG 153 -3.939 -6.350 29.022 1.00 0.00 ATOM 1217 CG ARG 153 -5.076 -5.374 29.272 1.00 0.00 ATOM 1218 CD ARG 153 -5.242 -4.979 30.695 1.00 0.00 ATOM 1219 NE ARG 153 -6.445 -4.210 30.971 1.00 0.00 ATOM 1220 CZ ARG 153 -6.823 -3.793 32.195 1.00 0.00 ATOM 1221 NH1 ARG 153 -6.119 -4.099 33.262 1.00 0.00 ATOM 1222 NH2 ARG 153 -7.936 -3.089 32.299 1.00 0.00 ATOM 1223 O ARG 153 -1.609 -7.597 28.185 1.00 0.00 ATOM 1224 C ARG 153 -2.545 -7.662 27.383 1.00 0.00 ATOM 1225 N LEU 154 -2.556 -8.524 26.375 1.00 0.00 ATOM 1226 CA LEU 154 -1.387 -9.366 26.108 1.00 0.00 ATOM 1227 CB LEU 154 -1.470 -10.677 26.884 1.00 0.00 ATOM 1228 CG LEU 154 -2.585 -11.691 26.623 1.00 0.00 ATOM 1229 CD1 LEU 154 -2.399 -12.366 25.262 1.00 0.00 ATOM 1230 CD2 LEU 154 -2.546 -12.738 27.728 1.00 0.00 ATOM 1231 O LEU 154 -2.118 -9.208 23.850 1.00 0.00 ATOM 1232 C LEU 154 -1.338 -9.741 24.632 1.00 0.00 ATOM 1233 N ASP 155 -0.243 -10.381 24.228 1.00 0.00 ATOM 1234 CA ASP 155 -0.054 -10.798 22.838 1.00 0.00 ATOM 1235 CB ASP 155 1.273 -10.263 22.292 1.00 0.00 ATOM 1236 CG ASP 155 1.667 -10.827 20.935 1.00 0.00 ATOM 1237 OD1 ASP 155 0.813 -10.935 20.087 1.00 0.00 ATOM 1238 OD2 ASP 155 2.840 -10.997 20.703 1.00 0.00 ATOM 1239 O ASP 155 0.649 -13.030 23.336 1.00 0.00 ATOM 1240 C ASP 155 -0.093 -12.311 22.672 1.00 0.00 ATOM 1241 N THR 156 -1.036 -12.794 21.742 1.00 0.00 ATOM 1242 CA THR 156 -1.148 -14.186 21.351 1.00 0.00 ATOM 1243 CB THR 156 -2.616 -14.591 21.120 1.00 0.00 ATOM 1244 CG2 THR 156 -2.705 -16.043 20.682 1.00 0.00 ATOM 1245 OG1 THR 156 -3.357 -14.425 22.335 1.00 0.00 ATOM 1246 O THR 156 -0.677 -13.642 19.059 1.00 0.00 ATOM 1247 C THR 156 -0.344 -14.293 20.055 1.00 0.00 ATOM 1248 N LEU 157 0.591 -15.242 20.019 1.00 0.00 ATOM 1249 CA LEU 157 1.441 -15.478 18.851 1.00 0.00 ATOM 1250 CB LEU 157 2.916 -15.687 19.253 1.00 0.00 ATOM 1251 CG LEU 157 3.830 -16.124 18.095 1.00 0.00 ATOM 1252 CD1 LEU 157 3.885 -15.146 16.941 1.00 0.00 ATOM 1253 CD2 LEU 157 5.219 -16.437 18.699 1.00 0.00 ATOM 1254 O LEU 157 0.912 -17.841 18.673 1.00 0.00 ATOM 1255 C LEU 157 1.105 -16.773 18.080 1.00 0.00 ATOM 1256 N VAL 158 0.933 -16.682 16.770 1.00 0.00 ATOM 1257 CA VAL 158 0.673 -17.819 15.911 1.00 0.00 ATOM 1258 CB VAL 158 -0.748 -17.769 15.322 1.00 0.00 ATOM 1259 CG1 VAL 158 -0.986 -18.957 14.401 1.00 0.00 ATOM 1260 CG2 VAL 158 -1.786 -17.741 16.433 1.00 0.00 ATOM 1261 O VAL 158 1.794 -16.921 13.968 1.00 0.00 ATOM 1262 C VAL 158 1.719 -17.834 