PFRMAT TS TARGET T0357 AUTHOR 5370-1100-4902 METHOD The SAM-T06 hand predictions use methods similar to SAM_T04 in CASP6 and METHOD the SAM-T02 method in CASP5. METHOD METHOD We start with a fully automated method (implemented as the SAM_T06 server): METHOD METHOD Use the SAM-T2K and SAM-T04 methods for finding homologs of the METHOD target and aligning them. The hand method also uses the METHOD experimental new SAM-T06 alignment method, which we hope is both METHOD more sensitive and lass prone to contamination by unrelated sequences. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignments. METHOD METHOD We currently use 10 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 O_NOTOR2 an alphabet for predicting characteristics of hydrogen METHOD bonds from the carbonyl oxygen METHOD N_NOTOR2 an alphabet for predicting characteristics of hydrogen METHOD bonds from the amide nitrogen METHOD We hope to add more networks for other alphabets over the summer. METHOD METHOD We make 2-track HMMs with each alphabet (1.0 amino acid + 0.3 METHOD local structure) and use them to score a template library of about METHOD 8000 (t06), 10000 (t04), or 15000 (t2k) templates. METHOD The template libraries are expanded weekly, but old template HMMs METHOD are not rebuilt. METHOD 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 One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence. METHOD METHOD All the logs of e-values were combined in a weighted average (with METHOD rather arbitrary weights, since we still have not taken the time METHOD to optimize them), and the best templates ranked. 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 which tested METHOD best for alignment. METHOD METHOD Residue-residue contact predictions are made using mutual METHOD information, pairwise contact potentials, joint entropy, and other METHOD signals combined by a neural net. The contact prediction method METHOD is expected to evolve over the summer, as new features are METHOD selected and new networks trained. METHOD METHOD Then the "undertaker" program (named because it optimizes burial) METHOD is used to try to combine the alignments and the fragments into a METHOD consistent 3D model. No single alignment or parent template was METHOD used as a frozen core, though in many cases one had much more METHOD influence than the others. The alignment scores were not passed METHOD to undertaker, but were used only to pick the set of alignments METHOD and fragments that undertaker would see. Helix and strand METHOD constraints generated from the secondary-structure predictions are METHOD passed to undertaker to use in the cost function, as are the METHOD residue-residue contact prediction. 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. METHOD METHOD After the automatic prediction is done, we examine it by hand and try METHOD to fix any flaws that we see. This generally involves rerunning METHOD undertaker with new cost functions, increasing the weights for METHOD features we want to see and decreasing the weights where we think the METHOD optimization has gone overboard. Sometimes we will add new templates METHOD or remove ones that we think are misleading the optimization process. METHOD METHOD New this year, we are also occasionally using ProteinShop to METHOD manipulate proteins by hand, to produce starting points for undertaker METHOD optimization. We expect this to be most useful in new-fold all-alpha METHOD proteins, where undertaker often gets trapped in poor local minima by METHOD extending helices too far. METHOD METHOD Another new trick is to optimize models with gromacs to knock them out METHOD of a local minimum. The gromacs optimization does terrible things to METHOD the model (messing up sidechains and peptide planes), but is good at METHOD removing clashes. The resulting models are only a small distance from METHOD the pre-optimization models, but score much worse with the undertaker METHOD cost functions, so undertaker can move them more freely than models it METHOD has optimized itself. METHOD METHOD METHOD For this preliminary submission I chose 5 models: METHOD METHOD Model 1 is try13-opt2, the cloest we got to forming a barrel, and the METHOD best scoring with the unconstrained costfcn. METHOD METHOD Model 2 is try9-opt2.gromacs0.repack-nonPC, which is try9-opt2, METHOD reoptimized by gromacs (which mainly removes small clashes), METHOD then with sidechains repacked by rosetta. It is rosetta's METHOD favorite of the models for which it repacked sidechains. METHOD METHOD Model 3 is try2-opt2, which scores best with several of the cost METHOD functions we tried. It was optimized from alignments, METHOD including 1i9aA, 1v7lA, 1uarA, 2gwhA, 1p3rA, 1jtkA. Several METHOD of these alignments may have ended up being just short METHOD fragments. METHOD METHOD Model 4 is try14-opt2.gromacs0.repack-nonPC, which is try9-opt2, METHOD reoptimized by gromacs (which mainly removes small clashes), METHOD then with sidechains repacked by rosetta. It is rosetta's METHOD 2nd favorite of the models for which it repacked sidechains. METHOD Try14-opt2 was created from alignments by undertaker, with the METHOD sam barrel-forming costfcn as try13-opt2. METHOD METHOD Model 5 is try1-opt2, the fully automatic model. REMARK 6 REMARK 6 T0357 model 2 Tue Jul 25 19:25:02 2006 MODEL 2 PARENT 1v7l_A 2d13_A 2etl_A 1qdl_B 2g74_A REMARK 7 REMARK 7 ALLPARENTS 1v7l_A 2d13_A 2etl_A 1qdl_B 2g74_A 1x83_A 1vi4_A REMARK 7 ALLPARENTS 1ppv_A 1vbk_A 1q54_A 1hx3_A 1rxy_A 1nbw_A 2bsx_A REMARK 7 ALLPARENTS 1q1g_A 1p3r_A 1qme_A 1r67_A 1bg6 2gan_A ATOM 1 N MET 1 -10.772 6.065 -7.706 1.00 0.00 ATOM 2 CA MET 1 -11.180 5.413 -8.957 1.00 0.00 ATOM 3 CB MET 1 -10.421 6.015 -10.138 1.00 0.00 ATOM 4 CG MET 1 -10.851 5.487 -11.499 1.00 0.00 ATOM 5 SD MET 1 -10.043 6.345 -12.864 1.00 0.00 ATOM 6 CE MET 1 -10.931 7.899 -12.861 1.00 0.00 ATOM 7 O MET 1 -11.905 3.159 -9.046 1.00 0.00 ATOM 8 C MET 1 -10.950 3.903 -8.898 1.00 0.00 ATOM 9 N VAL 2 -9.752 3.506 -8.465 1.00 0.00 ATOM 10 CA VAL 2 -9.378 2.079 -8.365 1.00 0.00 ATOM 11 CB VAL 2 -8.291 1.668 -9.371 1.00 0.00 ATOM 12 CG1 VAL 2 -7.919 0.185 -9.291 1.00 0.00 ATOM 13 CG2 VAL 2 -8.725 1.909 -10.810 1.00 0.00 ATOM 14 O VAL 2 -8.075 2.614 -6.422 1.00 0.00 ATOM 15 C VAL 2 -8.845 1.815 -6.956 1.00 0.00 ATOM 16 N LYS 3 -9.349 0.743 -6.371 1.00 0.00 ATOM 17 CA LYS 3 -8.818 0.245 -5.094 1.00 0.00 ATOM 18 CB LYS 3 -9.851 -0.637 -4.392 1.00 0.00 ATOM 19 CG LYS 3 -11.100 0.102 -3.932 1.00 0.00 ATOM 20 CD LYS 3 -12.070 -0.835 -3.228 1.00 0.00 ATOM 21 CE LYS 3 -13.312 -0.095 -2.755 1.00 0.00 ATOM 22 NZ LYS 3 -14.266 -0.997 -2.055 1.00 0.00 ATOM 23 O LYS 3 -7.525 -1.522 -6.045 1.00 0.00 ATOM 24 C LYS 3 -7.535 -0.516 -5.350 1.00 0.00 ATOM 25 N PHE 4 -6.511 -0.038 -4.672 1.00 0.00 ATOM 26 CA PHE 4 -5.297 -0.842 -4.633 1.00 0.00 ATOM 27 CB PHE 4 -4.164 -0.447 -5.551 1.00 0.00 ATOM 28 CG PHE 4 -4.253 -0.987 -6.950 1.00 0.00 ATOM 29 CD1 PHE 4 -4.976 -2.127 -7.157 1.00 0.00 ATOM 30 CD2 PHE 4 -3.577 -0.410 -8.008 1.00 0.00 ATOM 31 CE1 PHE 4 -5.044 -2.610 -8.428 1.00 0.00 ATOM 32 CE2 PHE 4 -3.650 -0.900 -9.268 1.00 0.00 ATOM 33 CZ PHE 4 -4.390 -2.022 -9.487 1.00 0.00 ATOM 34 O PHE 4 -4.879 -0.531 -2.322 1.00 0.00 ATOM 35 C PHE 4 -4.649 -1.179 -3.335 1.00 0.00 ATOM 36 N ALA 5 -3.904 -2.265 -3.450 1.00 0.00 ATOM 37 CA ALA 5 -3.232 -2.795 -2.272 1.00 0.00 ATOM 38 CB ALA 5 -4.007 -4.004 -1.781 1.00 0.00 ATOM 39 O ALA 5 -1.461 -3.908 -3.481 1.00 0.00 ATOM 40 C ALA 5 -1.792 -3.153 -2.571 1.00 0.00 ATOM 41 N CYS 6 -1.009 -2.640 -1.659 1.00 0.00 ATOM 42 CA CYS 6 0.395 -2.942 -1.619 1.00 0.00 ATOM 43 CB CYS 6 0.939 -1.608 -1.235 1.00 0.00 ATOM 44 SG CYS 6 1.158 -0.492 -2.667 1.00 0.00 ATOM 45 O CYS 6 0.295 -3.811 0.595 1.00 0.00 ATOM 46 C CYS 6 0.635 -4.015 -0.559 1.00 0.00 ATOM 47 N ARG 7 1.069 -5.193 -0.985 1.00 0.00 ATOM 48 CA ARG 7 1.361 -6.301 -0.073 1.00 0.00 ATOM 49 CB ARG 7 0.555 -7.547 -0.407 1.00 0.00 ATOM 50 CG ARG 7 0.715 -8.696 0.577 1.00 0.00 ATOM 51 CD ARG 7 -0.150 -9.870 0.295 1.00 0.00 ATOM 52 NE ARG 7 0.217 -10.614 -0.901 1.00 0.00 ATOM 53 CZ ARG 7 -0.469 -11.667 -1.386 1.00 0.00 ATOM 54 NH1 ARG 7 -1.532 -12.129 -0.765 1.00 0.00 ATOM 55 NH2 ARG 7 -0.029 -12.242 -2.492 1.00 0.00 ATOM 56 O ARG 7 3.408 -7.104 -1.006 1.00 0.00 ATOM 57 C ARG 7 2.864 -6.624 -0.007 1.00 0.00 ATOM 58 N ALA 8 3.332 -6.737 1.236 1.00 0.00 ATOM 59 CA ALA 8 4.721 -7.141 1.552 1.00 0.00 ATOM 60 CB ALA 8 5.466 -6.011 2.273 1.00 0.00 ATOM 61 O ALA 8 4.412 -8.404 3.596 1.00 0.00 ATOM 62 C ALA 8 4.760 -8.411 2.408 1.00 0.00 ATOM 63 N ILE 9 5.140 -9.509 1.770 1.00 0.00 ATOM 64 CA ILE 9 5.275 -10.792 2.502 1.00 0.00 ATOM 65 CB ILE 9 4.943 -11.995 1.600 1.00 0.00 ATOM 66 CG1 ILE 9 3.522 -11.868 1.044 1.00 0.00 ATOM 67 CG2 ILE 9 5.103 -13.296 2.370 1.00 0.00 ATOM 68 CD1 ILE 9 3.195 -12.884 -0.027 1.00 0.00 ATOM 69 O ILE 9 7.593 -11.406 2.354 1.00 0.00 ATOM 70 C ILE 9 6.707 -10.876 3.026 1.00 0.00 ATOM 71 N THR 10 6.915 -10.337 4.220 1.00 0.00 ATOM 72 CA THR 10 8.277 -10.312 4.798 1.00 0.00 ATOM 73 CB THR 10 8.541 -9.107 5.729 1.00 0.00 ATOM 74 CG2 THR 10 7.943 -7.794 5.192 1.00 0.00 ATOM 75 OG1 THR 10 8.163 -9.399 7.089 1.00 0.00 ATOM 76 O THR 10 7.764 -12.477 5.771 1.00 0.00 ATOM 77 C THR 10 8.614 -11.636 5.492 1.00 0.00 ATOM 78 N ARG 11 9.881 -11.713 5.865 1.00 0.00 ATOM 79 CA ARG 11 10.472 -12.810 6.635 1.00 0.00 ATOM 80 CB ARG 11 11.941 -12.565 6.948 1.00 0.00 ATOM 81 CG ARG 11 12.874 -12.654 5.750 1.00 0.00 ATOM 82 CD ARG 11 14.299 -12.372 6.062 1.00 0.00 ATOM 83 NE ARG 11 15.186 -12.410 4.911 1.00 0.00 ATOM 84 CZ ARG 11 16.490 -12.076 4.939 1.00 0.00 ATOM 85 NH1 ARG 11 17.055 -11.644 6.045 1.00 0.00 ATOM 86 NH2 ARG 11 17.184 -12.171 3.819 1.00 0.00 ATOM 87 O ARG 11 9.631 -14.238 8.435 1.00 0.00 ATOM 88 C ARG 11 9.663 -13.109 7.935 1.00 0.00 ATOM 89 N GLY 12 9.160 -12.023 8.533 1.00 0.00 ATOM 90 CA GLY 12 8.570 -11.997 9.881 1.00 0.00 ATOM 91 O GLY 12 6.280 -12.269 10.573 1.00 0.00 ATOM 92 C GLY 12 7.081 -11.654 9.860 1.00 0.00 ATOM 93 N ARG 13 6.751 -10.582 9.142 1.00 0.00 ATOM 94 CA ARG 13 5.352 -10.148 9.004 1.00 0.00 ATOM 95 CB ARG 13 5.010 -9.006 9.949 1.00 0.00 ATOM 96 CG ARG 13 5.030 -9.370 11.426 1.00 0.00 ATOM 97 CD ARG 13 4.691 -8.248 12.338 1.00 0.00 ATOM 98 NE ARG 13 5.694 -7.196 12.397 1.00 0.00 ATOM 99 CZ ARG 13 5.504 -5.989 12.963 1.00 0.00 ATOM 100 NH1 ARG 13 4.343 -5.662 13.486 1.00 0.00 ATOM 101 NH2 ARG 13 6.509 -5.131 12.958 1.00 0.00 ATOM 102 O ARG 13 5.558 -9.031 6.830 1.00 0.00 ATOM 103 C ARG 13 4.911 -9.761 7.570 1.00 0.00 ATOM 104 N ALA 14 3.673 -10.143 7.268 1.00 0.00 ATOM 105 CA ALA 14 3.037 -9.772 5.989 1.00 0.00 ATOM 106 CB ALA 14 2.156 -10.921 5.515 1.00 0.00 ATOM 107 O ALA 14 1.355 -8.504 7.130 1.00 0.00 ATOM 108 C ALA 14 2.194 -8.520 6.221 1.00 0.00 ATOM 109 N GLU 15 2.466 -7.504 5.417 1.00 0.00 ATOM 110 CA GLU 15 1.835 -6.188 5.580 1.00 0.00 ATOM 111 CB GLU 15 2.932 -5.143 5.781 1.00 0.00 ATOM 112 CG GLU 15 3.786 -5.337 7.043 1.00 0.00 ATOM 113 CD GLU 15 3.004 -5.215 8.351 1.00 0.00 ATOM 114 OE1 GLU 15 1.805 -4.859 8.285 1.00 0.00 ATOM 115 OE2 GLU 15 3.628 -5.459 9.415 1.00 0.00 ATOM 116 O GLU 15 1.309 -6.170 3.242 1.00 0.00 ATOM 117 C GLU 15 0.994 -5.788 4.373 1.00 0.00 ATOM 118 N GLY 16 -0.045 -5.004 4.616 1.00 0.00 ATOM 119 CA GLY 16 -0.863 -4.457 3.527 1.00 0.00 ATOM 120 O GLY 16 -0.862 -2.470 4.766 1.00 0.00 ATOM 121 C GLY 16 -1.025 -2.949 3.666 1.00 0.00 ATOM 122 N GLU 17 -0.961 -2.270 2.532 1.00 0.00 ATOM 123 CA GLU 17 -1.287 -0.826 2.526 1.00 0.00 ATOM 124 CB GLU 17 -0.020 0.009 2.320 1.00 0.00 ATOM 125 CG GLU 17 -0.249 1.513 2.337 1.00 0.00 ATOM 126 CD GLU 17 -0.795 1.969 3.662 1.00 0.00 ATOM 127 OE1 GLU 17 -0.117 1.811 4.648 1.00 0.00 ATOM 128 OE2 GLU 17 -1.841 2.575 3.674 1.00 0.00 ATOM 129 O GLU 17 -2.043 -0.751 0.242 1.00 0.00 ATOM 130 C GLU 17 -2.311 -0.564 1.431 1.00 0.00 ATOM 131 N ALA 18 -3.539 -0.379 1.886 1.00 0.00 ATOM 132 CA ALA 18 -4.684 -0.192 0.980 1.00 0.00 ATOM 133 CB ALA 18 -5.907 -0.932 1.520 1.00 0.00 ATOM 134 O ALA 18 -5.016 2.114 1.618 1.00 0.00 ATOM 135 C ALA 18 -4.977 1.285 0.713 1.00 0.00 ATOM 136 N LEU 19 -5.213 1.574 -0.553 1.00 0.00 ATOM 137 CA LEU 19 -5.532 2.944 -0.984 1.00 0.00 ATOM 138 CB LEU 19 -4.247 3.698 -1.349 1.00 0.00 ATOM 139 CG LEU 19 -3.521 4.359 -0.170 1.00 0.00 ATOM 140 CD1 LEU 19 -2.383 3.467 0.308 1.00 0.00 ATOM 141 CD2 LEU 19 -2.995 5.721 -0.595 1.00 0.00 ATOM 142 O LEU 19 -6.849 1.975 -2.759 1.00 0.00 ATOM 143 C LEU 19 -6.501 2.988 -2.169 1.00 0.00 ATOM 144 N VAL 20 -6.935 4.205 -2.443 1.00 0.00 ATOM 145 CA VAL 20 -7.762 4.508 -3.621 1.00 0.00 ATOM 146 CB VAL 20 -9.068 5.203 -3.203 1.00 0.00 ATOM 147 CG1 VAL 20 -9.945 5.531 -4.419 1.00 0.00 ATOM 148 CG2 VAL 20 -9.863 4.339 -2.226 1.00 0.00 ATOM 149 O VAL 20 -6.349 6.404 -4.030 1.00 0.00 ATOM 150 C VAL 20 -6.900 5.410 -4.501 1.00 0.00 ATOM 151 N THR 21 -6.873 5.084 -5.780 1.00 0.00 ATOM 152 CA THR 21 -6.167 5.935 -6.748 1.00 0.00 ATOM 153 CB THR 21 -5.295 5.117 -7.701 1.00 0.00 ATOM 154 CG2 THR 21 -4.533 6.045 -8.630 1.00 0.00 ATOM 155 OG1 THR 21 -4.316 4.428 -6.932 1.00 0.00 ATOM 156 O THR 21 -8.077 6.053 -8.177 1.00 0.00 ATOM 157 C THR 21 -7.242 6.680 -7.527 1.00 0.00 ATOM 158 N LYS 22 -7.369 7.961 -7.195 1.00 0.00 ATOM 159 CA LYS 22 -8.393 8.835 -7.795 1.00 0.00 ATOM 160 CB LYS 22 -8.935 9.775 -6.708 1.00 0.00 ATOM 161 CG LYS 22 -10.096 10.621 -7.237 1.00 0.00 ATOM 162 CD LYS 22 -10.514 11.587 -6.137 1.00 0.00 ATOM 163 CE LYS 22 -11.638 12.445 -6.652 1.00 0.00 ATOM 164 NZ LYS 22 -12.156 13.396 -5.648 1.00 0.00 ATOM 165 O LYS 22 -6.948 10.501 -8.725 1.00 0.00 ATOM 166 C LYS 22 -7.800 9.650 -8.958 1.00 0.00 ATOM 167 N GLU 23 -8.373 9.435 -10.132 1.00 0.00 ATOM 168 CA GLU 23 -7.935 10.143 -11.358 1.00 0.00 ATOM 169 CB GLU 23 -7.580 9.140 -12.457 1.00 0.00 ATOM 170 CG GLU 23 -7.086 9.773 -13.751 1.00 0.00 ATOM 171 CD GLU 23 -6.756 8.728 -14.780 1.00 0.00 ATOM 172 OE1 GLU 23 -6.934 7.567 -14.498 1.00 0.00 ATOM 173 OE2 GLU 23 -6.432 9.093 -15.885 1.00 0.00 ATOM 174 O GLU 23 -10.168 10.731 -12.003 1.00 0.00 ATOM 175 C GLU 23 -9.006 11.104 -11.853 1.00 0.00 ATOM 176 N TYR 24 -8.619 12.368 -11.967 1.00 0.00 ATOM 177 CA TYR 24 -9.534 13.424 -12.453 1.00 0.00 ATOM 178 CB TYR 24 -10.356 13.943 -11.260 1.00 0.00 ATOM 179 CG TYR 24 -11.481 14.904 -11.678 1.00 0.00 ATOM 180 CD1 TYR 24 -12.578 14.434 -12.389 1.00 0.00 ATOM 181 CD2 TYR 24 -11.381 16.262 -11.402 1.00 0.00 ATOM 182 CE1 TYR 24 -13.570 15.305 -12.807 1.00 0.00 ATOM 183 CE2 TYR 24 -12.375 17.128 -11.841 1.00 0.00 ATOM 184 CZ TYR 24 -13.480 16.653 -12.532 1.00 0.00 ATOM 185 OH TYR 24 -14.475 17.496 -12.888 1.00 0.00 ATOM 186 O TYR 24 -7.541 14.545 -13.148 1.00 0.00 ATOM 187 C TYR 24 -8.761 14.559 -13.139 1.00 0.00 ATOM 188 N ILE 25 -9.485 15.635 -13.436 1.00 0.00 ATOM 189 CA ILE 25 -8.894 16.884 -13.982 1.00 0.00 ATOM 190 CB ILE 25 -9.977 17.937 -14.284 1.00 0.00 ATOM 191 CG1 ILE 25 -10.858 17.478 -15.448 1.00 0.00 ATOM 192 CG2 ILE 25 -9.339 19.283 -14.593 1.00 0.00 ATOM 193 CD1 ILE 25 -12.101 18.317 -15.641 1.00 0.00 ATOM 194 O ILE 25 -6.871 17.988 -13.354 1.00 0.00 ATOM 195 C ILE 25 -7.883 17.427 -12.969 1.00 0.00 ATOM 196 N SER 26 -8.228 17.287 -11.699 1.00 0.00 ATOM 197 CA SER 26 -7.330 17.743 -10.645 1.00 0.00 ATOM 198 CB SER 26 -7.968 17.530 -9.287 1.00 0.00 ATOM 199 OG SER 26 -8.140 16.170 -8.993 1.00 0.00 ATOM 200 O SER 26 -5.138 17.767 -10.259 1.00 0.00 ATOM 201 C SER 26 -6.003 17.029 -10.726 1.00 0.00 ATOM 202 N PHE 27 -5.926 15.808 -11.306 1.00 0.00 ATOM 203 CA PHE 27 -4.783 14.854 -11.317 1.00 0.00 ATOM 204 CB PHE 27 -3.778 15.363 -10.365 1.00 0.00 ATOM 205 CG PHE 27 -3.888 15.679 -8.917 1.00 0.00 ATOM 206 CD1 PHE 27 -4.778 15.121 -8.022 1.00 0.00 ATOM 207 CD2 PHE 27 -3.238 16.863 -8.719 1.00 0.00 ATOM 208 CE1 PHE 27 -5.027 15.833 -6.865 1.00 0.00 ATOM 209 CE2 PHE 27 -3.539 17.572 -7.595 1.00 0.00 ATOM 210 CZ PHE 27 -4.428 17.069 -6.680 1.00 0.00 ATOM 211 O PHE 27 -6.036 12.907 -10.770 1.00 0.00 ATOM 212 C PHE 27 -4.911 13.401 -10.823 1.00 0.00 ATOM 213 N LEU 28 -3.855 12.859 -10.247 1.00 0.00 ATOM 214 CA LEU 28 -3.895 11.707 -9.343 1.00 0.00 ATOM 215 CB LEU 28 -2.726 10.760 -9.642 1.00 0.00 ATOM 216 CG LEU 28 -2.712 10.164 -11.055 1.00 0.00 ATOM 217 CD1 LEU 28 -1.467 9.311 -11.251 1.00 0.00 ATOM 218 CD2 LEU 28 -3.972 9.339 -11.272 1.00 0.00 ATOM 219 O LEU 28 -3.016 12.900 -7.421 1.00 0.00 ATOM 220 C LEU 28 -3.861 12.131 -7.883 1.00 0.00 ATOM 221 N GLY 29 -4.786 11.517 -7.157 1.00 0.00 ATOM 222 CA GLY 29 -4.917 11.592 -5.692 1.00 0.00 ATOM 223 O GLY 29 -5.493 9.270 -5.588 1.00 0.00 ATOM 224 C GLY 29 -4.808 10.183 -5.119 1.00 0.00 ATOM 225 N GLY 30 -3.865 10.001 -4.201 1.00 0.00 ATOM 226 CA GLY 30 -3.639 8.741 -3.480 1.00 0.00 ATOM 227 O GLY 30 -3.914 9.767 -1.330 1.00 0.00 ATOM 228 C GLY 30 -4.294 8.888 -2.113 1.00 0.00 ATOM 229 N ILE 31 -5.374 8.156 -1.915 1.00 0.00 ATOM 230 CA ILE 31 -6.160 8.283 -0.676 1.00 0.00 ATOM 231 CB ILE 31 -7.618 8.586 -1.052 1.00 0.00 ATOM 232 CG1 ILE 31 -7.690 9.927 -1.783 1.00 0.00 ATOM 233 CG2 ILE 31 -8.482 8.608 0.201 1.00 0.00 ATOM 234 CD1 ILE 31 -9.057 10.264 -2.352 1.00 0.00 ATOM 235 O ILE 31 -6.072 5.928 -0.447 1.00 0.00 ATOM 236 C ILE 31 -6.042 7.001 0.149 1.00 0.00 ATOM 237 N ASP 32 -6.007 7.169 1.472 1.00 0.00 ATOM 238 CA ASP 32 -6.047 6.075 2.451 1.00 0.00 ATOM 239 CB ASP 32 -5.875 6.652 3.855 1.00 0.00 ATOM 240 CG ASP 32 -5.689 5.572 4.915 1.00 0.00 ATOM 241 OD1 ASP 32 -5.745 4.381 4.572 1.00 0.00 ATOM 242 OD2 ASP 32 -5.420 6.011 6.049 1.00 0.00 ATOM 243 O ASP 32 -8.424 5.839 2.495 1.00 0.00 ATOM 244 C ASP 32 -7.347 5.260 2.352 1.00 0.00 ATOM 245 N LYS 33 -7.240 3.955 2.095 1.00 0.00 ATOM 246 CA LYS 33 -8.447 3.092 2.037 1.00 0.00 ATOM 247 CB LYS 33 -8.055 1.642 1.749 1.00 0.00 ATOM 248 CG LYS 33 -9.204 0.648 1.850 1.00 0.00 ATOM 249 CD LYS 33 -10.248 0.896 0.772 1.00 0.00 ATOM 250 CE LYS 33 -11.204 -0.280 0.643 1.00 0.00 ATOM 251 NZ LYS 33 -12.016 -0.475 1.875 1.00 0.00 ATOM 252 O LYS 33 -10.507 3.089 3.219 1.00 0.00 ATOM 253 C LYS 33 -9.284 3.141 3.328 1.00 0.00 ATOM 254 N GLU 34 -8.602 3.156 4.465 1.00 0.00 ATOM 255 CA GLU 34 -9.248 3.151 5.796 1.00 0.00 ATOM 256 CB GLU 34 -8.210 2.913 6.894 1.00 0.00 ATOM 257 CG GLU 34 -7.636 1.503 6.921 1.00 0.00 ATOM 258 CD GLU 34 -6.539 1.380 7.942 1.00 0.00 ATOM 259 OE1 GLU 34 -6.199 2.369 8.544 1.00 0.00 ATOM 260 OE2 GLU 34 -6.117 0.276 8.200 1.00 0.00 ATOM 261 O GLU 34 -11.083 4.354 6.787 1.00 0.00 ATOM 262 C GLU 34 -10.025 4.426 6.152 1.00 0.00 ATOM 263 N THR 35 -9.480 5.577 5.800 1.00 0.00 ATOM 264 CA THR 35 -10.048 6.856 6.278 1.00 0.00 ATOM 265 CB THR 35 -8.965 7.759 6.898 1.00 0.00 ATOM 266 CG2 THR 35 -8.310 7.067 8.084 1.00 0.00 ATOM 267 OG1 THR 35 -7.968 8.059 5.913 1.00 0.00 ATOM 268 O THR 35 -11.707 8.388 5.511 1.00 0.00 ATOM 269 C THR 35 -10.752 7.667 5.206 1.00 0.00 ATOM 270 N GLY 36 -10.249 7.533 3.994 1.00 0.00 ATOM 271 CA GLY 36 -10.700 8.346 2.863 1.00 0.00 ATOM 272 O GLY 36 -10.118 10.330 1.740 1.00 0.00 ATOM 273 C GLY 36 -9.899 9.636 2.742 1.00 0.00 ATOM 274 N ILE 37 -8.830 9.779 3.544 1.00 0.00 ATOM 275 CA ILE 37 -7.965 10.982 3.562 1.00 0.00 ATOM 276 CB ILE 37 -7.015 11.091 4.779 1.00 0.00 ATOM 277 CG1 ILE 37 -7.788 11.273 6.087 1.00 0.00 ATOM 278 CG2 ILE 37 -6.078 12.314 4.677 1.00 0.00 ATOM 279 CD1 ILE 37 -6.973 11.040 7.342 1.00 0.00 ATOM 280 O ILE 37 -6.437 9.999 1.994 1.00 0.00 ATOM 281 C ILE 37 -7.128 10.974 2.271 1.00 0.00 ATOM 282 N VAL 38 -7.083 12.134 1.636 1.00 0.00 ATOM 283 CA VAL 38 -6.207 12.325 0.469 1.00 0.00 ATOM 284 CB VAL 38 -6.667 13.476 -0.437 1.00 0.00 ATOM 285 CG1 VAL 38 -5.762 13.560 -1.665 1.00 0.00 ATOM 286 CG2 VAL 38 -8.119 13.309 -0.895 1.00 0.00 ATOM 287 O VAL 38 -4.509 13.590 1.598 1.00 0.00 ATOM 288 C VAL 38 -4.779 12.566 0.977 1.00 0.00 ATOM 289 N LYS 39 -3.964 11.524 0.847 1.00 0.00 ATOM 290 CA LYS 39 -2.559 11.548 1.298 1.00 0.00 ATOM 291 CB LYS 39 -2.053 10.128 1.551 1.00 0.00 ATOM 292 CG LYS 39 -2.683 9.440 2.755 1.00 0.00 ATOM 293 CD LYS 39 -2.231 10.084 4.058 1.00 0.00 ATOM 294 CE LYS 39 -2.862 9.399 5.262 1.00 0.00 ATOM 295 NZ LYS 39 -2.411 10.002 6.545 1.00 0.00 ATOM 296 O LYS 39 -0.617 12.823 0.867 1.00 0.00 ATOM 297 C LYS 39 -1.564 12.232 0.351 1.00 0.00 ATOM 298 N GLU 40 -1.705 11.944 -0.944 1.00 0.00 ATOM 299 CA GLU 40 -0.887 12.516 -2.029 1.00 0.00 ATOM 300 CB GLU 40 0.051 11.456 -2.610 1.00 0.00 ATOM 301 CG GLU 40 0.943 11.954 -3.738 1.00 0.00 ATOM 302 CD GLU 40 1.822 13.085 -3.279 1.00 0.00 ATOM 303 OE1 GLU 40 1.817 13.379 -2.108 1.00 0.00 ATOM 304 OE2 GLU 40 2.582 13.580 -4.077 1.00 0.00 ATOM 305 O GLU 40 -2.613 12.393 -3.619 1.00 0.00 ATOM 306 C GLU 40 -1.722 13.102 -3.134 1.00 0.00 ATOM 307 N ASP 41 -1.207 14.179 -3.692 1.00 0.00 ATOM 308 CA ASP 41 -1.821 14.819 -4.862 1.00 0.00 ATOM 309 CB ASP 41 -2.506 16.104 -4.390 1.00 0.00 ATOM 310 CG ASP 41 -3.685 15.860 -3.452 1.00 0.00 ATOM 311 OD1 ASP 41 -4.691 15.252 -3.878 1.00 0.00 ATOM 312 OD2 ASP 41 -3.566 16.323 -2.299 1.00 0.00 ATOM 313 O ASP 41 0.354 15.608 -5.474 1.00 0.00 ATOM 314 C ASP 41 -0.702 15.093 -5.867 1.00 0.00 ATOM 315 N CYS 42 -0.855 14.637 -7.092 1.00 0.00 ATOM 316 CA CYS 42 0.165 14.886 -8.144 1.00 0.00 ATOM 317 CB CYS 42 0.993 13.627 -8.415 1.00 0.00 ATOM 318 SG CYS 42 2.020 13.154 -6.976 1.00 0.00 ATOM 319 O CYS 42 -1.216 14.570 -9.997 1.00 0.00 ATOM 320 C CYS 42 -0.480 15.369 -9.432 1.00 0.00 ATOM 321 N GLU 43 -0.224 16.652 -9.729 1.00 0.00 ATOM 322 CA GLU 43 -0.521 17.433 -10.964 1.00 0.00 ATOM 323 CB GLU 43 -1.676 16.830 -11.734 1.00 0.00 ATOM 324 CG GLU 43 -2.696 17.411 -12.683 1.00 0.00 ATOM 325 CD GLU 43 -1.984 17.452 -14.017 1.00 0.00 ATOM 326 OE1 GLU 43 -1.080 16.627 -14.296 1.00 0.00 ATOM 327 OE2 GLU 43 -2.465 18.310 -14.770 1.00 0.00 ATOM 328 O GLU 43 -1.103 19.711 -11.587 1.00 0.00 ATOM 329 C GLU 43 -0.684 18.928 -10.745 1.00 0.00 ATOM 330 N ILE 44 -0.112 19.354 -9.635 1.00 0.00 ATOM 331 CA ILE 44 -0.158 20.784 -9.350 1.00 0.00 ATOM 332 CB ILE 44 -0.840 21.091 -8.011 1.00 0.00 ATOM 333 CG1 ILE 44 -0.210 20.388 -6.797 1.00 0.00 ATOM 334 CG2 ILE 44 -2.322 20.763 -8.230 1.00 0.00 ATOM 335 CD1 ILE 44 -0.836 20.842 -5.471 1.00 0.00 ATOM 336 O ILE 44 2.098 20.750 -10.093 1.00 0.00 ATOM 337 C ILE 44 1.206 21.422 -9.570 1.00 0.00 ATOM 338 N