14.793 1.00 0.00 ATOM 1263 N PRO 159 2.526 -18.887 14.760 1.00 0.00 ATOM 1264 CA PRO 159 3.502 -19.094 13.707 1.00 0.00 ATOM 1265 CB PRO 159 4.357 -20.237 14.233 1.00 0.00 ATOM 1266 CG PRO 159 4.218 -20.153 15.723 1.00 0.00 ATOM 1267 CD PRO 159 2.759 -19.762 15.909 1.00 0.00 ATOM 1268 O PRO 159 2.076 -20.382 12.298 1.00 0.00 ATOM 1269 C PRO 159 2.791 -19.384 12.399 1.00 0.00 ATOM 1270 N ILE 160 3.137 -18.633 11.351 1.00 0.00 ATOM 1271 CA ILE 160 2.532 -18.817 10.044 1.00 0.00 ATOM 1272 CB ILE 160 1.784 -17.542 9.622 1.00 0.00 ATOM 1273 CG1 ILE 160 0.645 -17.227 10.616 1.00 0.00 ATOM 1274 CG2 ILE 160 1.180 -17.585 8.185 1.00 0.00 ATOM 1275 CD1 ILE 160 -0.451 -18.307 10.657 1.00 0.00 ATOM 1276 O ILE 160 4.688 -18.419 9.116 1.00 0.00 ATOM 1277 C ILE 160 3.580 -18.914 8.931 1.00 0.00 ATOM 1278 N THR 161 3.211 -19.598 7.856 1.00 0.00 ATOM 1279 CA THR 161 4.122 -19.729 6.725 1.00 0.00 ATOM 1280 CB THR 161 3.854 -21.021 5.930 1.00 0.00 ATOM 1281 CG2 THR 161 4.798 -21.121 4.742 1.00 0.00 ATOM 1282 OG1 THR 161 4.041 -22.158 6.782 1.00 0.00 ATOM 1283 O THR 161 2.902 -18.223 5.273 1.00 0.00 ATOM 1284 C THR 161 3.966 -18.518 5.832 1.00 0.00 ATOM 1285 N GLY 162 5.105 -17.758 5.596 1.00 0.00 ATOM 1286 CA GLY 162 5.100 -16.620 4.725 1.00 0.00 ATOM 1287 O GLY 162 5.213 -18.245 2.988 1.00 0.00 ATOM 1288 C GLY 162 5.218 -17.051 3.274 1.00 0.00 ATOM 1289 N ASP 163 5.291 -16.106 2.320 1.00 0.00 ATOM 1290 CA ASP 163 5.403 -16.445 0.909 1.00 0.00 ATOM 1291 CB ASP 163 5.339 -15.181 0.048 1.00 0.00 ATOM 1292 CG ASP 163 6.454 -14.179 0.318 1.00 0.00 ATOM 1293 OD1 ASP 163 6.570 -13.737 1.437 1.00 0.00 ATOM 1294 OD2 ASP 163 7.271 -13.983 -0.549 1.00 0.00 ATOM 1295 O ASP 163 6.714 -18.095 -0.228 1.00 0.00 ATOM 1296 C ASP 163 6.690 -17.206 0.627 1.00 0.00 ATOM 1297 N LYS 164 7.704 -17.008 1.446 1.00 0.00 ATOM 1298 CA LYS 164 8.989 -17.674 1.278 1.00 0.00 ATOM 1299 CB LYS 164 10.135 -16.682 1.481 1.00 0.00 ATOM 1300 CG LYS 164 10.129 -15.535 0.501 1.00 0.00 ATOM 1301 CD LYS 164 10.387 -16.051 -0.895 1.00 0.00 ATOM 1302 CE LYS 164 10.407 -14.936 -1.913 1.00 0.00 ATOM 1303 NZ LYS 164 10.654 -15.524 -3.245 1.00 0.00 ATOM 1304 O LYS 164 10.219 -19.519 2.194 1.00 0.00 ATOM 1305 C LYS 164 9.110 -18.996 2.040 1.00 0.00 ATOM 1306 N GLY 165 8.026 -19.422 2.678 1.00 0.00 ATOM 1307 CA GLY 165 8.047 -20.669 3.413 1.00 0.00 ATOM 1308 O GLY 165 8.585 -21.617 5.535 1.00 0.00 ATOM 1309 C GLY 165 8.418 -20.582 4.881 1.00 0.00 TER END