LYS 45 1.414 22.627 -9.076 1.00 0.00 ATOM 339 CA LYS 45 2.739 23.274 -9.126 1.00 0.00 ATOM 340 CB LYS 45 2.720 24.592 -8.350 1.00 0.00 ATOM 341 CG LYS 45 2.570 24.432 -6.843 1.00 0.00 ATOM 342 CD LYS 45 2.520 25.784 -6.146 1.00 0.00 ATOM 343 CE LYS 45 2.437 25.627 -4.635 1.00 0.00 ATOM 344 NZ LYS 45 2.350 26.940 -3.942 1.00 0.00 ATOM 345 O LYS 45 5.016 22.553 -8.886 1.00 0.00 ATOM 346 C LYS 45 3.847 22.355 -8.568 1.00 0.00 ATOM 347 N GLY 46 3.412 21.332 -7.843 1.00 0.00 ATOM 348 CA GLY 46 4.256 20.227 -7.365 1.00 0.00 ATOM 349 O GLY 46 5.041 18.050 -7.851 1.00 0.00 ATOM 350 C GLY 46 4.453 19.011 -8.308 1.00 0.00 ATOM 351 N GLU 47 4.218 19.096 -9.612 1.00 0.00 ATOM 352 CA GLU 47 4.494 17.946 -10.515 1.00 0.00 ATOM 353 CB GLU 47 3.920 18.209 -11.908 1.00 0.00 ATOM 354 CG GLU 47 4.092 17.057 -12.888 1.00 0.00 ATOM 355 CD GLU 47 3.446 17.363 -14.211 1.00 0.00 ATOM 356 OE1 GLU 47 2.878 18.419 -14.343 1.00 0.00 ATOM 357 OE2 GLU 47 3.615 16.590 -15.124 1.00 0.00 ATOM 358 O GLU 47 6.402 16.488 -10.553 1.00 0.00 ATOM 359 C GLU 47 5.993 17.646 -10.624 1.00 0.00 ATOM 360 N SER 48 6.797 18.714 -10.632 1.00 0.00 ATOM 361 CA SER 48 8.273 18.619 -10.702 1.00 0.00 ATOM 362 CB SER 48 8.875 19.995 -10.912 1.00 0.00 ATOM 363 OG SER 48 8.529 20.535 -12.158 1.00 0.00 ATOM 364 O SER 48 9.855 17.227 -9.557 1.00 0.00 ATOM 365 C SER 48 8.891 17.983 -9.465 1.00 0.00 ATOM 366 N VAL 49 8.329 18.283 -8.307 1.00 0.00 ATOM 367 CA VAL 49 8.811 17.679 -7.059 1.00 0.00 ATOM 368 CB VAL 49 8.115 18.291 -5.828 1.00 0.00 ATOM 369 CG1 VAL 49 8.483 17.520 -4.569 1.00 0.00 ATOM 370 CG2 VAL 49 8.486 19.757 -5.681 1.00 0.00 ATOM 371 O VAL 49 9.503 15.401 -6.824 1.00 0.00 ATOM 372 C VAL 49 8.578 16.158 -7.084 1.00 0.00 ATOM 373 N ALA 50 7.406 15.773 -7.569 1.00 0.00 ATOM 374 CA ALA 50 6.933 14.375 -7.527 1.00 0.00 ATOM 375 CB ALA 50 5.442 14.186 -7.863 1.00 0.00 ATOM 376 O ALA 50 8.131 12.479 -8.397 1.00 0.00 ATOM 377 C ALA 50 7.705 13.603 -8.578 1.00 0.00 ATOM 378 N GLY 51 7.872 14.279 -9.700 1.00 0.00 ATOM 379 CA GLY 51 8.688 13.790 -10.803 1.00 0.00 ATOM 380 O GLY 51 10.809 12.785 -10.917 1.00 0.00 ATOM 381 C GLY 51 10.153 13.672 -10.380 1.00 0.00 ATOM 382 N ARG 52 10.762 14.561 -9.625 1.00 0.00 ATOM 383 CA ARG 52 12.176 14.286 -9.274 1.00 0.00 ATOM 384 CB ARG 52 12.938 15.556 -8.928 1.00 0.00 ATOM 385 CG ARG 52 13.199 16.487 -10.101 1.00 0.00 ATOM 386 CD ARG 52 13.864 17.764 -9.735 1.00 0.00 ATOM 387 NE ARG 52 14.154 18.636 -10.861 1.00 0.00 ATOM 388 CZ ARG 52 14.691 19.868 -10.757 1.00 0.00 ATOM 389 NH1 ARG 52 14.962 20.390 -9.581 1.00 0.00 ATOM 390 NH2 ARG 52 14.916 20.547 -11.867 1.00 0.00 ATOM 391 O ARG 52 12.939 12.276 -8.227 1.00 0.00 ATOM 392 C ARG 52 12.206 13.249 -8.157 1.00 0.00 ATOM 393 N ILE 53 11.336 13.474 -7.191 1.00 0.00 ATOM 394 CA ILE 53 11.172 12.549 -6.084 1.00 0.00 ATOM 395 CB ILE 53 11.489 13.220 -4.735 1.00 0.00 ATOM 396 CG1 ILE 53 12.929 13.741 -4.723 1.00 0.00 ATOM 397 CG2 ILE 53 11.263 12.245 -3.590 1.00 0.00 ATOM 398 CD1 ILE 53 13.110 15.052 -5.453 1.00 0.00 ATOM 399 O ILE 53 8.820 12.843 -5.960 1.00 0.00 ATOM 400 C ILE 53 9.737 12.059 -6.143 1.00 0.00 ATOM 401 N LEU 54 9.584 10.779 -6.405 1.00 0.00 ATOM 402 CA LEU 54 8.262 10.215 -6.676 1.00 0.00 ATOM 403 CB LEU 54 8.377 9.045 -7.661 1.00 0.00 ATOM 404 CG LEU 54 8.139 9.405 -9.133 1.00 0.00 ATOM 405 CD1 LEU 54 9.388 10.046 -9.723 1.00 0.00 ATOM 406 CD2 LEU 54 7.758 8.152 -9.908 1.00 0.00 ATOM 407 O LEU 54 8.257 9.076 -4.589 1.00 0.00 ATOM 408 C LEU 54 7.632 9.781 -5.377 1.00 0.00 ATOM 409 N VAL 55 6.403 10.209 -5.173 1.00 0.00 ATOM 410 CA VAL 55 5.650 9.822 -3.972 1.00 0.00 ATOM 411 CB VAL 55 4.890 11.020 -3.372 1.00 0.00 ATOM 412 CG1 VAL 55 4.091 10.586 -2.153 1.00 0.00 ATOM 413 CG2 VAL 55 5.858 12.135 -3.004 1.00 0.00 ATOM 414 O VAL 55 3.766 8.891 -5.174 1.00 0.00 ATOM 415 C VAL 55 4.676 8.698 -4.357 1.00 0.00 ATOM 416 N PHE 56 4.902 7.532 -3.771 1.00 0.00 ATOM 417 CA PHE 56 4.136 6.340 -4.129 1.00 0.00 ATOM 418 CB PHE 56 5.075 5.204 -4.538 1.00 0.00 ATOM 419 CG PHE 56 5.551 5.293 -5.959 1.00 0.00 ATOM 420 CD1 PHE 56 5.032 6.247 -6.821 1.00 0.00 ATOM 421 CD2 PHE 56 6.519 4.423 -6.438 1.00 0.00 ATOM 422 CE1 PHE 56 5.470 6.330 -8.130 1.00 0.00 ATOM 423 CE2 PHE 56 6.959 4.504 -7.744 1.00 0.00 ATOM 424 CZ PHE 56 6.434 5.459 -8.591 1.00 0.00 ATOM 425 O PHE 56 3.620 5.289 -1.970 1.00 0.00 ATOM 426 C PHE 56 3.197 5.812 -3.017 1.00 0.00 ATOM 427 N PRO 57 1.902 5.940 -3.303 1.00 0.00 ATOM 428 CA PRO 57 0.825 5.475 -2.410 1.00 0.00 ATOM 429 CB PRO 57 -0.317 6.372 -2.887 1.00 0.00 ATOM 430 CG PRO 57 -0.181 6.409 -4.400 1.00 0.00 ATOM 431 CD PRO 57 1.332 6.592 -4.500 1.00 0.00 ATOM 432 O PRO 57 0.808 3.419 -3.684 1.00 0.00 ATOM 433 C PRO 57 0.569 3.967 -2.616 1.00 0.00 ATOM 434 N GLY 58 -0.034 3.321 -1.622 1.00 0.00 ATOM 435 CA GLY 58 -0.565 1.941 -1.698 1.00 0.00 ATOM 436 O GLY 58 -1.509 0.431 -3.313 1.00 0.00 ATOM 437 C GLY 58 -1.483 1.588 -2.896 1.00 0.00 ATOM 438 N GLY 59 -2.144 2.574 -3.490 1.00 0.00 ATOM 439 CA GLY 59 -3.109 2.410 -4.589 1.00 0.00 ATOM 440 O GLY 59 -3.354 2.069 -6.896 1.00 0.00 ATOM 441 C GLY 59 -2.567 1.994 -5.949 1.00 0.00 ATOM 442 N LYS 60 -1.291 1.655 -6.066 1.00 0.00 ATOM 443 CA LYS 60 -0.663 1.132 -7.286 1.00 0.00 ATOM 444 CB LYS 60 0.201 2.206 -7.947 1.00 0.00 ATOM 445 CG LYS 60 0.896 1.756 -9.225 1.00 0.00 ATOM 446 CD LYS 60 1.874 2.811 -9.724 1.00 0.00 ATOM 447 CE LYS 60 1.144 4.010 -10.310 1.00 0.00 ATOM 448 NZ LYS 60 2.079 4.962 -10.969 1.00 0.00 ATOM 449 O LYS 60 1.056 -0.059 -6.121 1.00 0.00 ATOM 450 C LYS 60 0.183 -0.115 -6.983 1.00 0.00 ATOM 451 N GLY 61 -0.101 -1.214 -7.670 1.00 0.00 ATOM 452 CA GLY 61 0.707 -2.455 -7.586 1.00 0.00 ATOM 453 O GLY 61 2.532 -1.279 -8.634 1.00 0.00 ATOM 454 C GLY 61 2.173 -2.066 -7.745 1.00 0.00 ATOM 455 N SER 62 2.979 -2.453 -6.768 1.00 0.00 ATOM 456 CA SER 62 4.395 -2.014 -6.761 1.00 0.00 ATOM 457 CB SER 62 5.260 -2.688 -5.722 1.00 0.00 ATOM 458 OG SER 62 5.297 -4.112 -5.934 1.00 0.00 ATOM 459 O SER 62 6.055 -1.599 -8.417 1.00 0.00 ATOM 460 C SER 62 5.159 -2.343 -8.037 1.00 0.00 ATOM 461 N THR 63 4.743 -3.427 -8.695 1.00 0.00 ATOM 462 CA THR 63 5.380 -3.865 -9.942 1.00 0.00 ATOM 463 CB THR 63 4.879 -5.256 -10.374 1.00 0.00 ATOM 464 CG2 THR 63 5.515 -5.664 -11.695 1.00 0.00 ATOM 465 OG1 THR 63 5.212 -6.221 -9.368 1.00 0.00 ATOM 466 O THR 63 5.996 -2.548 -11.845 1.00 0.00 ATOM 467 C THR 63 5.110 -2.854 -11.056 1.00 0.00 ATOM 468 N VAL 64 3.909 -2.292 -11.029 1.00 0.00 ATOM 469 CA VAL 64 3.505 -1.222 -11.957 1.00 0.00 ATOM 470 CB VAL 64 1.996 -0.929 -11.861 1.00 0.00 ATOM 471 CG1 VAL 64 1.639 0.301 -12.682 1.00 0.00 ATOM 472 CG2 VAL 64 1.189 -2.131 -12.326 1.00 0.00 ATOM 473 O VAL 64 4.749 0.760 -12.539 1.00 0.00 ATOM 474 C VAL 64 4.310 0.040 -11.645 1.00 0.00 ATOM 475 N GLY 65 4.483 0.276 -10.346 1.00 0.00 ATOM 476 CA GLY 65 5.314 1.366 -9.825 1.00 0.00 ATOM 477 O GLY 65 7.233 2.258 -10.974 1.00 0.00 ATOM 478 C GLY 65 6.737 1.298 -10.392 1.00 0.00 ATOM 479 N SER 66 7.268 0.091 -10.323 1.00 0.00 ATOM 480 CA SER 66 8.613 -0.223 -10.863 1.00 0.00 ATOM 481 CB SER 66 8.998 -1.646 -10.509 1.00 0.00 ATOM 482 OG SER 66 9.157 -1.821 -9.128 1.00 0.00 ATOM 483 O SER 66 9.566 0.636 -12.887 1.00 0.00 ATOM 484 C SER 66 8.657 -0.017 -12.379 1.00 0.00 ATOM 485 N TYR 67 7.541 -0.370 -13.027 1.00 0.00 ATOM 486 CA TYR 67 7.367 -0.199 -14.482 1.00 0.00 ATOM 487 CB TYR 67 6.068 -0.862 -14.947 1.00 0.00 ATOM 488 CG TYR 67 5.792 -0.699 -16.426 1.00 0.00 ATOM 489 CD1 TYR 67 6.425 -1.504 -17.362 1.00 0.00 ATOM 490 CD2 TYR 67 4.896 0.257 -16.881 1.00 0.00 ATOM 491 CE1 TYR 67 6.177 -1.360 -18.713 1.00 0.00 ATOM 492 CE2 TYR 67 4.640 0.410 -18.229 1.00 0.00 ATOM 493 CZ TYR 67 5.283 -0.401 -19.142 1.00 0.00 ATOM 494 OH TYR 67 5.030 -0.253 -20.488 1.00 0.00 ATOM 495 O TYR 67 8.163 1.711 -15.696 1.00 0.00 ATOM 496 C TYR 67 7.367 1.273 -14.880 1.00 0.00 ATOM 497 N VAL 68 6.505 2.023 -14.230 1.00 0.00 ATOM 498 CA VAL 68 6.372 3.450 -14.539 1.00 0.00 ATOM 499 CB VAL 68 5.261 4.093 -13.701 1.00 0.00 ATOM 500 CG1 VAL 68 5.219 5.617 -13.873 1.00 0.00 ATOM 501 CG2 VAL 68 3.895 3.538 -14.127 1.00 0.00 ATOM 502 O VAL 68 8.158 4.934 -15.133 1.00 0.00 ATOM 503 C VAL 68 7.708 4.163 -14.288 1.00 0.00 ATOM 504 N LEU 69 8.314 3.865 -13.151 1.00 0.00 ATOM 505 CA LEU 69 9.584 4.505 -12.787 1.00 0.00 ATOM 506 CB LEU 69 10.040 4.027 -11.402 1.00 0.00 ATOM 507 CG LEU 69 11.457 4.455 -10.999 1.00 0.00 ATOM 508 CD1 LEU 69 11.499 5.958 -10.759 1.00 0.00 ATOM 509 CD2 LEU 69 11.880 3.697 -9.749 1.00 0.00 ATOM 510 O LEU 69 11.337 5.116 -14.318 1.00 0.00 ATOM 511 C LEU 69 10.664 4.217 -13.837 1.00 0.00 ATOM 512 N LEU 70 10.710 2.965 -14.289 1.00 0.00 ATOM 513 CA LEU 70 11.670 2.544 -15.325 1.00 0.00 ATOM 514 CB LEU 70 11.612 1.023 -15.514 1.00 0.00 ATOM 515 CG LEU 70 12.806 0.413 -16.258 1.00 0.00 ATOM 516 CD1 LEU 70 12.754 -1.107 -16.171 1.00 0.00 ATOM 517 CD2 LEU 70 12.791 0.871 -17.708 1.00 0.00 ATOM 518 O LEU 70 12.375 3.707 -17.296 1.00 0.00 ATOM 519 C LEU 70 11.431 3.236 -16.669 1.00 0.00 ATOM 520 N ASN 71 10.155 3.322 -17.047 1.00 0.00 ATOM 521 CA ASN 71 9.668 3.925 -18.309 1.00 0.00 ATOM 522 CB ASN 71 8.176 3.710 -18.486 1.00 0.00 ATOM 523 CG ASN 71 7.649 4.190 -19.809 1.00 0.00 ATOM 524 ND2 ASN 71 6.838 5.216 -19.756 1.00 0.00 ATOM 525 OD1 ASN 71 8.029 3.685 -20.872 1.00 0.00 ATOM 526 O ASN 71 10.556 5.942 -19.286 1.00 0.00 ATOM 527 C ASN 71 10.033 5.420 -18.310 1.00 0.00 ATOM 528 N LEU 72 9.804 6.046 -17.169 1.00 0.00 ATOM 529 CA LEU 72 10.103 7.480 -16.959 1.00 0.00 ATOM 530 CB LEU 72 9.657 7.957 -15.573 1.00 0.00 ATOM 531 CG LEU 72 8.148 7.991 -15.369 1.00 0.00 ATOM 532 CD1 LEU 72 7.838 8.322 -13.910 1.00 0.00 ATOM 533 CD2 LEU 72 7.508 9.056 -16.252 1.00 0.00 ATOM 534 O LEU 72 12.013 8.609 -17.870 1.00 0.00 ATOM 535 C LEU 72 11.606 7.748 -17.096 1.00 0.00 ATOM 536 N ARG 73 12.368 6.841 -16.489 1.00 0.00 ATOM 537 CA ARG 73 13.845 6.897 -16.573 1.00 0.00 ATOM 538 CB ARG 73 14.511 5.882 -15.655 1.00 0.00 ATOM 539 CG ARG 73 16.030 5.878 -15.701 1.00 0.00 ATOM 540 CD ARG 73 16.660 7.146 -15.252 1.00 0.00 ATOM 541 NE ARG 73 18.114 7.121 -15.227 1.00 0.00 ATOM 542 CZ ARG 73 18.895 8.204 -15.053 1.00 0.00 ATOM 543 NH1 ARG 73 18.372 9.404 -14.927 1.00 0.00 ATOM 544 NH2 ARG 73 20.206 8.033 -15.036 1.00 0.00 ATOM 545 O ARG 73 15.096 7.566 -18.489 1.00 0.00 ATOM 546 C ARG 73 14.326 6.744 -18.014 1.00 0.00 ATOM 547 N LYS 74 13.720 5.793 -18.719 1.00 0.00 ATOM 548 CA LYS 74 14.049 5.514 -20.126 1.00 0.00 ATOM 549 CB LYS 74 13.217 4.342 -20.648 1.00 0.00 ATOM 550 CG LYS 74 13.520 3.947 -22.088 1.00 0.00 ATOM 551 CD LYS 74 12.710 2.730 -22.510 1.00 0.00 ATOM 552 CE LYS 74 12.986 2.356 -23.959 1.00 0.00 ATOM 553 NZ LYS 74 12.190 1.176 -24.391 1.00 0.00 ATOM 554 O LYS 74 14.685 7.113 -21.811 1.00 0.00 ATOM 555 C LYS 74 13.830 6.746 -21.016 1.00 0.00 ATOM 556 N ASN 75 12.713 7.425 -20.759 1.00 0.00 ATOM 557 CA ASN 75 12.351 8.634 -21.514 1.00 0.00 ATOM 558 CB ASN 75 10.886 8.987 -21.329 1.00 0.00 ATOM 559 CG ASN 75 9.944 8.050 -22.033 1.00 0.00 ATOM 560 ND2 ASN 75 8.693 8.120 -21.657 1.00 0.00 ATOM 561 OD1 ASN 75 10.332 7.325 -22.957 1.00 0.00 ATOM 562 O ASN 75 12.898 10.944 -21.728 1.00 0.00 ATOM 563 C ASN 75 13.182 9.877 -21.186 1.00 0.00 ATOM 564 N GLY 76 14.036 9.749 -20.186 1.00 0.00 ATOM 565 CA GLY 76 14.912 10.849 -19.748 1.00 0.00 ATOM 566 O GLY 76 14.860 12.753 -18.299 1.00 0.00 ATOM 567 C GLY 76 14.321 11.700 -18.616 1.00 0.00 ATOM 568 N VAL 77 13.235 11.243 -18.009 1.00 0.00 ATOM 569 CA VAL 77 12.697 11.911 -16.809 1.00 0.00 ATOM 570 CB VAL 77 11.292 11.399 -16.448 1.00 0.00 ATOM 571 CG1 VAL 77 10.766 12.017 -15.142 1.00 0.00 ATOM 572 CG2 VAL 77 10.321 11.732 -17.571 1.00 0.00 ATOM 573 O VAL 77 13.985 10.345 -15.647 1.00 0.00 ATOM 574 C VAL 77 13.681 11.529 -15.713 1.00 0.00 ATOM 575 N ALA 78 14.236 12.546 -15.046 1.00 0.00 ATOM 576 CA ALA 78 15.233 12.424 -13.975 1.00 0.00 ATOM 577 CB ALA 78 16.051 13.728 -13.980 1.00 0.00 ATOM 578 O ALA 78 14.562 12.993 -11.726 1.00 0.00 ATOM 579 C ALA 78 14.617 12.112 -12.589 1.00 0.00 ATOM 580 N PRO 79 14.266 10.852 -12.304 1.00 0.00 ATOM 581 CA PRO 79 13.768 10.486 -10.988 1.00 0.00 ATOM 582 CB PRO 79 12.951 9.236 -11.297 1.00 0.00 ATOM 583 CG PRO 79 13.747 8.511 -12.361 1.00 0.00 ATOM 584 CD PRO 79 14.430 9.636 -13.116 1.00 0.00 ATOM 585 O PRO 79 15.978 9.593 -10.523 1.00 0.00 ATOM 586 C PRO 79 15.030 10.271 -10.127 1.00 0.00 ATOM 587 N LYS 80 15.117 11.037 -9.051 1.00 0.00 ATOM 588 CA LYS 80 16.271 10.967 -8.126 1.00 0.00 ATOM 589 CB LYS 80 16.713 12.371 -7.712 1.00 0.00 ATOM 590 CG LYS 80 17.241 13.227 -8.855 1.00 0.00 ATOM 591 CD LYS 80 17.706 14.588 -8.359 1.00 0.00 ATOM 592 CE LYS 80 18.232 15.446 -9.501 1.00 0.00 ATOM 593 NZ LYS 80 18.623 16.806 -9.042 1.00 0.00 ATOM 594 O LYS 80 16.880 9.684 -6.198 1.00 0.00 ATOM 595 C LYS 80 15.969 10.142 -6.881 1.00 0.00 ATOM 596 N ALA 81 14.700 10.029 -6.537 1.00 0.00 ATOM 597 CA ALA 81 14.294 9.247 -5.358 1.00 0.00 ATOM 598 CB ALA 81 14.711 9.931 -4.054 1.00 0.00 ATOM 599 O ALA 81 12.063 9.492 -6.162 1.00 0.00 ATOM 600 C ALA 81 12.799 9.023 -5.296 1.00 0.00 ATOM 601 N ILE 82 12.443 8.139 -4.382 1.00 0.00 ATOM 602 CA ILE 82 11.035 7.834 -4.107 1.00 0.00 ATOM 603 CB ILE 82 10.570 6.561 -4.840 1.00 0.00 ATOM 604 CG1 ILE 82 10.778 6.717 -6.351 1.00 0.00 ATOM 605 CG2 ILE 82 9.121 6.162 -4.537 1.00 0.00 ATOM 606 CD1 ILE 82 10.531 5.411 -7.082 1.00 0.00 ATOM 607 O ILE 82 11.592 7.238 -1.824 1.00 0.00 ATOM 608 C ILE 82 10.776 7.720 -2.605 1.00 0.00 ATOM 609 N ILE 83 9.563 8.128 -2.255 1.00 0.00 ATOM 610 CA ILE 83 9.022 8.007 -0.907 1.00 0.00 ATOM 611 CB ILE 83 8.725 9.387 -0.292 1.00 0.00 ATOM 612 CG1 ILE 83 10.006 10.222 -0.209 1.00 0.00 ATOM 613 CG2 ILE 83 8.097 9.233 1.085 1.00 0.00 ATOM 614 CD1 ILE 83 9.774 11.657 0.202 1.00 0.00 ATOM 615 O ILE 83 6.800 7.505 -1.702 1.00 0.00 ATOM 616 C ILE 83 7.743 7.157 -0.977 1.00 0.00 ATOM 617 N ASN 84 7.774 6.023 -0.293 1.00 0.00 ATOM 618 CA ASN 84 6.642 5.078 -0.288 1.00 0.00 ATOM 619 CB ASN 84 7.080 3.684 -0.700 1.00 0.00 ATOM 620 CG ASN 84 7.764 3.636 -2.038 1.00 0.00 ATOM 621 ND2 ASN 84 9.059 3.448 -2.004 1.00 0.00 ATOM 622 OD1 ASN 84 7.119 3.695 -3.091 1.00 0.00 ATOM 623 O ASN 84 6.524 4.813 2.103 1.00 0.00 ATOM 624 C ASN 84 5.922 4.985 1.044 1.00 0.00 ATOM 625 N LYS 85 4.608 4.864 0.924 1.00 0.00 ATOM 626 CA LYS 85 3.754 4.651 2.094 1.00 0.00 ATOM 627 CB LYS 85 2.282 4.833 1.723 1.00 0.00 ATOM 628 CG LYS 85 1.311 4.635 2.879 1.00 0.00 ATOM 629 CD LYS 85 1.522 5.681 3.964 1.00 0.00 ATOM 630 CE LYS 85 0.354 5.711 4.940 1.00 0.00 ATOM 631 NZ LYS 85 0.274 4.465 5.750 1.00 0.00 ATOM 632 O LYS 85 4.116 3.137 3.929 1.00 0.00 ATOM 633 C LYS 85 3.977 3.254 2.703 1.00 0.00 ATOM 634 N LYS 86 3.872 2.260 1.843 1.00 0.00 ATOM 635 CA LYS 86 4.020 0.852 2.244 1.00 0.00 ATOM 636 CB LYS 86 3.474 -0.075 1.157 1.00 0.00 ATOM 637 CG LYS 86 4.321 -0.127 -0.109 1.00 0.00 ATOM 638 CD LYS 86 4.050 1.071 -1.006 1.00 0.00 ATOM 639 CE LYS 86 4.859 0.995 -2.292 1.00 0.00 ATOM 640 NZ LYS 86 4.534 2.111 -3.222 1.00 0.00 ATOM 641 O LYS 86 6.392 1.149 2.105 1.00 0.00 ATOM 642 C LYS 86 5.477 0.472 2.550 1.00 0.00 ATOM 643 N THR 87 5.603 -0.761 3.042 1.00 0.00 ATOM 644 CA THR 87 6.909 -1.391 3.289 1.00 0.00 ATOM 645 CB THR 87 6.846 -2.378 4.470 1.00 0.00 ATOM 646 CG2 THR 87 8.169 -3.113 4.621 1.00 0.00 ATOM 647 OG1 THR 87 6.560 -1.663 5.679 1.00 0.00 ATOM 648 O THR 87 7.614 -3.360 2.047 1.00 0.00 ATOM 649 C THR 87 7.430 -2.136 2.056 1.00 0.00 ATOM 650 N GLU 88 7.515 -1.423 0.946 1.00 0.00 ATOM 651 CA GLU 88 8.058 -2.088 -0.241 1.00 0.00 ATOM 652 CB GLU 88 6.965 -2.279 -1.295 1.00 0.00 ATOM 653 CG GLU 88 5.865 -3.249 -0.891 1.00 0.00 ATOM 654 CD GLU 88 4.980 -3.588 -2.058 1.00 0.00 ATOM 655 OE1 GLU 88 5.486 -4.067 -3.044 1.00 0.00 ATOM 656 OE2 GLU 88 3.783 -3.473 -1.924 1.00 0.00 ATOM 657 O GLU 88 9.606 -1.687 -2.042 1.00 0.00 ATOM 658 C GLU 88 9.247 -1.353 -0.906 1.00 0.00 ATOM 659 N THR 89 10.027 -0.603 -0.133 1.00 0.00 ATOM 660 CA THR 89 11.248 0.119 -0.614 1.00 0.00 ATOM 661 CB THR 89 11.971 0.838 0.540 1.00 0.00 ATOM 662 CG2 THR 89 11.210 2.091 0.948 1.00 0.00 ATOM 663 OG1 THR 89 12.072 -0.043 1.666 1.00 0.00 ATOM 664 O THR 89 12.740 -0.553 -2.408 1.00 0.00 ATOM 665 C THR 89 12.251 -0.812 -1.303 1.00 0.00 ATOM 666 N ILE 90 12.645 -1.858 -0.586 1.00 0.00 ATOM 667 CA ILE 90 13.614 -2.794 -1.166 1.00 0.00 ATOM 668 CB ILE 90 14.031 -3.802 -0.092 1.00 0.00 ATOM 669 CG1 ILE 90 14.823 -3.123 1.017 1.00 0.00 ATOM 670 CG2 ILE 90 15.009 -4.760 -0.719 1.00 0.00 ATOM 671 CD1 ILE 90 14.969 -4.084 2.188 1.00 0.00 ATOM 672 O ILE 90 13.771 -3.658 -3.407 1.00 0.00 ATOM 673 C ILE 90 13.056 -3.478 -2.419 1.00 0.00 ATOM 674 N ILE 91 11.775 -3.850 -2.363 1.00 0.00 ATOM 675 CA ILE 91 11.116 -4.524 -3.505 1.00 0.00 ATOM 676 CB ILE 91 9.634 -4.820 -3.208 1.00 0.00 ATOM 677 CG1 ILE 91 9.511 -5.877 -2.109 1.00 0.00 ATOM 678 CG2 ILE 91 8.919 -5.273 -4.473 1.00 0.00 ATOM 679 CD1 ILE 91 8.108 -6.033 -1.567 1.00 0.00 ATOM 680 O ILE 91 11.568 -4.146 -5.848 1.00 0.00 ATOM 681 C ILE 91 11.227 -3.660 -4.765 1.00 0.00 ATOM 682 N ALA 92 10.920 -2.393 -4.596 1.00 0.00 ATOM 683 CA ALA 92 10.912 -1.464 -5.733 1.00 0.00 ATOM 684 CB ALA 92 10.166 -0.243 -5.239 1.00 0.00 ATOM 685 O ALA 92 12.544 -1.295 -7.485 1.00 0.00 ATOM 686 C ALA 92 12.327 -1.179 -6.279 1.00 0.00 ATOM 687 N VAL 93 13.287 -0.936 -5.381 1.00 0.00 ATOM 688 CA VAL 93 14.720 -0.707 -5.761 1.00 0.00 ATOM 689 CB VAL 93 15.721 -0.469 -4.598 1.00 0.00 ATOM 690 CG1 VAL 93 17.168 -0.346 -5.080 1.00 0.00 ATOM 691 CG2 VAL 93 15.698 0.910 -3.978 1.00 0.00 ATOM 692 O VAL 93 15.959 -1.745 -7.517 1.00 0.00 ATOM 693 C VAL 93 15.272 -1.933 -6.515 1.00 0.00 ATOM 694 N GLY 94 15.069 -3.117 -5.941 1.00 0.00 ATOM 695 CA GLY 94 15.594 -4.371 -6.500 1.00 0.00 ATOM 696 O GLY 94 15.934 -5.185 -8.741 1.00 0.00 ATOM 697 C GLY 94 15.213 -4.552 -7.979 1.00 0.00 ATOM 698 N ALA 95 14.149 -3.861 -8.394 1.00 0.00 ATOM 699 CA ALA 95 13.633 -3.938 -9.768 1.00 0.00 ATOM 700 CB ALA 95 12.133 -4.250 -9.686 1.00 0.00 ATOM 701 O ALA 95 13.426 -2.727 -11.818 1.00 0.00 ATOM 702 C ALA 95 13.853 -2.714 -10.668 1.00 0.00 ATOM 703 N ALA 96 14.435 -1.649 -10.146 1.00 0.00 ATOM 704 CA ALA 96 14.670 -0.421 -10.929 1.00 0.00 ATOM 705 CB ALA 96 14.835 0.722 -9.936 1.00 0.00 ATOM 706 O ALA 96 16.781 -1.339 -11.672 1.00 0.00 ATOM 707 C ALA 96 15.861 -0.552 -11.892 1.00 0.00 ATOM 708 N MET 97 15.889 0.326 -12.878 1.00 0.00 ATOM 709 CA MET 97 16.921 0.357 -13.939 1.00 0.00 ATOM 710 CB MET 97 16.521 1.343 -15.035 1.00 0.00 ATOM 711 CG MET 97 17.454 1.359 -16.238 1.00 0.00 ATOM 712 SD MET 97 16.892 2.478 -17.537 1.00 0.00 ATOM 713 CE MET 97 18.193 2.268 -18.749 1.00 0.00 ATOM 714 O MET 97 19.256 0.496 -13.876 1.00 0.00 ATOM 715 C MET 97 18.237 0.731 -13.278 1.00 0.00 ATOM 716 N ALA 98 18.141 1.542 -12.236 1.00 0.00 ATOM 717 CA ALA 98 19.280 1.942 -11.412 1.00 0.00 ATOM 718 CB ALA 98 19.906 3.223 -11.940 1.00 0.00 ATOM 719 O ALA 98 17.667 2.509 -9.711 1.00 0.00 ATOM 720 C ALA 98 18.822 2.164 -9.978 1.00 0.00 ATOM 721 N GLU 99 19.736 1.890 -9.061 1.00 0.00 ATOM 722 CA GLU 99 19.472 2.061 -7.621 1.00 0.00 ATOM 723 CB GLU 99 20.656 1.552 -6.796 1.00 0.00 ATOM 724 CG GLU 99 20.442 1.605 -5.290 1.00 0.00 ATOM 725 CD GLU 99 21.622 1.042 -4.549 1.00 0.00 ATOM 726 OE1 GLU 99 22.554 0.619 -5.191 1.00 0.00 ATOM 727 OE2 GLU 99 21.643 1.136 -3.345 1.00 0.00 ATOM 728 O GLU 99 19.843 4.456 -7.731 1.00 0.00 ATOM 729 C GLU 99 19.184 3.528 -7.282 1.00 0.00 ATOM 730 N ILE 100 18.125 3.693 -6.504 1.00 0.00 ATOM 731 CA ILE 100 17.690 5.023 -6.038 1.00 0.00 ATOM 732 CB ILE 100 16.448 5.513 -6.805 1.00 0.00 ATOM 733 CG1 ILE 100 15.337 4.461 -6.750 1.00 0.00 ATOM 734 CG2 ILE 100 16.808 5.837 -8.247 1.00 0.00 ATOM 735 CD1 ILE 100 14.077 4.865 -7.481 1.00 0.00 ATOM 736 O ILE 100 16.912 3.949 -4.053 1.00 0.00 ATOM 737 C ILE 100 17.387 4.982 -4.540 1.00 0.00 ATOM 738 N PRO 101 17.543 6.103 -3.835 1.00 0.00 ATOM 739 CA PRO 101 17.166 6.161 -2.427 1.00 0.00 ATOM 740 CB PRO 101 17.773 7.474 -1.933 1.00 0.00 ATOM 741 CG PRO 101 17.750 8.374 -3.159 1.00 0.00 ATOM 742 CD PRO 101 18.054 7.417 -4.298 1.00 0.00 ATOM 743 O PRO 101 14.903 6.899 -2.910 1.00 0.00 ATOM 744 C PRO 101 15.639 6.091 -2.327 1.00 0.00 ATOM 745 N LEU 102 15.168 5.076 -1.620 1.00 0.00 ATOM 746 CA LEU 102 13.718 4.937 -1.438 1.00 0.00 ATOM 747 CB LEU 102 13.210 3.640 -2.015 1.00 0.00 ATOM 748 CG LEU 102 13.499 3.305 -3.449 1.00 0.00 ATOM 749 CD1 LEU 102 12.763 1.999 -3.665 1.00 0.00 ATOM 750 CD2 LEU 102 12.786 4.323 -4.285 1.00 0.00 ATOM 751 O LEU 102 13.989 4.299 0.856 1.00 0.00 ATOM 752 C LEU 102 13.365 4.958 0.046 1.00 0.00 ATOM 753 N VAL 103 12.456 5.843 0.408 1.00 0.00 ATOM 754 CA VAL 103 12.072 6.046 1.823 1.00 0.00 ATOM 755 CB VAL 103 12.000 7.542 2.179 1.00 0.00 ATOM 756 CG1 VAL 103 11.699 7.722 3.660 1.00 0.00 ATOM 757 CG2 VAL 103 13.300 8.240 1.813 1.00 0.00 ATOM 758 O VAL 103 9.714 5.839 1.588 1.00 0.00 ATOM 759 C VAL 103 10.726 5.395 2.131 1.00 0.00 ATOM 760 N GLU 104 10.719 4.542 3.143 1.00 0.00 ATOM 761 CA GLU 104 9.462 3.976 3.670 1.00 0.00 ATOM 762 CB GLU 104 9.686 2.546 4.167 1.00 0.00 ATOM 763 CG GLU 104 8.406 1.769 4.444 1.00 0.00 ATOM 764 CD GLU 104 8.688 0.510 5.216 1.00 0.00 ATOM 765 OE1 GLU 104 9.434 -0.306 4.734 1.00 0.00 ATOM 766 OE2 GLU 104 8.247 0.415 6.337 1.00 0.00 ATOM 767 O GLU 104 9.476 4.917 5.887 1.00 0.00 ATOM 768 C GLU 104 8.932 4.860 4.786 1.00 0.00 ATOM 769 N VAL 105 7.786 5.477 4.522 1.00 0.00 ATOM 770 CA VAL 105 7.170 6.398 5.503 1.00 0.00 ATOM 771 CB VAL 105 5.923 7.091 4.922 1.00 0.00 ATOM 772 CG1 VAL 105 5.199 7.878 6.004 1.00 0.00 ATOM 773 CG2 VAL 105 6.310 8.005 3.770 1.00 0.00 ATOM 774 O VAL 105 6.918 6.144 7.901 1.00 0.00 ATOM 775 C VAL 105 6.788 5.636 6.777 1.00 0.00 ATOM 776 N ARG 106 6.177 4.488 6.565 1.00 0.00 ATOM 777 CA ARG 106 5.759 3.636 7.701 1.00 0.00 ATOM 778 CB ARG 106 5.075 2.357 7.238 1.00 0.00 ATOM 779 CG ARG 106 4.439 1.535 8.348 1.00 0.00 ATOM 780 CD ARG 106 3.722 0.322 7.878 1.00 0.00 ATOM 781 NE ARG 106 3.131 -0.478 8.938 1.00 0.00 ATOM 782 CZ ARG 106 2.432 -1.613 8.742 1.00 0.00 ATOM 783 NH1 ARG 106 2.200 -2.064 7.529 1.00 0.00 ATOM 784 NH2 ARG 106 1.963 -2.249 9.801 1.00 0.00 ATOM 785 O ARG 106 6.804 3.553 9.843 1.00 0.00 ATOM 786 C ARG 106 6.937 3.330 8.639 1.00 0.00 ATOM 787 N ASP 107 8.045 2.877 8.054 1.00 0.00 ATOM 788 CA ASP 107 9.349 2.559 8.692 1.00 0.00 ATOM 789 CB ASP 107 10.375 2.139 7.636 1.00 0.00 ATOM 790 CG ASP 107 11.715 1.692 8.203 1.00 0.00 ATOM 791 OD1 ASP 107 11.736 0.733 8.938 1.00 0.00 ATOM 792 OD2 ASP 107 12.720 2.209 7.777 1.00 0.00 ATOM 793 O ASP 107 10.196 3.634 10.674 1.00 0.00 ATOM 794 C ASP 107 9.884 3.751 9.496 1.00 0.00 ATOM 795 N GLU 108 9.800 4.928 8.857 1.00 0.00 ATOM 796 CA GLU 108 10.301 6.169 9.456 1.00 0.00 ATOM 797 CB GLU 108 10.216 7.321 8.452 1.00 0.00 ATOM 798 CG GLU 108 10.801 8.634 8.952 1.00 0.00 ATOM 799 CD GLU 108 10.683 9.715 7.913 1.00 0.00 ATOM 800 OE1 GLU 108 11.185 9.529 6.830 1.00 0.00 ATOM 801 OE2 GLU 108 9.996 10.678 8.161 1.00 0.00 ATOM 802 O GLU 108 10.082 6.669 11.794 1.00 0.00 ATOM 803 C GLU 108 9.518 6.507 10.722 1.00 0.00 ATOM 804 N LYS 109 8.196 6.371 10.625 1.00 0.00 ATOM 805 CA LYS 109 7.297 6.606 11.765 1.00 0.00 ATOM 806 CB LYS 109 5.823 6.603 11.346 1.00 0.00 ATOM 807 CG LYS 109 5.466 7.813 10.503 1.00 0.00 ATOM 808 CD LYS 109 3.993 7.756 10.165 1.00 0.00 ATOM 809 CE LYS 109 3.617 8.965 9.315 1.00 0.00 ATOM 810 NZ LYS 109 2.202 8.888 8.995 1.00 0.00 ATOM 811 O LYS 109 7.554 5.904 14.046 1.00 0.00 ATOM 812 C LYS 109 7.487 5.555 12.865 1.00 0.00 ATOM 813 N PHE 110 7.583 4.298 12.447 1.00 0.00 ATOM 814 CA PHE 110 7.783 3.152 13.352 1.00 0.00 ATOM 815 CB PHE 110 7.896 1.857 12.538 1.00 0.00 ATOM 816 CG PHE 110 8.175 0.643 13.437 1.00 0.00 ATOM 817 CD1 PHE 110 7.130 0.035 14.110 1.00 0.00 ATOM 818 CD2 PHE 110 9.463 0.157 13.585 1.00 0.00 ATOM 819 CE1 PHE 110 7.368 -1.063 14.919 1.00 0.00 ATOM 820 CE2 PHE 110 9.701 -0.941 14.394 1.00 0.00 ATOM 821 CZ PHE 110 8.656 -1.559 15.069 1.00 0.00 ATOM 822 O PHE 110 8.961 3.337 15.440 1.00 0.00 ATOM 823 C PHE 110 9.033 3.347 14.208 1.00 0.00 ATOM 824 N PHE 111 10.141 3.645 13.538 1.00 0.00 ATOM 825 CA PHE 111 11.436 3.899 14.208 1.00 0.00 ATOM 826 CB PHE 111 12.550 4.064 13.172 1.00 0.00 ATOM 827 CG PHE 111 13.903 4.308 13.859 1.00 0.00 ATOM 828 CD1 PHE 111 14.635 3.257 14.366 1.00 0.00 ATOM 829 CD2 PHE 111 14.393 5.604 13.961 1.00 0.00 ATOM 830 CE1 PHE 111 15.856 3.473 14.981 1.00 0.00 ATOM 831 CE2 PHE 111 15.632 5.825 14.560 1.00 0.00 ATOM 832 CZ PHE 111 16.364 4.764 15.069 1.00 0.00 ATOM 833 O PHE 111 11.853 4.984 16.306 1.00 0.00 ATOM 834 C PHE 111 11.395 5.088 15.169 1.00 0.00 ATOM 835 N GLU 112 10.765 6.162 14.700 1.00 0.00 ATOM 836 CA GLU 112 10.687 7.398 15.488 1.00 0.00 ATOM 837 CB GLU 112 10.052 8.522 14.692 1.00 0.00 ATOM 838 CG GLU 112 10.951 9.010 13.574 1.00 0.00 ATOM 839 CD GLU 112 10.177 9.994 12.708 1.00 0.00 ATOM 840 OE1 GLU 112 8.987 10.321 12.932 1.00 0.00 ATOM 841 OE2 GLU 112 10.803 10.478 11.775 1.00 0.00 ATOM 842 O GLU 112 10.215 7.556 17.835 1.00 0.00 ATOM 843 C GLU 112 9.815 7.211 16.723 1.00 0.00 ATOM 844 N ALA 113 8.700 6.519 16.538 1.00 0.00 ATOM 845 CA ALA 113 7.815 6.282 17.679 1.00 0.00 ATOM 846 CB ALA 113 6.509 5.690 17.243 1.00 0.00 ATOM 847 O ALA 113 8.294 5.569 19.924 1.00 0.00 ATOM 848 C ALA 113 8.467 5.386 18.727 1.00 0.00 ATOM 849 N VAL 114 9.280 4.458 18.233 1.00 0.00 ATOM 850 CA VAL 114 10.007 3.545 19.128 1.00 0.00 ATOM 851 CB VAL 114 10.654 2.439 18.295 1.00 0.00 ATOM 852 CG1 VAL 114 11.573 1.596 19.143 1.00 0.00 ATOM 853 CG2 VAL 114 9.640 1.429 17.764 1.00 0.00 ATOM 854 O VAL 114 11.238 4.104 21.113 1.00 0.00 ATOM 855 C VAL 114 11.025 4.347 19.924 1.00 0.00 ATOM 856 N LYS 115 11.740 5.203 19.216 1.00 0.00 ATOM 857 CA LYS 115 12.697 6.064 19.893 1.00 0.00 ATOM 858 CB LYS 115 13.874 6.386 18.971 1.00 0.00 ATOM 859 CG LYS 115 14.606 5.163 18.434 1.00 0.00 ATOM 860 CD LYS 115 15.245 4.362 19.559 1.00 0.00 ATOM 861 CE LYS 115 16.032 3.178 19.019 1.00 0.00 ATOM 862 NZ LYS 115 16.617 2.353 20.110 1.00 0.00 ATOM 863 O LYS 115 12.755 8.408 20.298 1.00 0.00 ATOM 864 C LYS 115 12.097 7.371 20.395 1.00 0.00 ATOM 865 N THR 116 10.906 7.323 21.011 1.00 0.00 ATOM 866 CA THR 116 10.263 8.524 21.622 1.00 0.00 ATOM 867 CB THR 116 9.306 8.157 22.764 1.00 0.00 ATOM 868 CG2 THR 116 8.600 9.399 23.315 1.00 0.00 ATOM 869 OG1 THR 116 8.378 7.169 22.309 1.00 0.00 ATOM 870 O THR 116 12.220 8.959 22.922 1.00 0.00 ATOM 871 C THR 116 11.337 9.443 22.223 1.00 0.00 ATOM 872 N GLY 117 11.366 10.669 21.698 1.00 0.00 ATOM 873 CA GLY 117 12.416 11.665 21.991 1.00 0.00 ATOM 874 O GLY 117 13.918 13.182 20.910 1.00 0.00 ATOM 875 C GLY 117 13.162 12.231 20.766 1.00 0.00 ATOM 876 N ASP 118 12.867 11.718 19.572 1.00 0.00 ATOM 877 CA ASP 118 13.486 12.205 18.322 1.00 0.00 ATOM 878 CB ASP 118 14.936 11.712 18.162 1.00 0.00 ATOM 879 CG ASP 118 15.027 10.190 17.986 1.00 0.00 ATOM 880 OD1 ASP 118 14.601 9.703 16.920 1.00 0.00 ATOM 881 OD2 ASP 118 15.604 9.553 18.882 1.00 0.00 ATOM 882 O ASP 118 11.851 10.865 17.150 1.00 0.00 ATOM 883 C ASP 118 12.686 11.764 17.084 1.00 0.00 ATOM 884 N ARG 119 12.858 12.560 16.046 1.00 0.00 ATOM 885 CA ARG 119 12.229 12.291 14.750 1.00 0.00 ATOM 886 CB ARG 119 11.066 13.232 14.469 1.00 0.00 ATOM 887 CG ARG 119 10.582 13.239 13.029 1.00 0.00 ATOM 888 CD ARG 119 9.651 14.349 12.700 1.00 0.00 ATOM 889 NE ARG 119 8.346 14.248 13.335 1.00 0.00 ATOM 890 CZ ARG 119 7.459 15.259 13.423 1.00 0.00 ATOM 891 NH1 ARG 119 7.743 16.453 12.953 1.00 0.00 ATOM 892 NH2 ARG 119 6.302 15.023 14.016 1.00 0.00 ATOM 893 O ARG 119 14.100 13.273 13.580 1.00 0.00 ATOM 894 C ARG 119 13.304 12.334 13.660 1.00 0.00 ATOM 895 N VAL 120 13.239 11.329 12.810 1.00 0.00 ATOM 896 CA VAL 120 14.062 11.259 11.606 1.00 0.00 ATOM 897 CB VAL 120 14.280 9.797 11.225 1.00 0.00 ATOM 898 CG1 VAL 120 15.163 9.715 9.983 1.00 0.00 ATOM 899 CG2 VAL 120 14.763 8.988 12.435 1.00 0.00 ATOM 900 O VAL 120 12.136 11.847 10.256 1.00 0.00 ATOM 901 C VAL 120 13.317 11.989 10.482 1.00 0.00 ATOM 902 N VAL 121 14.017 12.891 9.834 1.00 0.00 ATOM 903 CA VAL 121 13.431 13.643 8.716 1.00 0.00 ATOM 904 CB VAL 121 13.507 15.156 8.988 1.00 0.00 ATOM 905 CG1 VAL 121 12.931 15.994 7.842 1.00 0.00 ATOM 906 CG2 VAL 121 12.819 15.521 10.311 1.00 0.00 ATOM 907 O VAL 121 15.479 13.360 7.533 1.00 0.00 ATOM 908 C VAL 121 14.261 13.251 7.495 1.00 0.00 ATOM 909 N VAL 122 13.595 12.765 6.460 1.00 0.00 ATOM 910 CA VAL 122 14.316 12.359 5.240 1.00 0.00 ATOM 911 CB VAL 122 14.169 10.859 4.957 1.00 0.00 ATOM 912 CG1 VAL 122 14.973 10.485 3.720 1.00 0.00 ATOM 913 CG2 VAL 122 14.706 10.026 6.118 1.00 0.00 ATOM 914 O VAL 122 12.599 13.179 3.789 1.00 0.00 ATOM 915 C VAL 122 13.795 13.168 4.069 1.00 0.00 ATOM 916 N ASN 123 14.727 13.713 3.308 1.00 0.00 ATOM 917 CA ASN 123 14.361 14.454 2.108 1.00 0.00 ATOM 918 CB ASN 123 14.942 15.856 2.124 1.00 0.00 ATOM 919 CG ASN 123 14.444 16.706 3.260 1.00 0.00 ATOM 920 ND2 ASN 123 15.368 17.184 4.055 1.00 0.00 ATOM 921 OD1 ASN 123 13.245 16.986 3.373 1.00 0.00 ATOM 922 O ASN 123 16.033 13.589 0.651 1.00 0.00 ATOM 923 C ASN 123 14.830 13.656 0.900 1.00 0.00 ATOM 924 N ALA 124 13.920 13.032 0.196 1.00 0.00 ATOM 925 CA ALA 124 14.356 12.237 -0.961 1.00 0.00 ATOM 926 CB ALA 124 13.213 11.328 -1.348 1.00 0.00 ATOM 927 O ALA 124 15.841 12.558 -2.813 1.00 0.00 ATOM 928 C ALA 124 14.979 13.067 -2.093 1.00 0.00 ATOM 929 N ASP 125 14.691 14.365 -2.102 1.00 0.00 ATOM 930 CA ASP 125 15.190 15.350 -3.079 1.00 0.00 ATOM 931 CB ASP 125 14.438 16.675 -2.938 1.00 0.00 ATOM 932 CG ASP 125 14.717 17.679 -4.049 1.00 0.00 ATOM 933 OD1 ASP 125 14.448 17.369 -5.185 1.00 0.00 ATOM 934 OD2 ASP 125 15.048 18.799 -3.740 1.00 0.00 ATOM 935 O ASP 125 17.468 15.545 -3.892 1.00 0.00 ATOM 936 C ASP 125 16.712 15.590 -2.922 1.00 0.00 ATOM 937 N GLU 126 17.186 15.489 -1.667 1.00 0.00 ATOM 938 CA GLU 126 18.618 15.594 -1.314 1.00 0.00 ATOM 939 CB GLU 126 18.817 16.597 -0.175 1.00 0.00 ATOM 940 CG GLU 126 18.410 18.023 -0.516 1.00 0.00 ATOM 941 CD GLU 126 18.642 18.949 0.645 1.00 0.00 ATOM 942 OE1 GLU 126 19.103 18.492 1.663 1.00 0.00 ATOM 943 OE2 GLU 126 18.464 20.133 0.479 1.00 0.00 ATOM 944 O GLU 126 20.498 14.205 -0.722 1.00 0.00 ATOM 945 C GLU 126 19.280 14.269 -0.903 1.00 0.00 ATOM 946 N GLY 127 18.453 13.243 -0.714 1.00 0.00 ATOM 947 CA GLY 127 18.882 11.943 -0.164 1.00 0.00 ATOM 948 O GLY 127 20.720 11.642 1.345 1.00 0.00 ATOM 949 C GLY 127 19.606 12.133 1.170 1.00 0.00 ATOM 950 N TYR 128 19.041 12.989 2.011 1.00 0.00 ATOM 951 CA TYR 128 19.602 13.299 3.335 1.00 0.00 ATOM 952 CB TYR 128 20.065 14.757 3.392 1.00 0.00 ATOM 953 CG TYR 128 21.274 15.050 2.532 1.00 0.00 ATOM 954 CD1 TYR 128 22.138 14.036 2.147 1.00 0.00 ATOM 955 CD2 TYR 128 21.545 16.342 2.105 1.00 0.00 ATOM 956 CE1 TYR 128 23.244 14.298 1.361 1.00 0.00 ATOM 957 CE2 TYR 128 22.648 16.616 1.318 1.00 0.00 ATOM 958 CZ TYR 128 23.495 15.591 0.948 1.00 0.00 ATOM 959 OH TYR 128 24.593 15.859 0.164 1.00 0.00 ATOM 960 O TYR 128 17.409 13.327 4.341 1.00 0.00 ATOM 961 C TYR 128 18.597 13.033 4.454 1.00 0.00 ATOM 962 N VAL 129 19.151 12.488 5.529 1.00 0.00 ATOM 963 CA VAL 129 18.440 12.314 6.818 1.00 0.00 ATOM 964 CB VAL 129 18.644 10.898 7.388 1.00 0.00 ATOM 965 CG1 VAL 129 20.121 10.633 7.642 1.00 0.00 ATOM 966 CG2 VAL 129 17.845 10.720 8.671 1.00 0.00 ATOM 967 O VAL 129 20.138 13.396 8.093 1.00 0.00 ATOM 968 C VAL 129 18.947 13.363 7.803 1.00 0.00 ATOM 969 N GLU 130 17.981 13.912 8.536 1.00 0.00 ATOM 970 CA GLU 130 18.323 14.698 9.726 1.00 0.00 ATOM 971 CB GLU 130 18.044 16.183 9.485 1.00 0.00 ATOM 972 CG GLU 130 18.900 16.815 8.397 1.00 0.00 ATOM 973 CD GLU 130 18.583 18.275 8.231 1.00 0.00 ATOM 974 OE1 GLU 130 17.706 18.754 8.910 1.00 0.00 ATOM 975 OE2 GLU 130 19.290 18.938 7.508 1.00 0.00 ATOM 976 O GLU 130 16.396 13.821 10.891 1.00 0.00 ATOM 977 C GLU 130 17.555 14.214 10.945 1.00 0.00 ATOM 978 N LEU 131 18.272 14.362 12.041 1.00 0.00 ATOM 979 CA LEU 131 17.715 14.006 13.341 1.00 0.00 ATOM 980 CB LEU 131 18.627 12.996 14.051 1.00 0.00 ATOM 981 CG LEU 131 18.840 11.673 13.304 1.00 0.00 ATOM 982 CD1 LEU 131 19.829 10.799 14.064 1.00 0.00 ATOM 983 CD2 LEU 131 17.506 10.960 13.141 1.00 0.00 ATOM 984 O LEU 131 18.445 15.864 14.612 1.00 0.00 ATOM 985 C LEU 131 17.490 15.175 14.250 1.00 0.00 ATOM 986 N ILE 132 16.262 15.293 14.632 1.00 0.00 ATOM 987 CA ILE 132 15.861 16.363 15.556 1.00 0.00 ATOM 988 CB ILE 132 14.943 17.390 14.868 1.00 0.00 ATOM 989 CG1 ILE 132 15.670 18.054 13.696 1.00 0.00 ATOM 990 CG2 ILE 132 14.470 18.434 15.866 1.00 0.00 ATOM 991 CD1 ILE 132 14.775 18.908 12.827 1.00 0.00 ATOM 992 O ILE 132 14.215 14.999 16.683 1.00 0.00 ATOM 993 C ILE 132 15.146 15.805 16.782 1.00 0.00 ATOM 994 N GLU 133 15.568 16.311 17.932 1.00 0.00 ATOM 995 CA GLU 133 14.902 16.007 19.205 1.00 0.00 ATOM 996 CB GLU 133 15.706 16.570 20.379 1.00 0.00 ATOM 997 CG GLU 133 15.156 16.205 21.750 1.00 0.00 ATOM 998 CD GLU 133 16.006 16.778 22.850 1.00 0.00 ATOM 999 OE1 GLU 133 17.000 17.393 22.547 1.00 0.00 ATOM 1000 OE2 GLU 133 15.604 16.700 23.987 1.00 0.00 ATOM 1001 O GLU 133 13.281 17.808 19.203 1.00 0.00 ATOM 1002 C GLU 133 13.474 16.590 19.174 1.00 0.00 ATOM 1003 N LEU 134 12.464 15.732 19.009 1.00 0.00 ATOM 1004 CA LEU 134 11.082 16.218 18.877 1.00 0.00 ATOM 1005 CB LEU 134 10.304 15.341 17.888 1.00 0.00 ATOM 1006 CG LEU 134 10.281 15.849 16.442 1.00 0.00 ATOM 1007 CD1 LEU 134 9.325 17.028 16.318 1.00 0.00 ATOM 1008 CD2 LEU 134 11.687 16.249 16.020 1.00 0.00 ATOM 1009 O LEU 134 9.929 15.213 20.740 1.00 0.00 ATOM 1010 C LEU 134 10.359 16.254 20.232 1.00 0.00 ATOM 1011 N GLU 135 10.077 17.468 20.681 1.00 0.00 ATOM 1012 CA GLU 135 9.367 17.682 21.964 1.00 0.00 ATOM 1013 CB GLU 135 9.331 19.172 22.315 1.00 0.00 ATOM 1014 CG GLU 135 10.679 19.756 22.711 1.00 0.00 ATOM 1015 CD GLU 135 10.592 21.243 22.914 1.00 0.00 ATOM 1016 OE1 GLU 135 9.543 21.795 22.679 1.00 0.00 ATOM 1017 OE2 GLU 135 11.536 21.812 23.408 1.00 0.00 ATOM 1018 O GLU 135 7.542 16.398 22.894 1.00 0.00 ATOM 1019 C GLU 135 7.938 17.150 21.996 1.00 0.00 ATOM 1020 N HIS 136 7.212 17.427 20.914 1.00 0.00 ATOM 1021 CA HIS 136 5.801 17.018 20.767 1.00 0.00 ATOM 1022 CB HIS 136 5.182 17.651 19.516 1.00 0.00 ATOM 1023 CG HIS 136 3.738 17.305 19.319 1.00 0.00 ATOM 1024 CD2 HIS 136 3.127 16.519 18.401 1.00 0.00 ATOM 1025 ND1 HIS 136 2.738 17.794 20.133 1.00 0.00 ATOM 1026 CE1 HIS 136 1.573 17.322 19.723 1.00 0.00 ATOM 1027 NE2 HIS 136 1.782 16.548 18.676 1.00 0.00 ATOM 1028 O HIS 136 4.680 14.950 21.267 1.00 0.00 ATOM 1029 C HIS 136 5.619 15.496 20.697 1.00 0.00 ATOM 1030 N HIS 137 6.543 14.833 19.996 1.00 0.00 ATOM 1031 CA HIS 137 6.554 13.349 19.877 1.00 0.00 ATOM 1032 CB HIS 137 7.769 12.880 19.063 1.00 0.00 ATOM 1033 CG HIS 137 7.798 11.368 18.825 1.00 0.00 ATOM 1034 CD2 HIS 137 8.626 10.476 19.378 1.00 0.00 ATOM 1035 ND1 HIS 137 6.993 10.732 18.001 1.00 0.00 ATOM 1036 CE1 HIS 137 7.293 9.444 18.057 1.00 0.00 ATOM 1037 NE2 HIS 137 8.297 9.274 18.909 1.00 0.00 ATOM 1038 O HIS 137 5.847 11.808 21.573 1.00 0.00 ATOM 1039 C HIS 137 6.648 12.683 21.253 1.00 0.00 ATOM 1040 N HIS 138 7.582 13.196 22.063 1.00 0.00 ATOM 1041 CA HIS 138 7.759 12.734 23.458 1.00 0.00 ATOM 1042 CB HIS 138 8.916 13.479 24.132 1.00 0.00 ATOM 1043 CG HIS 138 9.121 13.101 25.565 1.00 0.00 ATOM 1044 CD2 HIS 138 8.835 13.762 26.712 1.00 0.00 ATOM 1045 ND1 HIS 138 9.686 11.902 25.945 1.00 0.00 ATOM 1046 CE1 HIS 138 9.741 11.843 27.264 1.00 0.00 ATOM 1047 NE2 HIS 138 9.231 12.958 27.753 1.00 0.00 ATOM 1048 O HIS 138 6.080 12.008 25.004 1.00 0.00 ATOM 1049 C HIS 138 6.483 12.912 24.284 1.00 0.00 ATOM 1050 N HIS 139 5.919 14.106 24.193 1.00 0.00 ATOM 1051 CA HIS 139 4.695 14.447 24.934 1.00 0.00 ATOM 1052 CB HIS 139 4.299 15.906 24.684 1.00 0.00 ATOM 1053 CG HIS 139 5.231 16.898 25.308 1.00 0.00 ATOM 1054 CD2 HIS 139 6.212 16.744 26.226 1.00 0.00 ATOM 1055 ND1 HIS 139 5.205 18.241 24.994 1.00 0.00 ATOM 1056 CE1 HIS 139 6.134 18.870 25.695 1.00 0.00 ATOM 1057 NE2 HIS 139 6.758 17.984 26.449 1.00 0.00 ATOM 1058 O HIS 139 2.787 13.055 25.398 1.00 0.00 ATOM 1059 C HIS 139 3.545 13.506 24.540 1.00 0.00 ATOM 1060 N HIS 140 3.390 13.337 23.221 1.00 0.00 ATOM 1061 CA HIS 140 2.355 12.468 22.624 1.00 0.00 ATOM 1062 CB HIS 140 2.485 12.442 21.098 1.00 0.00 ATOM 1063 CG HIS 140 1.510 11.524 20.427 1.00 0.00 ATOM 1064 CD2 HIS 140 1.674 10.303 19.867 1.00 0.00 ATOM 1065 ND1 HIS 140 0.175 11.838 20.277 1.00 0.00 ATOM 1066 CE1 HIS 140 -0.439 10.848 19.653 1.00 0.00 ATOM 1067 NE2 HIS 140 0.449 9.905 19.394 1.00 0.00 ATOM 1068 O HIS 140 1.403 10.461 23.493 1.00 0.00 ATOM 1069 C HIS 140 2.439 11.037 23.181 1.00 0.00 ATOM 1070 N HIS 141 3.649 10.490 23.132 1.00 0.00 ATOM 1071 CA HIS 141 3.928 9.159 23.681 1.00 0.00 ATOM 1072 CB HIS 141 5.358 8.778 23.328 1.00 0.00 ATOM 1073 CG HIS 141 5.692 7.322 23.653 1.00 0.00 ATOM 1074 CD2 HIS 141 5.451 6.246 22.900 1.00 0.00 ATOM 1075 ND1 HIS 141 6.304 6.921 24.765 1.00 0.00 ATOM 1076 CE1 HIS 141 6.507 5.619 24.645 1.00 0.00 ATOM 1077 NE2 HIS 141 5.970 5.193 23.516 1.00 0.00 ATOM 1078 O HIS 141 3.466 10.085 25.843 1.00 0.00 ATOM 1079 C HIS 141 3.696 9.046 25.194 1.00 0.00 TER END